#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gud s LEU 2 N 0.00 4.32 0.19 2.46 2.96 -1.26 -4.98 118.68 122.36 2gud s LEU 2 Ca 0.00 2.07 -0.11 0.00 -0.22 0.00 0.00 54.13 55.86 2gud s LEU 2 Cb 0.00 -3.56 -0.00 0.00 0.50 0.00 0.00 46.19 43.13 2gud s LEU 2 CO 0.00 -0.68 0.37 0.28 -1.32 0.00 0.00 176.35 175.00 2gud s THR 3 N 2.22 0.04 -0.00 3.68 -1.32 -1.26 -5.17 115.64 113.83 2gud s THR 3 Ca 0.62 -1.29 0.03 0.00 -1.21 0.00 0.00 61.69 59.84 2gud s THR 3 Cb -0.30 -1.89 -0.01 0.00 -1.51 0.00 0.00 72.50 68.79 2gud s THR 3 CO 0.26 -0.19 -0.11 -1.38 -2.21 0.00 0.00 174.62 170.99 2gud s HIS 4 N -3.97 0.97 -0.00 9.09 -3.43 -1.26 -5.15 115.29 111.54 2gud s HIS 4 Ca 0.17 -0.21 -0.00 0.00 -0.80 0.00 0.00 55.06 54.22 2gud s HIS 4 Cb 0.02 -0.61 0.00 0.00 -1.43 0.00 0.00 32.58 30.56 2gud s HIS 4 CO 0.02 -0.01 0.01 0.50 -2.00 0.00 0.00 174.74 173.25 2gud s ARG 5 N -0.40 -0.00 -0.11 -0.38 3.52 -1.26 -5.15 118.95 115.16 2gud s ARG 5 Ca 0.03 0.03 -0.06 0.00 -0.13 0.00 0.00 55.73 55.61 2gud s ARG 5 Cb -0.05 -0.04 -0.04 0.00 -1.56 0.00 0.00 34.95 33.27 2gud s ARG 5 CO -0.00 -0.03 0.11 0.21 -0.81 0.00 0.00 175.30 174.78 2gud s LYS 6 N 0.17 3.35 0.01 5.12 2.20 -1.26 -5.11 119.74 124.22 2gud s LYS 6 Ca -0.01 -0.19 0.06 0.00 -0.36 0.00 0.00 55.97 55.46 2gud s LYS 6 Cb -0.02 -3.11 -0.02 0.00 -1.51 0.00 0.00 37.83 33.17 2gud s LYS 6 CO -0.00 0.76 -0.18 -0.06 -0.36 0.00 0.00 175.35 175.51 2gud s PHE 7 N -1.01 1.56 0.00 4.03 0.40 -1.26 -5.09 117.98 116.60 2gud s PHE 7 Ca 0.15 -0.33 0.00 0.00 -0.60 0.00 0.00 56.93 56.15 2gud s PHE 7 Cb -0.12 -0.96 0.00 0.00 0.51 0.00 0.00 43.02 42.45 2gud s PHE 7 CO 0.04 0.02 0.00 0.41 0.70 0.00 0.00 175.22 176.39 2gud n GLY 8 N 2.28 -1.74 0.00 4.36 0.00 -1.26 -5.07 105.19 103.76 2gud n GLY 8 Ca -0.16 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 43.82 2gud n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gud n GLY 9 N 0.00 3.62 0.28 -0.02 0.00 -1.26 -5.05 105.19 102.76 2gud n GLY 9 Ca 0.00 -2.05 0.11 0.00 0.00 0.00 0.00 46.02 44.08 2gud n GLY 9 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2gud n SER 10 N -0.24 1.45 -3.25 1.61 3.41 -1.26 -5.01 113.62 110.34 2gud n SER 10 Ca 0.00 -1.16 -0.13 0.00 -0.26 0.00 0.00 58.87 57.33 2gud n SER 10 Cb 0.00 0.51 0.07 0.00 -0.26 0.00 0.00 64.21 64.54 2gud n SER 10 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gud n GLY 11 N 1.43 0.24 0.00 5.00 0.00 -1.26 -5.03 105.19 105.58 2gud n GLY 11 Ca 0.08 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.18 2gud n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gud n GLY 12 N 0.89 -1.11 3.67 -0.02 0.00 -1.26 -4.93 105.19 102.43 2gud n GLY 12 Ca 0.09 -1.61 -0.33 0.00 0.00 0.00 0.00 46.02 44.16 2gud n GLY 12 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2gud s SER 13 N -2.20 5.11 0.54 1.61 1.04 -1.26 -5.09 113.70 113.45 2gud s SER 13 Ca 0.00 0.04 -0.20 0.00 0.48 0.00 0.00 55.95 56.27 2gud s SER 13 Cb 0.00 -1.36 -0.06 0.00 0.10 0.00 0.00 66.02 64.70 2gud s SER 13 CO 0.00 0.32 1.16 -2.16 0.98 0.00 0.00 173.24 173.54 2gud s PRO 14 N -1.28 3.33 0.08 4.02 0.04 -1.26 -5.02 135.00 134.91 2gud s PRO 14 Ca 0.17 1.71 -0.01 0.00 0.04 0.00 0.00 61.00 62.92 2gud s PRO 14 Cb -0.11 -2.07 -0.04 0.00 0.04 0.00 0.00 34.50 32.32 2gud s PRO 14 CO 0.07 -0.89 -0.02 -0.59 0.04 0.00 0.00 177.00 175.61 2gud s PHE 15 N -1.67 0.66 0.05 0.56 -0.12 -1.26 -3.66 117.98 112.53 2gud s PHE 15 Ca 0.72 -1.08 0.08 0.00 -0.05 0.00 0.00 56.93 56.60 2gud s PHE 15 Cb -0.27 -0.44 -0.03 0.00 -0.63 0.00 0.00 43.02 41.65 2gud s PHE 15 CO 0.30 -0.37 -0.20 -1.54 -0.05 0.00 0.00 175.22 173.36 2gud s SER 16 N -2.97 3.65 0.44 1.98 1.04 -1.26 -4.97 113.70 111.61 2gud s SER 16 Ca 0.11 -0.47 0.11 0.00 0.48 0.00 0.00 55.95 56.18 2gud s SER 16 Cb 0.07 -0.53 0.98 0.00 0.10 0.00 0.00 66.02 66.64 2gud s SER 16 CO -0.07 0.25 2.05 1.23 0.98 0.00 0.00 173.24 177.68 2gud h GLY 17 N 4.55 0.28 -7.18 7.32 0.00 -2.01 -3.36 103.07 102.68 2gud h GLY 17 Ca -0.48 -0.12 -0.58 0.00 0.00 0.00 0.00 47.33 46.15 2gud h GLY 17 CO 0.46 0.12 0.79 -2.27 0.00 0.00 0.00 176.54 175.64 2gud s LEU 18 N -9.13 3.76 -0.22 3.11 2.96 -1.26 -4.86 118.68 113.04 2gud s LEU 18 Ca -0.06 -0.43 0.06 0.00 -0.22 0.00 0.00 54.13 53.48 2gud s LEU 18 Cb 0.17 -2.73 -0.17 0.00 0.50 0.00 0.00 46.19 43.95 2gud s LEU 18 CO 0.71 -1.50 -0.12 -1.54 -1.32 0.00 0.00 176.35 172.58 2gud n SER 19 N 8.27 1.66 -3.74 3.68 3.41 -1.26 -4.80 113.62 120.83 2gud n SER 19 Ca 0.02 -0.09 -0.13 0.00 -0.26 0.00 0.00 58.87 58.42 2gud n SER 19 Cb 0.48 0.05 -0.08 0.00 -0.26 0.00 0.00 64.21 64.40 2gud n SER 19 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2gud s SER 20 N -5.92 -0.18 -0.01 4.04 1.04 -1.26 -1.00 113.70 110.39 2gud s SER 20 Ca -0.24 -0.02 0.00 0.00 0.48 0.00 0.00 55.95 56.18 2gud s SER 20 Cb 0.07 0.35 0.01 0.00 0.10 0.00 0.00 66.02 66.55 2gud s SER 20 CO 0.60 -0.54 -0.01 -0.63 0.98 0.00 0.00 173.24 173.65 2gud s ILE 21 N -1.91 0.14 0.20 -1.02 1.01 -0.21 -0.96 121.20 118.45 2gud s ILE 21 Ca -0.09 0.02 0.00 0.00 0.00 0.00 0.00 60.65 60.57 2gud s ILE 21 Cb -0.03 -0.18 -0.04 0.00 0.01 0.00 0.00 42.46 42.21 2gud s ILE 21 CO 0.01 0.09 0.08 0.00 0.00 0.00 0.00 174.94 175.12 2gud s ALA 22 N 0.50 1.29 0.13 9.38 0.00 -0.55 -0.58 121.76 131.92 2gud s ALA 22 Ca -0.05 -1.68 0.03 0.00 0.00 0.00 0.00 51.96 50.27 2gud s ALA 22 Cb -0.07 1.05 -0.04 0.00 0.00 0.00 0.00 23.12 24.05 2gud s ALA 22 CO -0.01 -0.49 -0.09 0.14 0.00 0.00 0.00 175.76 175.31 2gud s VAL 23 N -3.95 0.98 -0.16 0.00 -7.23 -1.26 -0.41 120.40 108.37 2gud s VAL 23 Ca 0.33 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.44 2gud s VAL 23 Cb 0.07 -1.77 -0.04 0.00 0.56 0.00 0.00 36.38 35.21 2gud s VAL 23 CO 0.09 -0.79 0.05 -0.13 -0.31 0.00 0.00 175.10 174.01 2gud s ARG 24 N -3.74 3.81 0.03 4.82 0.52 -0.43 -0.39 118.95 123.57 2gud s ARG 24 Ca 0.14 -0.35 -0.05 0.00 -0.52 0.00 0.00 55.73 54.95 2gud s ARG 24 Cb 0.03 -3.14 -0.01 0.00 0.52 0.00 0.00 34.95 32.36 2gud s ARG 24 CO -0.01 0.35 0.09 -1.54 0.02 0.00 0.00 175.30 174.21 2gud s SER 25 N 0.14 0.15 0.00 0.23 1.04 -0.32 -0.57 113.70 114.36 2gud s SER 25 Ca 0.04 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.03 2gud s SER 25 Cb -0.12 0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.20 2gud s SER 25 CO 0.01 -0.44 0.00 0.61 0.98 0.00 0.00 173.24 174.40 2gud n GLY 26 N 1.07 2.82 0.22 7.32 0.00 -1.26 -0.54 105.19 114.81 2gud n GLY 26 Ca -0.21 -0.27 -0.04 0.00 0.00 0.00 0.00 46.02 45.51 2gud n GLY 26 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2gud h SER 27 N 0.00 0.44 -4.64 1.61 0.02 -1.92 -3.20 113.55 105.86 2gud h SER 27 Ca 0.00 -0.16 -0.53 0.00 -0.84 0.00 0.00 61.79 60.25 2gud h SER 27 Cb 0.00 -0.12 -0.10 0.00 0.14 0.00 0.00 62.40 62.32 2gud h SER 27 CO 0.00 0.74 -0.40 -1.22 -1.14 0.00 0.00 176.83 174.81 2gud n TYR 28 N -4.08 0.79 -2.80 3.45 4.01 -1.26 -1.51 117.16 115.75 2gud n TYR 28 Ca -0.01 -2.11 -0.43 0.00 -0.16 0.00 0.00 57.90 55.19 2gud n TYR 28 Cb 0.44 -0.22 -0.04 0.00 -0.31 0.00 0.00 39.34 39.21 2gud n TYR 28 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2gud s LEU 29 N 0.00 3.98 0.28 7.72 2.01 -0.05 -4.37 118.68 128.25 2gud s LEU 29 Ca 0.04 0.08 0.04 0.00 0.01 0.00 0.00 54.13 54.29 2gud s LEU 29 Cb 0.00 -3.17 0.39 0.00 0.01 0.00 0.00 46.19 43.43 2gud s LEU 29 CO 0.03 -1.10 1.68 0.44 1.01 0.00 0.00 176.35 178.41 2gud h ASP 30 N 9.13 0.37 -4.93 2.29 5.19 -1.14 -0.38 116.42 126.96 2gud h ASP 30 Ca -0.24 -0.15 -0.01 0.00 -0.62 0.00 0.00 57.03 56.00 2gud h ASP 30 Cb 1.07 -0.10 -0.15 0.00 0.18 0.00 0.00 39.33 40.33 2gud h ASP 30 CO 1.05 0.72 0.25 0.00 -3.12 0.00 0.00 179.24 178.13 2gud s ALA 31 N -4.23 -1.68 -0.01 3.45 0.00 -0.98 -1.10 121.76 117.20 2gud s ALA 31 Ca -0.06 0.82 0.08 0.00 0.00 0.00 0.00 51.96 52.80 2gud s ALA 31 Cb 0.13 0.53 -0.02 0.00 0.00 0.00 0.00 23.12 23.76 2gud s ALA 31 CO 