#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a0c n ASN 2 N 0.00 1.74 -3.90 4.52 6.94 -1.25 -1.71 115.26 121.58 3a0c n ASN 2 Ca 0.00 -3.70 -0.10 0.00 -0.02 0.00 0.00 54.58 50.75 3a0c n ASN 2 Cb 0.00 -0.50 -0.10 0.00 -2.36 0.00 0.00 39.78 36.81 3a0c n ASN 2 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3a0c s SER 3 N -3.12 0.09 -0.13 0.53 1.04 -1.26 -1.22 113.70 109.64 3a0c s SER 3 Ca 0.37 -0.30 -0.03 0.00 0.48 0.00 0.00 55.95 56.47 3a0c s SER 3 Cb 0.36 0.18 0.04 0.00 0.10 0.00 0.00 66.02 66.70 3a0c s SER 3 CO -0.06 -0.36 0.04 -0.22 0.98 0.00 0.00 173.24 173.61 3a0c s LEU 4 N -1.45 0.66 0.04 2.42 2.96 -0.22 -4.97 118.68 118.12 3a0c s LEU 4 Ca -0.15 -0.40 0.01 0.00 -0.22 0.00 0.00 54.13 53.38 3a0c s LEU 4 Cb -0.08 -0.41 -0.04 0.00 0.50 0.00 0.00 46.19 46.16 3a0c s LEU 4 CO 0.01 -0.27 0.07 -0.94 -1.32 0.00 0.00 176.35 173.90 3a0c s SER 5 N 2.00 5.52 0.22 3.68 1.04 -1.26 0.50 113.70 125.39 3a0c s SER 5 Ca 0.03 0.05 -0.31 0.00 0.48 0.00 0.00 55.95 56.19 3a0c s SER 5 Cb -0.14 -1.52 -0.15 0.00 0.10 0.00 0.00 66.02 64.31 3a0c s SER 5 CO -0.07 0.23 1.24 -1.20 0.98 0.00 0.00 173.24 174.42 3a0c n SER 6 N 0.87 1.89 -2.26 7.02 7.64 -0.13 -0.47 113.62 128.18 3a0c n SER 6 Ca -0.11 1.15 -0.31 0.00 1.01 0.00 0.00 58.87 60.61 3a0c n SER 6 Cb 0.52 -1.31 0.05 0.00 -1.01 0.00 0.00 64.21 62.47 3a0c n SER 6 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 3a0c n PRO 7 N 1.70 3.05 -0.96 1.43 -0.04 -1.26 -4.78 135.00 134.13 3a0c n PRO 7 Ca 0.13 -3.66 -0.29 0.00 -0.04 0.00 0.00 63.50 59.64 3a0c n PRO 7 Cb 0.28 -2.28 0.18 0.00 -0.04 0.00 0.00 33.50 31.64 3a0c n PRO 7 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3a0c s ASN 8 N -2.47 2.64 0.06 3.54 -0.87 0.38 -4.64 114.94 113.58 3a0c s ASN 8 Ca 0.59 1.55 0.01 0.00 -1.57 0.00 0.00 52.86 53.43 3a0c s ASN 8 Cb 0.47 -2.21 -0.03 0.00 -0.02 0.00 0.00 41.25 39.45 3a0c s ASN 8 CO -0.02 -3.17 -0.06 -0.55 -2.57 0.00 0.00 177.10 170.73 3a0c s SER 9 N -3.10 0.79 -0.48 -1.22 0.15 -1.26 -2.41 113.70 106.18 3a0c s SER 9 Ca 0.65 -0.81 -0.06 0.00 0.70 0.00 0.00 55.95 56.44 3a0c s SER 9 Cb -0.20 0.10 0.13 0.00 -1.71 0.00 0.00 66.02 64.33 3a0c s SER 9 CO 0.59 -0.40 0.32 -0.76 1.20 0.00 0.00 173.24 174.19 3a0c s LEU 10 N -2.39 5.50 1.08 3.45 1.43 0.10 -4.92 118.68 122.93 3a0c s LEU 10 Ca 0.01 -2.14 -0.16 0.00 -1.03 0.00 0.00 54.13 50.81 3a0c s LEU 10 Cb -0.01 -1.92 0.23 0.00 0.03 0.00 0.00 46.19 44.52 3a0c s LEU 10 CO -0.04 -0.58 1.13 -0.36 0.23 0.00 0.00 176.35 176.73 3a0c s PHE 11 N 1.01 1.36 0.09 0.29 0.40 -1.26 -1.16 117.98 118.71 3a0c s PHE 11 Ca 0.09 0.66 -0.36 0.00 -0.60 0.00 0.00 56.93 56.72 3a0c s PHE 11 Cb -0.23 -3.46 -0.16 0.00 0.51 0.00 0.00 43.02 39.68 3a0c s PHE 11 CO -0.03 -3.26 1.45 2.41 0.70 0.00 0.00 175.22 176.49 3a0c n THR 12 N -4.35 0.03 0.00 0.64 -1.04 -0.86 -0.96 114.28 107.74 3a0c n THR 12 Ca 0.10 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.10 3a0c n THR 12 Cb 0.59 -1.08 0.00 0.00 -1.82 0.00 0.00 70.33 68.02 3a0c n THR 12 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3a0c n GLY 13 N 2.92 2.61 3.83 3.41 0.00 0.28 -4.96 105.19 113.27 3a0c n GLY 13 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 3a0c n GLY 13 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3a0c s HIS 14 N -2.15 3.34 0.16 1.61 4.02 -0.14 -4.79 115.29 117.35 3a0c s HIS 14 Ca 0.00 1.50 -0.17 0.00 1.02 0.00 0.00 55.06 57.40 3a0c s HIS 14 Cb 0.00 -2.85 0.03 0.00 -1.02 0.00 0.00 32.58 28.75 3a0c s HIS 14 CO 0.00 -0.48 0.48 -1.54 1.02 0.00 0.00 174.74 174.21 3a0c s SER 15 N -2.88 -0.27 0.07 1.40 1.04 -1.26 -1.15 113.70 110.65 3a0c s SER 15 Ca 0.60 -0.39 0.04 0.00 0.48 0.00 0.00 55.95 56.69 3a0c s SER 15 Cb -0.11 0.54 -0.04 0.00 0.10 0.00 0.00 66.02 66.51 3a0c s SER 15 CO 0.30 -0.96 -0.00 -0.76 0.98 0.00 0.00 173.24 172.79 3a0c s LEU 16 N -2.84 3.46 -0.05 2.42 1.43 -0.24 -4.91 118.68 117.95 3a0c s LEU 16 Ca 0.06 -0.15 -0.05 0.00 -1.03 0.00 0.00 54.13 52.97 3a0c s LEU 16 Cb 0.00 -2.15 0.01 0.00 0.03 0.00 0.00 46.19 44.08 3a0c s LEU 16 CO -0.07 0.20 0.14 -1.61 0.23 0.00 0.00 176.35 175.23 3a0c s GLU 17 N -2.15 0.15 0.03 1.70 2.02 -0.70 -0.63 118.70 119.13 3a0c s GLU 17 Ca 0.24 0.20 -0.13 0.00 0.02 0.00 0.00 54.97 55.31 3a0c s GLU 17 Cb -0.12 0.06 0.02 0.00 0.10 0.00 0.00 34.13 34.19 3a0c s GLU 17 CO 0.17 -0.03 0.27 0.54 0.02 0.00 0.00 175.26 176.23 3a0c s VAL 18 N 0.15 0.08 0.77 2.63 0.11 -0.77 -3.96 120.40 119.41 3a0c s VAL 18 Ca -0.01 -0.69 -0.11 0.00 -2.93 0.00 0.00 61.98 58.25 3a0c s VAL 18 Cb -0.02 -0.84 0.05 0.00 -1.53 0.00 0.00 36.38 34.05 3a0c s VAL 18 CO -0.00 -0.38 1.09 -0.83 -3.33 0.00 0.00 175.10 171.65 3a0c s GLY 19 N -1.89 1.68 0.11 6.54 0.00 -1.26 -1.44 107.32 111.06 3a0c s GLY 19 Ca -0.07 0.27 -0.13 0.00 0.00 0.00 0.00 44.72 44.79 3a0c s GLY 19 CO -0.02 0.61 1.36 -0.56 0.00 0.00 0.00 173.10 174.50 3a0c h PRO 20 N -1.10 0.81 -0.17 2.90 0.13 -1.94 -3.39 132.00 129.24 3a0c h PRO 20 Ca -0.44 -0.55 -0.24 0.00 -0.87 0.00 0.00 66.00 63.90 3a0c h PRO 20 Cb 1.23 0.08 -0.20 0.00 0.13 0.00 0.00 31.00 32.25 3a0c h PRO 20 CO 0.51 1.18 -0.49 -1.13 -0.23 0.00 0.00 178.00 177.84 3a0c n SER 21 N -4.04 -1.26 -4.71 1.44 3.41 -1.24 -5.07 113.62 102.16 3a0c n SER 21 Ca -0.05 -2.47 -0.35 0.00 -0.26 0.00 0.00 58.87 55.74 3a0c n SER 21 Cb 0.64 0.71 -0.09 0.00 -0.26 0.00 