0.79 -0.63 -0.24 -1.50 0.00 0.00 0.00 175.76 174.17 2gud s ILE 32 N -2.86 1.92 -0.28 0.00 2.07 -0.36 -1.31 121.20 120.38 2gud s ILE 32 Ca -0.02 -1.06 0.01 0.00 -1.41 0.00 0.00 60.65 58.16 2gud s ILE 32 Cb -0.01 -1.60 0.05 0.00 0.13 0.00 0.00 42.46 41.04 2gud s ILE 32 CO -0.06 0.52 -0.06 -0.63 -1.91 0.00 0.00 174.94 172.80 2gud s ILE 33 N -0.59 2.53 -0.26 2.00 1.01 0.45 -0.74 121.20 125.60 2gud s ILE 33 Ca 0.09 -1.51 -0.04 0.00 0.00 0.00 0.00 60.65 59.19 2gud s ILE 33 Cb -0.09 -2.47 0.01 0.00 0.01 0.00 0.00 42.46 39.92 2gud s ILE 33 CO -0.01 -0.05 -0.00 -0.63 0.00 0.00 0.00 174.94 174.25 2gud s ILE 34 N 1.17 3.41 -1.49 2.92 -1.09 -0.23 -1.49 121.20 124.41 2gud s ILE 34 Ca -0.07 -0.78 -0.12 0.00 -2.23 0.00 0.00 60.65 57.45 2gud s ILE 34 Cb -0.20 -2.71 0.07 0.00 -1.58 0.00 0.00 42.46 38.05 2gud s ILE 34 CO -0.03 0.20 0.87 0.47 -1.23 0.00 0.00 174.94 175.21 2gud n ASP 35 N 4.77 -4.87 0.00 3.58 8.00 -0.13 -1.20 116.55 126.70 2gud n ASP 35 Ca -0.16 -0.64 0.00 0.00 0.71 0.00 0.00 54.79 54.70 2gud n ASP 35 Cb 0.48 -3.91 0.00 0.00 -0.02 0.00 0.00 41.12 37.67 2gud n ASP 35 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2gud n GLY 36 N -1.60 1.89 3.65 0.44 0.00 -1.26 -5.00 105.19 103.32 2gud n GLY 36 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 2gud n GLY 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gud s VAL 37 N -2.68 5.18 0.01 1.61 1.01 -0.34 -5.05 120.40 120.15 2gud s VAL 37 Ca 0.00 0.68 -0.26 0.00 0.00 0.00 0.00 61.98 62.40 2gud s VAL 37 Cb 0.00 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 2gud s VAL 37 CO 0.00 0.22 0.83 -2.28 0.00 0.00 0.00 175.10 173.86 2gud s HIS 38 N 1.57 3.68 -0.26 5.22 2.46 -1.26 -1.07 115.29 125.64 2gud s HIS 38 Ca 0.18 1.51 -0.01 0.00 0.47 0.00 0.00 55.06 57.21 2gud s HIS 38 Cb -0.15 -2.92 0.08 0.00 -0.13 0.00 0.00 32.58 29.46 2gud s HIS 38 CO 0.08 0.14 0.06 -1.01 -2.47 0.00 0.00 174.74 171.54 2gud s HIS 39 N 0.45 1.57 -3.27 3.88 3.76 0.08 -5.00 115.29 116.75 2gud s HIS 39 Ca 0.43 -1.45 0.00 0.00 -0.15 0.00 0.00 55.06 53.89 2gud s HIS 39 Cb -0.20 -1.47 0.00 0.00 1.11 0.00 0.00 32.58 32.02 2gud s HIS 39 CO 0.24 -0.77 0.00 0.41 -0.85 0.00 0.00 174.74 173.76 2gud n GLY 40 N 4.89 0.82 0.00 -2.22 0.00 -1.26 -1.22 105.19 106.20 2gud n GLY 40 Ca -0.06 -2.03 0.00 0.00 0.00 0.00 0.00 46.02 43.94 2gud n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gud n GLY 41 N 0.00 1.60 0.68 -0.02 0.00 -0.26 -4.84 105.19 102.35 2gud n GLY 41 Ca 0.00 -2.05 0.07 0.00 0.00 0.00 0.00 46.02 44.04 2gud n GLY 41 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2gud n SER 42 N -2.06 2.61 -3.15 1.61 3.41 -1.26 -4.58 113.62 110.19 2gud n SER 42 Ca 0.00 -1.76 -0.18 0.00 -0.26 0.00 0.00 58.87 56.67 2gud n SER 42 Cb 0.00 -0.12 0.13 0.00 -0.26 0.00 0.00 64.21 63.96 2gud n SER 42 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gud n GLY 43 N 0.81 -1.61 7.00 5.00 0.00 -1.26 -4.90 105.19 110.23 2gud n GLY 43 Ca 0.11 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.48 2gud n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gud n GLY 44 N -0.61 0.34 3.08 -0.02 0.00 -1.26 -4.54 105.19 102.18 2gud n GLY 44 Ca 0.10 -0.93 -0.19 0.00 0.00 0.00 0.00 46.02 45.00 2gud n GLY 44 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2gud s ASN 45 N -4.00 1.37 -0.03 1.61 0.01 0.29 -4.80 114.94 109.39 2gud s ASN 45 Ca 0.00 -0.32 -0.30 0.00 -0.71 0.00 0.00 52.86 51.54 2gud s ASN 45 Cb 0.00 -0.11 -0.03 0.00 0.41 0.00 0.00 41.25 41.52 2gud s ASN 45 CO 0.00 0.07 1.06 -0.22 -1.51 0.00 0.00 177.10 176.50 2gud s LEU 46 N -0.67 4.32 0.74 0.60 2.96 -1.26 -1.18 118.68 124.18 2gud s LEU 46 Ca 0.02 1.70 -0.12 0.00 -0.22 0.00 0.00 54.13 55.52 2gud s LEU 46 Cb -0.06 -3.56 0.04 0.00 0.50 0.00 0.00 46.19 43.10 2gud s LEU 46 CO 0.00 -0.41 1.11 -0.94 -1.32 0.00 0.00 176.35 174.79 2gud s SER 47 N 1.13 5.10 0.93 3.68 1.04 0.47 -5.00 113.70 121.05 2gud s SER 47 Ca 0.53 1.13 -0.11 0.00 0.48 0.00 0.00 55.95 57.98 2gud s SER 47 Cb -0.22 -1.88 0.15 0.00 0.10 0.00 0.00 66.02 64.17 2gud s SER 47 CO 0.24 -1.56 1.11 -2.16 0.98 0.00 0.00 173.24 171.85 2gud s PRO 48 N -5.34 0.95 -0.09 4.02 0.04 -1.26 -4.61 135.00 128.71 2gud s PRO 48 Ca 0.59 1.30 -0.18 0.00 0.04 0.00 0.00 61.00 62.75 2gud s PRO 48 Cb -0.12 -1.74 -0.05 0.00 0.04 0.00 0.00 34.50 32.64 2gud s PRO 48 CO 0.52 -2.59 0.48 0.99 0.04 0.00 0.00 177.00 176.44 2gud s THR 49 N -2.69 5.13 -0.22 1.26 2.01 -1.26 -4.59 115.64 115.27 2gud s THR 49 Ca 0.66 0.98 -0.13 0.00 0.31 0.00 0.00 61.69 63.51 2gud s THR 49 Cb -0.22 -3.82 -0.05 0.00 0.01 0.00 0.00 72.50 68.43 2gud s THR 49 CO 0.59 0.37 0.25 0.12 -0.69 0.00 0.00 174.62 175.25 2gud s PHE 50 N 0.31 3.34 -0.17 4.92 2.19 0.25 -4.95 117.98 123.87 2gud s PHE 50 Ca 0.26 0.38 0.00 0.00 0.33 0.00 0.00 56.93 57.91 2gud s PHE 50 Cb -0.16 -2.36 0.01 0.00 -1.31 0.00 0.00 43.02 39.20 2gud s PHE 50 CO 0.11 0.05 -0.16 0.99 1.83 0.00 0.00 175.22 178.05 2gud s THR 51 N 1.11 2.53 0.29 0.12 2.01 -1.26 -1.04 115.64 119.40 2gud s THR 51 Ca 0.12 -0.80 -0.29 0.00 0.31 0.00 0.00 61.69 61.03 2gud s THR 51 Cb -0.14 -2.08 -0.10 0.00 0.01 0.00 0.00 72.50 70.20 2gud s THR 51 CO 0.05 0.51 1.20 -0.36 -0.69 0.00 0.00 174.62 175.34 2gud s PHE 52 N 1.09 3.34 0.68 4.92 0.08 -0.17 -5.01 117.98 122.90 2gud s PHE 52 Ca -0.00 1.54 -0.04 0.00 0.12 0.00 0.00 56.93 58.54 2gud s PHE 52 Cb -0.14 -3.47 0.07 0.00 -0.57 0.00 0.00 43.02 38.90 2gud s PHE 52 CO -0.05 -1.21 0.96 0.20 -0.10 0.00 0.00 175.22 175.02 2gud s GLY 53 N -0.57 1.74 0.18 4.36 0.00 -1.26 -4.98 107.32 106.79 2gud s GLY 53 Ca 0.48 -1.16 -0.33 0.00 0.00 0.00 0.00 44.72 43.70 2gud s GLY 53 CO 0.45 -0.75 1.60 -1.26 0.00 0.00 0.00 173.10 173.14 2gud n SER 54 N -2.79 3.29 0.00 1.64 2.88 -1.26 -1.43 113.62 115.94 2gud n SER 54 Ca 0.09 1.08 0.00 0.00 -1.33 0.00 0.00 58.87 58.72 2gud n SER 54 Cb 0.60 -1.46 0.00 0.00 -0.75 0.00 0.00 64.21 62.60 2gud n SER 54 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2gud n GLY 55 N 3.43 0.91 3.82 0.46 0.00 -1.24 -4.96 105.19 107.61 2gud n GLY 55 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 2gud n GLY 55 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2gud s GLU 56 N -0.04 3.40 0.09 1.61 2.12 -0.52 -4.97 118.70 120.39 2gud s GLU 56 Ca 0.00 -0.20 -0.10 0.00 0.36 0.00 0.00 54.97 55.03 2gud s GLU 56 Cb 0.00 -3.12 0.00 0.00 0.26 0.00 0.00 34.13 31.28 2gud s GLU 56 CO 0.00 0.72 0.22 1.52 -0.54 0.00 0.00 175.26 177.18 2gud s TYR 57 N -0.88 0.09 0.02 5.30 -0.85 -1.26 -4.73 117.35 115.03 2gud s TYR 57 Ca 0.14 -0.48 -0.30 0.00 -0.52 0.00 0.00 57.07 55.91 2gud s TYR 57 Cb -0.12 -0.01 -0.06 0.00 0.38 0.00 0.00 41.96 42.15 2gud s TYR 57 CO 0.03 -0.55 1.47 0.42 -1.52 0.00 0.00 175.55 175.40 2gud s ILE 58 N -3.70 3.52 -0.10 -3.49 1.01 -1.26 -1.66 121.20 115.51 2gud s ILE 58 Ca 0.03 0.92 0.12 0.00 0.00 0.00 0.00 60.65 61.72 2gud s ILE 58 Cb 0.04 -3.59 -0.17 0.00 0.01 0.00 0.00 42.46 38.75 2gud s ILE 58 CO -0.10 -0.00 0.29 -1.54 0.00 0.00 0.00 174.94 173.58 2gud n SER 59 N 5.46 2.06 -3.73 3.58 3.41 -0.13 -1.58 113.62 122.69 2gud n SER 59 Ca 0.14 -0.12 -0.13 0.00 -0.26 0.00 0.00 58.87 58.50 2gud n SER 59 Cb 0.43 1.44 -0.10 0.00 -0.26 0.00 0.00 64.21 65.72 2gud n SER 59 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2gud s ASN 60 N -3.13 -0.44 -0.11 4.04 3.84 -1.11 -1.48 114.94 116.55 2gud s ASN 60 Ca -0.03 0.84 -0.10 0.00 0.21 0.00 0.00 52.86 53.79 2gud s ASN 60 Cb 0.08 0.83 0.03 0.00 -0.55 0.00 0.00 41.25 41.64 2gud s ASN 60 CO 0.48 -0.15 0.29 -0.32 -2.79 0.00 0.00 177.10 174.61 2gud s MET 61 N 0.41 0.33 -0.14 0.43 1.75 -0.06 -0.86 119.30 121.15 2gud s MET 61 Ca -0.02 0.45 0.02 0.00 -1.25 0.00 0.00 55.69 54.89 2gud s MET 61 Cb -0.04 0.12 0.01 0.00 2.84 0.00 0.00 34.83 37.76 2gud s MET 61 CO -0.02 -0.06 -0.21 0.99 -0.65 0.00 0.00 175.02 175.07 2gud s THR 62 N 0.37 2.16 -0.13 10.11 2.01 -0.16 -0.44 