0.00 64.21 65.21 3a0c n SER 21 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 3a0c s TYR 22 N -0.42 3.26 -0.10 7.33 4.12 -0.52 -1.49 117.35 129.51 3a0c s TYR 22 Ca 0.22 0.23 -0.04 0.00 0.02 0.00 0.00 57.07 57.50 3a0c s TYR 22 Cb 0.41 -1.86 0.05 0.00 -1.52 0.00 0.00 41.96 39.04 3a0c s TYR 22 CO -0.07 0.46 0.18 1.03 0.02 0.00 0.00 175.55 177.17 3a0c s ARG 23 N -0.70 0.06 -0.40 -0.62 0.52 -0.81 -1.85 118.95 115.15 3a0c s ARG 23 Ca 0.11 0.54 -0.12 0.00 -0.52 0.00 0.00 55.73 55.74 3a0c s ARG 23 Cb -0.12 -0.35 0.04 0.00 0.52 0.00 0.00 34.95 35.04 3a0c s ARG 23 CO 0.02 -0.34 0.26 -1.17 0.02 0.00 0.00 175.30 174.10 3a0c s LEU 24 N 2.31 5.00 0.01 2.53 2.96 0.20 -0.50 118.68 131.18 3a0c s LEU 24 Ca 0.03 -1.09 0.07 0.00 -0.22 0.00 0.00 54.13 52.92 3a0c s LEU 24 Cb -0.12 -2.07 -0.03 0.00 0.50 0.00 0.00 46.19 44.46 3a0c s LEU 24 CO -0.07 -0.46 -0.21 -0.51 -1.32 0.00 0.00 176.35 173.79 3a0c s ILE 25 N 1.58 2.56 -0.71 6.68 2.07 -0.56 -1.08 121.20 131.74 3a0c s ILE 25 Ca 0.03 -1.09 -0.17 0.00 -1.41 0.00 0.00 60.65 58.01 3a0c s ILE 25 Cb -0.20 -2.00 0.15 0.00 0.13 0.00 0.00 42.46 40.54 3a0c s ILE 25 CO 0.07 0.46 0.75 -0.32 -1.91 0.00 0.00 174.94 173.99 3a0c s MET 26 N -1.03 3.31 0.89 3.50 -2.45 -0.30 -2.38 119.30 120.83 3a0c s MET 26 Ca 0.12 -1.85 -0.11 0.00 -1.25 0.00 0.00 55.69 52.60 3a0c s MET 26 Cb -0.10 -4.43 0.13 0.00 1.25 0.00 0.00 34.83 31.68 3a0c s MET 26 CO 0.02 -1.45 1.09 -0.65 1.05 0.00 0.00 175.02 175.08 3a0c s GLN 27 N 1.62 1.29 0.43 4.11 -0.21 -1.02 0.10 119.66 125.98 3a0c s GLN 27 Ca 0.15 0.83 0.29 0.00 0.02 0.00 0.00 55.36 56.66 3a0c s GLN 27 Cb -0.18 -1.81 1.12 0.00 1.00 0.00 0.00 33.01 33.14 3a0c s GLN 27 CO -0.02 -2.22 1.85 0.78 -2.12 0.00 0.00 175.29 173.56 3a0c h GLY 28 N -1.53 0.00 -0.78 3.09 0.00 -1.93 -2.59 103.07 99.33 3a0c h GLY 28 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 3a0c h GLY 28 CO 0.54 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.17 3a0c n ASP 29 N -2.77 1.56 0.00 0.19 5.75 -1.26 -4.41 116.55 115.62 3a0c n ASP 29 Ca 0.02 -1.73 0.00 0.00 -0.01 0.00 0.00 54.79 53.06 3a0c n ASP 29 Cb 0.31 -0.12 0.00 0.00 -1.03 0.00 0.00 41.12 40.28 3a0c n ASP 29 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3a0c s ASN 31 N -2.38 6.69 -0.49 0.00 2.47 -1.26 -4.42 114.94 115.56 3a0c s ASN 31 Ca 0.00 0.85 -0.18 0.00 0.42 0.00 0.00 52.86 53.95 3a0c s ASN 31 Cb 0.00 -2.36 0.06 0.00 -1.45 0.00 0.00 41.25 37.50 3a0c s ASN 31 CO 0.00 -0.32 0.56 0.12 -3.72 0.00 0.00 177.10 173.74 3a0c s PHE 32 N 2.12 3.10 0.08 0.43 5.36 -1.26 -2.44 117.98 125.36 3a0c s PHE 32 Ca 0.29 -0.62 0.07 0.00 -0.96 0.00 0.00 56.93 55.71 3a0c s PHE 32 Cb -0.16 -3.41 -0.03 0.00 -0.34 0.00 0.00 43.02 39.08 3a0c s PHE 32 CO 0.10 -0.96 -0.19 0.54 -1.46 0.00 0.00 175.22 173.26 3a0c s VAL 33 N 2.36 1.51 -0.28 3.12 0.11 -1.00 0.32 120.40 126.53 3a0c s VAL 33 Ca 0.12 -1.35 -0.10 0.00 -2.93 0.00 0.00 61.98 57.72 3a0c s VAL 33 Cb -0.20 -1.37 -0.04 0.00 -1.53 0.00 0.00 36.38 33.23 3a0c s VAL 33 CO 0.11 -0.02 0.17 -0.22 -3.33 0.00 0.00 175.10 171.80 3a0c s LEU 34 N -1.61 3.95 -0.11 2.54 2.96 0.18 -1.49 118.68 125.10 3a0c s LEU 34 Ca 0.04 -0.13 -0.06 0.00 -0.22 0.00 0.00 54.13 53.77 3a0c s LEU 34 Cb -0.09 -2.07 -0.04 0.00 0.50 0.00 0.00 46.19 44.49 3a0c s LEU 34 CO 0.03 -0.07 0.11 -0.31 -1.32 0.00 0.00 176.35 174.79 3a0c s TYR 35 N 1.72 3.50 -0.36 5.38 2.02 0.34 -1.06 117.35 128.89 3a0c s TYR 35 Ca 0.07 0.44 0.02 0.00 -0.37 0.00 0.00 57.07 57.24 3a0c s TYR 35 Cb -0.16 -1.90 0.11 0.00 -0.40 0.00 0.00 41.96 39.61 3a0c s TYR 35 CO 0.09 0.67 0.10 0.34 -1.57 0.00 0.00 175.55 175.19 3a0c s ASP 36 N -1.04 4.42 -1.54 2.29 -1.08 0.14 -1.92 116.67 117.94 3a0c s ASP 36 Ca 0.15 -2.14 -0.04 0.00 -0.52 0.00 0.00 52.55 50.01 3a0c s ASP 36 Cb -0.12 -1.36 0.01 0.00 -1.46 0.00 0.00 42.92 39.99 3a0c s ASP 36 CO 0.04 -0.37 0.42 -1.20 0.52 0.00 0.00 175.17 174.59 3a0c n SER 37 N 4.25 -5.63 0.00 -0.34 7.64 -0.56 -1.29 113.62 117.69 3a0c n SER 37 Ca 0.03 -0.21 0.00 0.00 1.01 0.00 0.00 58.87 59.70 3a0c n SER 37 Cb 0.40 -4.60 0.00 0.00 -1.01 0.00 0.00 64.21 59.00 3a0c n SER 37 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3a0c n GLY 38 N -1.32 0.40 3.54 0.23 0.00 -1.26 -5.05 105.19 101.73 3a0c n GLY 38 Ca -0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.51 3a0c n GLY 38 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3a0c s LYS 39 N -0.89 3.85 -0.33 1.61 2.20 -0.41 -5.05 119.74 120.72 3a0c s LYS 39 Ca 0.00 -0.38 -0.29 0.00 -0.36 0.00 0.00 55.97 54.95 3a0c s LYS 39 Cb 0.00 -3.51 -0.00 0.00 -1.51 0.00 0.00 37.83 32.81 3a0c s LYS 39 CO 0.00 -0.15 1.49 -1.25 -0.36 0.00 0.00 175.35 175.08 3a0c s PRO 40 N 1.60 3.68 -0.01 4.03 0.04 -1.26 0.28 135.00 143.36 3a0c s PRO 40 Ca 0.07 1.25 0.21 0.00 0.04 0.00 0.00 61.00 62.57 3a0c s PRO 40 Cb -0.15 -4.02 -0.25 0.00 0.04 0.00 0.00 34.50 30.12 3a0c s PRO 40 CO 0.07 -1.43 0.76 1.33 0.04 0.00 0.00 177.00 177.77 3a0c n VAL 41 N 6.76 0.01 -3.52 -0.36 0.24 -0.22 -4.96 118.33 116.28 3a0c n VAL 41 Ca 0.17 -0.20 -0.18 0.00 -2.04 0.00 0.00 64.34 62.10 3a0c n VAL 41 Cb 0.47 0.58 -0.06 0.00 -1.47 0.00 0.00 33.84 33.36 3a0c n VAL 41 CO 0.00 0.00 0.00 0.86 -2.14 0.00 0.00 176.83 175.55 3a0c s TRP 42 N -3.20 -0.65 -0.02 6.34 -0.00 -1.16 -4.99 118.94 115.27 3a0c s TRP 42 Ca 0.02 1.08 -0.29 0.00 -0.00 0.00 