115.64 129.56 2gud s THR 62 Ca -0.02 -0.95 0.03 0.00 0.31 0.00 0.00 61.69 61.06 2gud s THR 62 Cb -0.03 -1.87 0.01 0.00 0.01 0.00 0.00 72.50 70.62 2gud s THR 62 CO -0.02 0.54 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.61 2gud s ILE 63 N 0.79 2.04 -0.10 1.82 1.01 -0.11 -1.33 121.20 125.32 2gud s ILE 63 Ca -0.07 -0.98 -0.11 0.00 0.00 0.00 0.00 60.65 59.49 2gud s ILE 63 Cb -0.16 -1.79 -0.05 0.00 0.01 0.00 0.00 42.46 40.48 2gud s ILE 63 CO -0.01 0.55 0.26 -0.13 0.00 0.00 0.00 174.94 175.61 2gud s ARG 64 N 0.67 3.84 0.11 2.79 0.52 -0.38 -0.97 118.95 125.53 2gud s ARG 64 Ca -0.11 0.09 -0.17 0.00 -0.52 0.00 0.00 55.73 55.02 2gud s ARG 64 Cb -0.16 -3.27 0.04 0.00 0.52 0.00 0.00 34.95 32.07 2gud s ARG 64 CO 0.01 0.58 0.41 -1.54 0.02 0.00 0.00 175.30 174.78 2gud s SER 65 N -0.57 -0.25 0.00 0.23 1.04 -0.32 -0.24 113.70 113.60 2gud s SER 65 Ca 0.18 -0.24 0.00 0.00 0.48 0.00 0.00 55.95 56.36 2gud s SER 65 Cb -0.14 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.45 2gud s SER 65 CO 0.06 -0.81 0.00 0.61 0.98 0.00 0.00 173.24 174.08 2gud n GLY 66 N -0.07 2.97 0.20 7.32 0.00 -1.26 -0.98 105.19 113.36 2gud n GLY 66 Ca -0.17 -0.23 0.04 0.00 0.00 0.00 0.00 46.02 45.66 2gud n GLY 66 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2gud h ASP 67 N 0.00 0.00 -4.62 1.61 3.32 -2.00 -3.46 116.42 111.28 2gud h ASP 67 Ca 0.00 0.00 -0.51 0.00 0.02 0.00 0.00 57.03 56.54 2gud h ASP 67 Cb 0.00 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 39.44 2gud h ASP 67 CO 0.00 0.33 -0.41 -1.22 -1.72 0.00 0.00 179.24 176.22 2gud n TYR 68 N -4.03 0.39 -2.82 4.55 4.01 -1.26 -4.82 117.16 113.18 2gud n TYR 68 Ca -0.02 -2.23 -0.42 0.00 -0.16 0.00 0.00 57.90 55.07 2gud n TYR 68 Cb 0.38 -0.09 -0.03 0.00 -0.31 0.00 0.00 39.34 39.28 2gud n TYR 68 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2gud s ILE 69 N -2.78 4.81 -0.03 -0.72 -1.09 -0.12 -4.39 121.20 116.88 2gud s ILE 69 Ca 0.12 1.74 0.00 0.00 -2.23 0.00 0.00 60.65 60.29 2gud s ILE 69 Cb 0.01 -4.19 -0.26 0.00 -1.58 0.00 0.00 42.46 36.44 2gud s ILE 69 CO 0.09 -0.06 0.71 0.44 -1.23 0.00 0.00 174.94 174.89 2gud h ASP 70 N 7.45 0.29 -4.52 3.58 5.19 -0.94 -0.09 116.42 127.39 2gud h ASP 70 Ca -0.25 -0.49 -0.03 0.00 -0.62 0.00 0.00 57.03 55.64 2gud h ASP 70 Cb 1.10 -0.09 -0.20 0.00 0.18 0.00 0.00 39.33 40.31 2gud h ASP 70 CO 0.88 1.42 0.23 0.21 -3.12 0.00 0.00 179.24 178.87 2gud s ASN 71 N -6.77 -0.64 0.01 6.45 3.84 -1.03 -1.33 114.94 115.48 2gud s ASN 71 Ca -0.11 0.89 0.02 0.00 0.21 0.00 0.00 52.86 53.88 2gud s ASN 71 Cb 0.07 0.79 -0.01 0.00 -0.55 0.00 0.00 41.25 41.55 2gud s ASN 71 CO 0.83 -0.45 -0.07 -0.51 -2.79 0.00 0.00 177.10 174.10 2gud s ILE 72 N -0.66 0.55 -0.00 -5.21 2.07 -0.61 -1.25 121.20 116.08 2gud s ILE 72 Ca -0.06 -0.59 -0.10 0.00 -1.41 0.00 0.00 60.65 58.48 2gud s ILE 72 Cb -0.02 -0.52 0.01 0.00 0.13 0.00 0.00 42.46 42.06 2gud s ILE 72 CO 0.06 -0.05 0.21 -0.94 -1.91 0.00 0.00 174.94 172.30 2gud s SER 73 N -0.71 -0.06 0.17 4.50 1.04 -0.44 -1.51 113.70 116.70 2gud s SER 73 Ca -0.02 -0.09 -0.12 0.00 0.48 0.00 0.00 55.95 56.20 2gud s SER 73 Cb -0.05 0.25 0.01 0.00 0.10 0.00 0.00 66.02 66.32 2gud s SER 73 CO 0.00 -0.40 0.37 0.72 0.98 0.00 0.00 173.24 174.91 2gud s PHE 74 N -1.36 0.19 0.09 5.02 -0.12 -0.19 -0.99 117.98 120.60 2gud s PHE 74 Ca -0.14 -0.55 0.07 0.00 -0.05 0.00 0.00 56.93 56.27 2gud s PHE 74 Cb -0.07 0.11 -0.03 0.00 -0.63 0.00 0.00 43.02 42.40 2gud s PHE 74 CO 0.03 -0.78 -0.19 -2.00 -0.05 0.00 0.00 175.22 172.22 2gud s GLU 75 N -3.92 1.10 0.41 1.99 2.12 -0.04 -1.10 118.70 119.25 2gud s GLU 75 Ca 0.13 -1.08 0.08 0.00 0.36 0.00 0.00 54.97 54.46 2gud s GLU 75 Cb 0.02 -1.29 -0.02 0.00 0.26 0.00 0.00 34.13 33.10 2gud s GLU 75 CO -0.02 0.30 0.37 0.95 -0.54 0.00 0.00 175.26 176.33 2gud s THR 76 N -1.11 2.76 -0.50 -1.70 -4.23 -0.21 -0.96 115.64 109.68 2gud s THR 76 Ca 0.05 -1.34 0.19 0.00 -1.18 0.00 0.00 61.69 59.41 2gud s THR 76 Cb -0.10 -3.02 0.19 0.00 1.34 0.00 0.00 72.50 70.92 2gud s THR 76 CO 0.03 -0.02 1.58 -0.46 -0.54 0.00 0.00 174.62 175.22 2gud n ASN 77 N -1.53 0.48 -1.41 3.99 6.94 -0.67 -1.52 115.26 121.53 2gud n ASN 77 Ca 0.03 0.66 0.11 0.00 -0.02 0.00 0.00 54.58 55.36 2gud n ASN 77 Cb 0.61 -0.75 0.33 0.00 -2.36 0.00 0.00 39.78 37.62 2gud n ASN 77 CO 0.00 0.00 0.00 0.23 -1.03 0.00 0.00 177.26 176.46 2gud n MET 78 N -2.08 2.99 -0.89 -3.83 2.81 -1.26 -4.95 117.12 109.92 2gud n MET 78 Ca 0.01 -2.72 0.00 0.00 -1.81 0.00 0.00 57.70 53.17 2gud n MET 78 Cb 0.13 -1.65 0.00 0.00 -0.71 0.00 0.00 33.22 30.99 2gud n MET 78 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2gud n GLY 79 N 1.51 0.53 3.94 3.03 0.00 -0.58 -5.04 105.19 108.59 2gud n GLY 79 Ca 0.25 -0.22 -0.24 0.00 0.00 0.00 0.00 46.02 45.81 2gud n GLY 79 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gud s ARG 80 N -0.49 3.37 0.09 1.61 0.52 -1.26 -4.88 118.95 117.91 2gud s ARG 80 Ca 0.00 -0.33 0.04 0.00 -0.52 0.00 0.00 55.73 54.92 2gud s ARG 80 Cb 0.00 -2.60 -0.03 0.00 0.52 0.00 0.00 34.95 32.83 2gud s ARG 80 CO 0.00 -0.00 -0.11 1.03 0.02 0.00 0.00 175.30 176.24 2gud s ARG 81 N -4.43 0.82 -0.03 3.54 1.81 -1.26 -1.05 118.95 118.35 2gud s ARG 81 Ca 0.43 -1.09 0.02 0.00 -1.72 0.00 0.00 55.73 53.37 2gud s ARG 81 Cb -0.10 -0.57 0.01 0.00 -0.45 0.00 0.00 34.95 33.84 2gud s ARG 81 CO 0.37 0.10 -0.07 0.12 -0.68 0.00 0.00 175.30 175.14 2gud s PHE 82 N -2.15 0.85 0.00 -0.53 5.36 -0.26 -4.99 117.98 116.27 2gud s PHE 82 Ca 0.03 -0.22 0.00 0.00 -0.96 0.00 0.00 56.93 55.78 2gud s PHE 82 Cb -0.05 -0.64 0.00 0.00 -0.34 0.00 0.00 43.02 41.99 2gud s PHE 82 CO 0.01 -0.12 0.00 0.41 -1.46 0.00 0.00 175.22 174.06 2gud n GLY 83 N 3.46 -1.75 3.76 13.12 0.00 -1.26 -1.02 105.19 121.50 2gud n GLY 83 Ca -0.20 -1.33 -0.37 0.00 0.00 0.00 0.00 46.02 44.12 2gud n GLY 83 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2gud s PRO 84 N 0.00 3.47 -0.03 1.61 0.02 -1.26 -4.85 135.00 133.96 2gud s PRO 84 Ca 0.00 1.91 0.02 0.00 0.02 0.00 0.00 61.00 62.95 2gud s PRO 84 Cb 0.00 -2.29 0.00 0.00 0.02 0.00 0.00 34.50 32.23 2gud s PRO 84 CO 0.00 -0.82 -0.09 0.71 -0.33 0.00 0.00 177.00 176.47 2gud s TYR 85 N -1.49 0.93 -0.32 6.54 2.02 -0.57 -5.00 117.35 119.46 2gud s TYR 85 Ca 0.68 -0.23 0.00 0.00 -0.37 0.00 0.00 57.07 57.15 2gud s TYR 85 Cb -0.32 -0.67 0.00 0.00 -0.40 0.00 0.00 41.96 40.57 2gud s TYR 85 CO 0.38 -0.10 0.00 0.41 -1.57 0.00 0.00 175.55 174.67 2gud n GLY 86 N 3.31 0.55 0.78 0.71 0.00 -1.26 -1.58 105.19 107.69 2gud n GLY 86 Ca -0.18 -2.27 -0.05 0.00 0.00 0.00 0.00 46.02 43.52 2gud n GLY 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gud n GLY 87 N 0.00 2.96 1.09 -0.02 0.00 -0.44 -4.83 105.19 103.94 2gud n GLY 87 Ca 0.00 -2.19 0.09 0.00 0.00 0.00 0.00 46.02 43.92 2gud n GLY 87 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2gud n SER 88 N -2.00 3.61 -3.33 1.61 3.41 -1.26 -4.43 113.62 111.22 2gud n SER 88 Ca -0.00 -2.04 -0.22 0.00 -0.26 0.00 0.00 58.87 56.35 2gud n SER 88 Cb 0.13 -0.40 0.17 0.00 -0.26 0.00 0.00 64.21 63.85 2gud n SER 88 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gud n GLY 89 N 1.16 -2.04 7.00 5.00 0.00 -1.26 -4.91 105.19 110.13 2gud n GLY 89 Ca 0.20 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.63 2gud n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gud n GLY 90 N -2.10 0.31 3.18 -0.02 0.00 -1.26 -4.50 105.19 100.79 2gud n GLY 90 Ca 0.12 -0.95 -0.19 0.00 0.00 0.00 0.00 46.02 45.00 2gud n GLY 90 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gud s SER 91 N -4.00 1.75 0.15 1.61 0.01 -0.16 -4.82 113.70 108.25 2gud s SER 91 Ca 0.00 -0.61 -0.18 0.00 1.31 0.00 0.00 55.95 56.47 2gud s SER 91 Cb 0.00 -0.06 -0.07 0.00 0.21 0.00 0.00 66.02 66.09 2gud s SER 91 CO 0.00 -0.05 0.63 0.00 0.41 0.00 0.00 173.24 174.22 2gud s ALA 92 N -1.22 3.52 -0.01 1.44 0.00 -1.26 -1.17 121.76 123.07 2gud s ALA 92 Ca -0.01 0.04 0.02 