0.00 56.10 56.91 3a0c s TRP 42 Cb 0.15 0.42 0.08 0.00 -0.00 0.00 0.00 33.47 34.12 3a0c s TRP 42 CO 0.88 -0.61 0.74 0.00 -0.00 0.00 0.00 176.95 177.96 3a0c s ALA 43 N -1.30 -1.77 -0.92 5.86 0.00 -1.26 0.51 121.76 122.89 3a0c s ALA 43 Ca -0.10 1.15 0.25 0.00 0.00 0.00 0.00 51.96 53.25 3a0c s ALA 43 Cb -0.00 0.12 1.01 0.00 0.00 0.00 0.00 23.12 24.25 3a0c s ALA 43 CO 0.09 -0.48 1.78 -1.13 0.00 0.00 0.00 175.76 176.02 3a0c n SER 44 N 0.46 0.18 -2.10 0.00 3.41 0.15 -4.90 113.62 110.83 3a0c n SER 44 Ca -0.16 0.52 -0.19 0.00 -0.26 0.00 0.00 58.87 58.78 3a0c n SER 44 Cb 0.59 -0.57 -0.02 0.00 -0.26 0.00 0.00 64.21 63.95 3a0c n SER 44 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3a0c n ASN 45 N -1.68 -5.51 -1.42 4.04 3.02 -1.26 -4.88 115.26 107.57 3a0c n ASN 45 Ca 0.06 0.05 0.08 0.00 -0.03 0.00 0.00 54.58 54.74 3a0c n ASN 45 Cb 0.31 -4.57 0.33 0.00 -0.61 0.00 0.00 39.78 35.24 3a0c n ASN 45 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3a0c n THR 46 N -3.80 2.21 -1.68 3.41 -2.24 -1.26 -4.99 114.28 105.93 3a0c n THR 46 Ca -0.22 -1.44 -0.47 0.00 -2.27 0.00 0.00 64.05 59.64 3a0c n THR 46 Cb 0.67 -0.08 -0.04 0.00 -2.10 0.00 0.00 70.33 68.77 3a0c n THR 46 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3a0c n GLY 47 N 0.45 1.44 1.52 3.38 0.00 -1.26 -1.45 105.19 109.28 3a0c n GLY 47 Ca 0.24 0.82 0.00 0.00 0.00 0.00 0.00 46.02 47.09 3a0c n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a0c n GLY 48 N 4.26 0.76 0.05 -0.02 0.00 0.33 -4.93 105.19 105.63 3a0c n GLY 48 Ca 0.21 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.36 3a0c n GLY 48 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3a0c n LEU 49 N 0.00 0.54 -3.83 0.99 4.77 -0.53 -4.98 117.00 113.96 3a0c n LEU 49 Ca 0.00 0.01 -0.05 0.00 -0.03 0.00 0.00 56.01 55.94 3a0c n LEU 49 Cb 0.00 -0.25 0.01 0.00 -2.33 0.00 0.00 43.42 40.85 3a0c n LEU 49 CO 0.00 0.12 0.69 -0.83 -1.33 0.00 0.00 177.39 176.04 3a0c s GLY 50 N -2.88 0.05 0.05 -0.72 0.00 -1.26 -5.03 107.32 97.53 3a0c s GLY 50 Ca 0.15 -0.30 0.07 0.00 0.00 0.00 0.00 44.72 44.64 3a0c s GLY 50 CO 0.63 0.86 -0.19 -0.56 0.00 0.00 0.00 173.10 173.84 3a0c s SER 51 N -3.15 2.32 -1.40 1.64 0.01 -1.26 -4.26 113.70 107.61 3a0c s SER 51 Ca 0.17 -0.52 -0.08 0.00 1.31 0.00 0.00 55.95 56.82 3a0c s SER 51 Cb -0.03 -0.18 0.04 0.00 0.21 0.00 0.00 66.02 66.05 3a0c s SER 51 CO 0.06 0.13 1.00 0.61 0.41 0.00 0.00 173.24 175.44 3a0c n GLY 52 N 1.79 -0.46 3.81 3.44 0.00 -1.26 0.67 105.19 113.17 3a0c n GLY 52 Ca -0.18 0.19 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 3a0c n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a0c s ARG 54 N -4.68 0.39 -0.33 0.00 1.70 -0.78 -2.04 118.95 113.22 3a0c s ARG 54 Ca 0.61 -0.23 -0.09 0.00 -0.47 0.00 0.00 55.73 55.54 3a0c s ARG 54 Cb -0.15 0.16 0.01 0.00 -0.57 0.00 0.00 34.95 34.40 3a0c s ARG 54 CO 0.49 -0.09 0.15 -1.17 -1.08 0.00 0.00 175.30 173.60 3a0c s LEU 55 N -0.97 4.25 -0.15 -1.89 2.96 -0.31 -1.93 118.68 120.63 3a0c s LEU 55 Ca -0.11 -0.78 -0.04 0.00 -0.22 0.00 0.00 54.13 52.99 3a0c s LEU 55 Cb -0.06 -1.97 -0.03 0.00 0.50 0.00 0.00 46.19 44.64 3a0c s LEU 55 CO 0.01 -0.27 -0.03 -0.89 -1.32 0.00 0.00 176.35 173.86 3a0c s THR 56 N 1.55 4.01 -0.39 3.68 2.01 0.07 0.01 115.64 126.57 3a0c s THR 56 Ca 0.03 -0.32 -0.10 0.00 0.31 0.00 0.00 61.69 61.61 3a0c s THR 56 Cb -0.18 -2.76 0.05 0.00 0.01 0.00 0.00 72.50 69.63 3a0c s THR 56 CO 0.05 0.50 0.22 -0.22 -0.69 0.00 0.00 174.62 174.48 3a0c s LEU 57 N 0.29 4.89 0.81 4.42 2.96 -1.01 -0.61 118.68 130.44 3a0c s LEU 57 Ca -0.02 -1.25 -0.11 0.00 -0.22 0.00 0.00 54.13 52.52 3a0c s LEU 57 Cb -0.14 -1.99 0.08 0.00 0.50 0.00 0.00 46.19 44.64 3a0c s LEU 57 CO 0.03 -0.46 1.09 -1.00 -1.32 0.00 0.00 176.35 174.69 3a0c s HIS 58 N 1.48 2.72 -1.49 5.38 3.76 -0.46 -3.94 115.29 122.73 3a0c s HIS 58 Ca 0.02 1.21 0.12 0.00 -0.15 0.00 0.00 55.06 56.26 3a0c s HIS 58 Cb -0.21 -3.11 0.61 0.00 1.11 0.00 0.00 32.58 30.98 3a0c s HIS 58 CO 0.04 -1.88 1.27 0.09 -0.85 0.00 0.00 174.74 173.40 3a0c n ASN 59 N -3.52 0.00 -1.07 1.40 3.02 -1.26 -2.09 115.26 111.73 3a0c n ASN 59 Ca 0.07 0.06 0.09 0.00 -0.03 0.00 0.00 54.58 54.78 3a0c n ASN 59 Cb 0.56 -0.25 0.25 0.00 -0.61 0.00 0.00 39.78 39.73 3a0c n ASN 59 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 3a0c n ASN 60 N -1.25 3.54 0.00 6.41 6.94 -1.26 -0.35 115.26 129.28 3a0c n ASN 60 Ca 0.06 -1.99 0.00 0.00 -0.02 0.00 0.00 54.58 52.63 3a0c n ASN 60 Cb 0.09 -0.38 0.00 0.00 -2.36 0.00 0.00 39.78 37.13 3a0c n ASN 60 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3a0c n GLY 61 N 1.22 1.07 3.68 4.83 0.00 -0.89 0.17 105.19 115.27 3a0c n GLY 61 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 3a0c n GLY 61 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3a0c s ASN 62 N -2.99 7.01 -0.32 1.61 2.47 -1.23 -4.42 114.94 117.08 3a0c s ASN 62 Ca 0.00 1.25 -0.13 0.00 0.42 0.00 0.00 52.86 54.39 3a0c s ASN 62 Cb 0.00 -2.47 -0.02 0.00 -1.45 0.00 0.00 41.25 37.30 3a0c s ASN 62 CO 0.00 -0.40 0.28 -0.22 -3.72 0.00 0.00 177.10 173.04 3a0c s LEU 63 N 2.08 4.36 0.04 3.21 2.96 -1.26 -1.36 118.68 128.71 3a0c s LEU 63 Ca 0.40 -0.23 0.07 0.00 -0.22 0.00 0.00 54.13 54.16 3a0c s LEU 63 Cb -0.17 -2.22 -0.02 0.00 0.50 0.00 0.00 46.19 44.28 3a0c s LEU 63 CO 0.14 -0.22 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.04 