0.00 0.00 0.00 0.00 51.96 52.01 2gud s ALA 92 Cb -0.10 -2.68 -0.00 0.00 0.00 0.00 0.00 23.12 20.34 2gud s ALA 92 CO 0.02 0.39 -0.06 -0.80 0.00 0.00 0.00 175.76 175.31 2gud s ASN 93 N -1.49 0.72 -0.07 0.00 -0.87 -0.15 -4.99 114.94 108.10 2gud s ASN 93 Ca 0.37 -0.11 0.05 0.00 -1.57 0.00 0.00 52.86 51.60 2gud s ASN 93 Cb -0.17 -0.09 -0.01 0.00 -0.02 0.00 0.00 41.25 40.96 2gud s ASN 93 CO 0.20 0.07 -0.23 -0.89 -2.57 0.00 0.00 177.10 173.68 2gud s THR 94 N -0.11 1.91 -0.15 1.60 2.01 -1.26 -0.94 115.64 118.71 2gud s THR 94 Ca 0.02 -0.97 -0.17 0.00 0.31 0.00 0.00 61.69 60.87 2gud s THR 94 Cb -0.03 -1.63 -0.04 0.00 0.01 0.00 0.00 72.50 70.81 2gud s THR 94 CO -0.00 0.53 0.45 -0.76 -0.69 0.00 0.00 174.62 174.15 2gud s LEU 95 N 0.03 4.23 -0.02 4.42 1.43 0.42 -4.96 118.68 124.23 2gud s LEU 95 Ca -0.08 0.72 0.04 0.00 -1.03 0.00 0.00 54.13 53.78 2gud s LEU 95 Cb -0.15 -2.64 -0.01 0.00 0.03 0.00 0.00 46.19 43.43 2gud s LEU 95 CO 0.05 -0.03 -0.15 -0.44 0.23 0.00 0.00 176.35 176.01 2gud s SER 96 N 0.75 1.83 -1.09 2.29 0.01 -1.26 -0.88 113.70 115.35 2gud s SER 96 Ca 0.24 -0.29 -0.08 0.00 1.31 0.00 0.00 55.95 57.13 2gud s SER 96 Cb -0.15 -0.31 -0.05 0.00 0.21 0.00 0.00 66.02 65.72 2gud s SER 96 CO 0.09 0.17 0.90 -3.20 0.41 0.00 0.00 173.24 171.60 2gud n ASN 97 N 2.88 -5.74 -4.52 2.44 5.15 -0.79 -4.78 115.26 109.89 2gud n ASN 97 Ca -0.16 -0.76 -0.29 0.00 -0.60 0.00 0.00 54.58 52.77 2gud n ASN 97 Cb 0.54 -4.84 -0.09 0.00 -0.53 0.00 0.00 39.78 34.86 2gud n ASN 97 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2gud s VAL 98 N -3.41 1.12 -0.24 3.44 -7.23 -0.55 -1.31 120.40 112.22 2gud s VAL 98 Ca 0.40 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.55 2gud s VAL 98 Cb -0.07 -2.40 0.08 0.00 0.56 0.00 0.00 36.38 34.54 2gud s VAL 98 CO 0.76 0.00 0.05 -0.75 -0.31 0.00 0.00 175.10 174.85 2gud s LYS 99 N -3.81 0.81 0.16 4.82 2.20 -0.06 -4.07 119.74 119.80 2gud s LYS 99 Ca 0.18 -0.75 -0.30 0.00 -0.36 0.00 0.00 55.97 54.74 2gud s LYS 99 Cb 0.04 -2.12 -0.08 0.00 -1.51 0.00 0.00 37.83 34.16 2gud s LYS 99 CO 0.10 -0.77 1.23 0.08 -0.36 0.00 0.00 175.35 175.63 2gud s VAL 100 N 1.70 3.56 -0.23 4.02 1.01 -0.62 -0.97 120.40 128.88 2gud s VAL 100 Ca 0.02 1.26 -0.05 0.00 0.00 0.00 0.00 61.98 63.21 2gud s VAL 100 Cb -0.17 -3.80 -0.13 0.00 0.00 0.00 0.00 36.38 32.28 2gud s VAL 100 CO -0.15 0.17 -0.25 -0.38 0.00 0.00 0.00 175.10 174.50 2gud n ILE 101 N 2.87 1.31 -3.71 2.22 2.08 0.60 -4.60 119.36 120.13 2gud n ILE 101 Ca 0.06 -0.42 -0.14 0.00 0.56 0.00 0.00 62.75 62.81 2gud n ILE 101 Cb 0.44 -1.54 -0.08 0.00 -0.75 0.00 0.00 39.64 37.71 2gud n ILE 101 CO 0.00 0.00 0.00 -1.58 0.56 0.00 0.00 176.55 175.53 2gud s GLN 102 N -2.45 0.78 -0.26 0.38 2.00 -0.89 -4.56 119.66 114.66 2gud s GLN 102 Ca -0.32 -0.15 0.02 0.00 -2.00 0.00 0.00 55.36 52.91 2gud s GLN 102 Cb 0.10 0.35 0.07 0.00 0.80 0.00 0.00 33.01 34.33 2gud s GLN 102 CO 0.48 -0.23 -0.06 0.42 -0.50 0.00 0.00 175.29 175.40 2gud s ILE 103 N -1.51 1.90 0.40 -2.34 1.01 -1.26 -1.00 121.20 118.39 2gud s ILE 103 Ca -0.12 -1.56 0.04 0.00 0.00 0.00 0.00 60.65 59.01 2gud s ILE 103 Cb -0.04 -2.13 0.04 0.00 0.01 0.00 0.00 42.46 40.35 2gud s ILE 103 CO 0.04 -0.15 0.33 0.59 0.00 0.00 0.00 174.94 175.75 2gud n ASN 104 N 4.51 2.19 0.00 3.58 3.02 -0.24 -4.97 115.26 123.34 2gud n ASN 104 Ca -0.11 -2.34 0.00 0.00 -0.03 0.00 0.00 54.58 52.10 2gud n ASN 104 Cb 0.43 -0.06 0.00 0.00 -0.61 0.00 0.00 39.78 39.54 2gud n ASN 104 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2gud n GLY 105 N 0.16 -0.72 3.01 7.41 0.00 -1.26 -0.45 105.19 113.35 2gud n GLY 105 Ca 0.00 -0.81 -0.12 0.00 0.00 0.00 0.00 46.02 45.09 2gud n GLY 105 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gud s SER 106 N -4.00 -0.08 0.04 1.61 0.01 -0.42 -4.89 113.70 105.98 2gud s SER 106 Ca 0.00 0.12 -0.11 0.00 1.31 0.00 0.00 55.95 57.27 2gud s SER 106 Cb 0.00 0.23 0.01 0.00 0.21 0.00 0.00 66.02 66.47 2gud s SER 106 CO 0.00 -0.11 0.24 0.00 0.41 0.00 0.00 173.24 173.78 2gud s ALA 107 N -0.26 -0.50 0.00 1.44 0.00 -1.26 -1.47 121.76 119.71 2gud s ALA 107 Ca -0.03 -0.16 0.00 0.00 0.00 0.00 0.00 51.96 51.76 2gud s ALA 107 Cb -0.02 0.30 0.00 0.00 0.00 0.00 0.00 23.12 23.40 2gud s ALA 107 CO 0.00 -0.38 0.00 0.41 0.00 0.00 0.00 175.76 175.79 2gud n GLY 108 N 0.63 3.64 0.22 0.00 0.00 -1.26 -4.85 105.19 103.56 2gud n GLY 108 Ca -0.19 -0.45 0.10 0.00 0.00 0.00 0.00 46.02 45.48 2gud n GLY 108 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2gud h ASP 109 N 0.00 0.00 -2.65 1.61 3.32 -1.90 -3.06 116.42 113.74 2gud h ASP 109 Ca 0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 2gud h ASP 109 Cb 0.00 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 39.42 2gud h ASP 109 CO 0.00 0.22 -0.52 -0.31 -1.72 0.00 0.00 179.24 176.91 2gud s TYR 110 N -3.51 1.81 -0.63 4.55 2.02 -1.26 -1.97 117.35 118.36 2gud s TYR 110 Ca 0.02 -1.22 -0.23 0.00 -0.37 0.00 0.00 57.07 55.27 2gud s TYR 110 Cb 0.09 -1.24 0.06 0.00 -0.40 0.00 0.00 41.96 40.47 2gud s TYR 110 CO 0.64 -0.20 0.95 -1.17 -1.57 0.00 0.00 175.55 174.20 2gud s LEU 111 N -3.65 4.33 0.10 -1.29 2.96 -0.15 -4.45 118.68 116.53 2gud s LEU 111 Ca 0.21 -0.84 -0.15 0.00 -0.22 0.00 0.00 54.13 53.13 2gud s LEU 111 Cb 0.02 -2.51 -0.07 0.00 0.50 0.00 0.00 46.19 44.13 2gud s LEU 111 CO 0.13 -1.37 1.46 0.44 -1.32 0.00 0.00 176.35 175.69 2gud h ASP 112 N 9.49 0.72 -5.04 3.68 5.19 -1.57 -0.28 116.42 128.61 2gud h ASP 112 Ca -0.28 -0.42 -0.05 0.00 -0.62 0.00 0.00 57.03 55.66 2gud h ASP 112 Cb 1.07 -0.20 -0.14 0.00 0.18 0.00 0.00 39.33 40.24 2gud h ASP 112 CO 1.15 0.98 0.01 -0.94 -3.12 0.00 0.00 179.24 177.32 2gud s SER 113 N -6.42 -0.36 -0.02 6.45 1.04 -0.90 -3.55 113.70 109.94 2gud s SER 113 Ca -0.13 -0.09 0.07 0.00 0.48 0.00 0.00 55.95 56.28 2gud s SER 113 Cb 0.09 0.50 -0.02 0.00 0.10 0.00 0.00 66.02 66.69 2gud s SER 113 CO 0.81 -0.82 -0.22 -0.76 0.98 0.00 0.00 173.24 173.24 2gud s LEU 114 N -2.48 2.04 -0.32 2.42 1.43 -1.26 -1.29 118.68 119.21 2gud s LEU 114 Ca -0.01 -0.39 0.03 0.00 -1.03 0.00 0.00 54.13 52.73 2gud s LEU 114 Cb 0.00 -1.12 0.09 0.00 0.03 0.00 0.00 46.19 45.20 2gud s LEU 114 CO -0.08 0.26 0.03 -0.62 0.23 0.00 0.00 176.35 176.17 2gud s ASP 115 N -0.49 4.56 -0.24 2.29 -1.08 0.40 -4.89 116.67 117.22 2gud s ASP 115 Ca 0.08 -1.92 -0.14 0.00 -0.52 0.00 0.00 52.55 50.05 2gud s ASP 115 Cb -0.08 -1.48 -0.04 0.00 -1.46 0.00 0.00 42.92 39.85 2gud s ASP 115 CO -0.01 -0.35 0.32 -0.63 0.52 0.00 0.00 175.17 175.02 2gud s ILE 116 N 1.06 5.24 -0.19 4.11 -1.09 -1.26 -1.08 121.20 127.98 2gud s ILE 116 Ca 0.07 0.50 -0.10 0.00 -2.23 0.00 0.00 60.65 58.89 2gud s ILE 116 Cb -0.19 -3.65 -0.05 0.00 -1.58 0.00 0.00 42.46 36.99 2gud s ILE 116 CO -0.10 0.24 0.14 -0.31 -1.23 0.00 0.00 174.94 173.68 2gud s TYR 117 N 1.53 3.43 0.17 3.97 1.51 -0.17 -4.99 117.35 122.79 2gud s TYR 117 Ca 0.14 0.36 -0.22 0.00 -1.01 0.00 0.00 57.07 56.33 2gud s TYR 117 Cb -0.15 -2.14 0.06 0.00 -0.11 0.00 0.00 41.96 39.62 2gud s TYR 117 CO 0.08 0.33 0.59 1.52 -1.11 0.00 0.00 175.55 176.96 2gud s TYR 118 N 0.24 -0.48 -0.14 2.71 1.13 -1.26 -0.29 117.35 119.25 2gud s TYR 118 Ca 0.09 0.24 -0.15 0.00 -1.41 0.00 0.00 57.07 55.84 2gud s TYR 118 Cb -0.11 0.54 -0.05 0.00 -1.10 0.00 0.00 41.96 41.25 2gud s TYR 118 CO -0.01 -0.87 0.35 -1.21 -2.51 0.00 0.00 175.55 171.30 2gud s GLU 119 N -3.77 4.25 -0.33 -3.49 2.02 -0.14 -4.93 118.70 112.32 2gud s GLU 119 Ca 0.02 0.20 -0.13 0.00 0.02 0.00 0.00 54.97 55.09 2gud s GLU 119 Cb -0.01 -3.41 -0.02 0.00 0.10 0.00 0.00 34.13 30.78 2gud s GLU 119 CO -0.11 0.25 0.25 -1.14 0.02 0.00 0.00 175.26 174.53 2gud s GLN 120 N 0.41 3.59 0.00 1.61 2.00 -1.26 -0.89 119.66 125.13 2gud s GLN 120 Ca 0.19 -0.54 0.27 0.00 -2.00 0.00 0.00 55.36 53.29 2gud s GLN 120 Cb -0.14 -3.78 0.92 0.00 0.80 0.00 0.00 33.01 30.81 2gud s GLN 120 CO 0.06 -0.41 1.67 0.66 -0.50 0.00 0.00 175.29 176.77