3a0c s VAL 64 N 1.85 1.72 -0.26 1.68 1.01 0.23 -1.33 120.40 125.29 3a0c s VAL 64 Ca 0.09 -1.20 -0.07 0.00 0.00 0.00 0.00 61.98 60.80 3a0c s VAL 64 Cb -0.17 -1.49 -0.02 0.00 0.00 0.00 0.00 36.38 34.71 3a0c s VAL 64 CO 0.11 0.24 0.05 -0.63 0.00 0.00 0.00 175.10 174.87 3a0c s ILE 65 N -0.78 4.07 -0.05 2.22 1.01 0.16 -0.75 121.20 127.07 3a0c s ILE 65 Ca 0.08 -0.36 0.02 0.00 0.00 0.00 0.00 60.65 60.39 3a0c s ILE 65 Cb -0.09 -2.95 -0.03 0.00 0.01 0.00 0.00 42.46 39.41 3a0c s ILE 65 CO 0.02 0.29 -0.08 -0.31 0.00 0.00 0.00 174.94 174.85 3a0c s TYR 66 N 1.56 2.87 0.06 3.97 2.02 -0.81 -0.44 117.35 126.58 3a0c s TYR 66 Ca 0.05 -0.03 -0.01 0.00 -0.37 0.00 0.00 57.07 56.71 3a0c s TYR 66 Cb -0.15 -1.67 0.01 0.00 -0.40 0.00 0.00 41.96 39.75 3a0c s TYR 66 CO 0.02 0.31 0.08 -0.40 -1.57 0.00 0.00 175.55 174.00 3a0c n ASP 67 N 2.06 0.01 0.19 2.29 5.68 -0.86 -1.86 116.55 124.06 3a0c n ASP 67 Ca -0.17 -1.04 0.14 0.00 -0.50 0.00 0.00 54.79 53.22 3a0c n ASP 67 Cb 0.53 -0.06 0.55 0.00 -1.14 0.00 0.00 41.12 40.99 3a0c n ASP 67 CO 0.00 0.00 0.00 -0.61 -1.33 0.00 0.00 177.20 175.26 3a0c h GLN 68 N 0.00 0.00 -0.49 0.11 4.15 0.21 -2.71 115.11 116.39 3a0c h GLN 68 Ca -0.03 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.38 3a0c h GLN 68 Cb 0.08 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.76 3a0c h GLN 68 CO 0.02 0.00 0.01 0.43 -1.93 0.00 0.00 178.83 177.36 3a0c n SER 69 N -2.59 5.13 -2.30 -0.69 7.64 -1.26 -4.95 113.62 114.60 3a0c n SER 69 Ca 0.02 -2.98 -0.20 0.00 1.01 0.00 0.00 58.87 56.72 3a0c n SER 69 Cb 0.28 -0.65 -0.00 0.00 -1.01 0.00 0.00 64.21 62.83 3a0c n SER 69 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3a0c n ASN 70 N 0.23 -5.61 -4.76 6.43 3.02 -1.02 -5.00 115.26 108.55 3a0c n ASN 70 Ca 0.27 -0.06 -0.38 0.00 -0.03 0.00 0.00 54.58 54.38 3a0c n ASN 70 Cb 1.12 -4.61 -0.06 0.00 -0.61 0.00 0.00 39.78 35.62 3a0c n ASN 70 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3a0c s ARG 71 N -5.07 4.26 -0.63 3.52 0.52 -1.26 -4.82 118.95 115.48 3a0c s ARG 71 Ca 0.04 0.58 -0.26 0.00 -0.52 0.00 0.00 55.73 55.57 3a0c s ARG 71 Cb -0.02 -3.36 -0.02 0.00 0.52 0.00 0.00 34.95 32.07 3a0c s ARG 71 CO 0.05 0.35 1.84 0.08 0.02 0.00 0.00 175.30 177.64 3a0c s VAL 72 N -0.05 3.37 0.03 3.52 1.01 -1.26 -2.03 120.40 124.99 3a0c s VAL 72 Ca 0.28 0.18 0.05 0.00 0.00 0.00 0.00 61.98 62.49 3a0c s VAL 72 Cb -0.17 -3.98 -0.24 0.00 0.00 0.00 0.00 36.38 31.99 3a0c s VAL 72 CO 0.14 -0.95 0.96 0.40 0.00 0.00 0.00 175.10 175.66 3a0c h ILE 73 N 6.87 1.28 -2.15 2.22 1.08 -1.12 -3.48 117.51 122.22 3a0c h ILE 73 Ca -0.25 -3.01 -0.01 0.00 -0.39 0.00 0.00 64.86 61.20 3a0c h ILE 73 Cb 1.15 2.70 -0.18 0.00 -3.07 0.00 0.00 36.82 37.43 3a0c h ILE 73 CO 1.22 0.79 0.28 0.86 -0.69 0.00 0.00 178.15 180.61 3a0c s TRP 74 N -2.65 -0.56 -0.20 1.37 -0.00 -1.12 -4.97 118.94 110.80 3a0c s TRP 74 Ca -0.04 0.81 -0.28 0.00 -0.00 0.00 0.00 56.10 56.60 3a0c s TRP 74 Cb 0.08 0.46 0.11 0.00 -0.00 0.00 0.00 33.47 34.12 3a0c s TRP 74 CO 0.83 -0.61 0.91 1.14 -0.00 0.00 0.00 176.95 179.23 3a0c s GLN 75 N -1.84 0.68 0.29 5.86 -2.07 -1.26 0.36 119.66 121.68 3a0c s GLN 75 Ca -0.06 0.47 0.25 0.00 -1.82 0.00 0.00 55.36 54.20 3a0c s GLN 75 Cb -0.00 0.33 0.56 0.00 -1.09 0.00 0.00 33.01 32.80 3a0c s GLN 75 CO 0.02 -0.15 1.64 1.79 -1.32 0.00 0.00 175.29 177.28 3a0c h THR 76 N 3.26 0.00 -1.70 3.63 1.35 -1.59 -3.47 112.91 114.38 3a0c h THR 76 Ca -0.25 -0.69 -0.36 0.00 -0.55 0.00 0.00 66.41 64.56 3a0c h THR 76 Cb 1.16 1.63 -0.11 0.00 -1.73 0.00 0.00 68.15 69.11 3a0c h THR 76 CO 0.21 0.00 -0.36 1.17 -0.25 0.00 0.00 175.52 176.29 3a0c n LYS 77 N -2.58 -1.51 -1.47 4.72 4.81 -1.26 -4.86 118.16 116.01 3a0c n LYS 77 Ca 0.05 0.99 -0.27 0.00 -0.87 0.00 0.00 58.31 58.20 3a0c n LYS 77 Cb 0.47 -5.39 -0.04 0.00 0.02 0.00 0.00 35.03 30.09 3a0c n LYS 77 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 3a0c n THR 78 N -2.55 3.30 -3.30 3.15 -2.24 -1.26 -4.95 114.28 106.43 3a0c n THR 78 Ca -0.18 -2.98 -0.38 0.00 -2.27 0.00 0.00 64.05 58.23 3a0c n THR 78 Cb 0.59 -1.54 -0.06 0.00 -2.10 0.00 0.00 70.33 67.22 3a0c n THR 78 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3a0c s ASN 79 N 0.21 6.78 0.00 3.42 4.22 -1.26 -3.47 114.94 124.85 3a0c s ASN 79 Ca 0.57 0.93 0.00 0.00 -2.14 0.00 0.00 52.86 52.22 3a0c s ASN 79 Cb 0.38 -2.30 0.00 0.00 1.28 0.00 0.00 41.25 40.60 3a0c s ASN 79 CO -0.22 0.06 0.00 0.61 -2.04 0.00 0.00 177.10 175.51 3a0c n GLY 80 N 2.88 4.60 3.68 0.45 0.00 0.46 -4.93 105.19 112.34 3a0c n GLY 80 Ca -0.08 -0.62 -0.46 0.00 0.00 0.00 0.00 46.02 44.86 3a0c n GLY 80 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3a0c n LYS 81 N 0.00 2.30 -1.88 1.61 4.81 -1.26 -4.75 118.16 118.99 3a0c n LYS 81 Ca 0.00 0.84 -0.39 0.00 -0.87 0.00 0.00 58.31 57.89 3a0c n LYS 81 Cb 0.00 -2.67 -0.03 0.00 0.02 0.00 0.00 35.03 32.35 3a0c n LYS 81 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 3a0c s GLU 82 N 2.87 2.61 0.00 1.64 2.56 -1.26 -4.42 118.70 122.71 3a0c s GLU 82 Ca 0.86 1.03 0.00 0.00 0.00 0.00 0.00 54.97 56.86 3a0c s GLU 82 Cb -0.64 -4.41 0.00 0.00 2.00 0.00 0.00 34.13 31.08 3a0c s GLU 82 CO 0.44 -2.72 0.00 -3.47 -0.56 0.00 0.00 175.26 168.96 3a0c n ASP 83 N 13.20 0.00 -3.73 -1.70 -0.08 0.53 -4.98 116.55 119.79 3a0c n ASP 83 Ca 0.26 0.00 -0.12 0.00 -1.51 0.00 0.00 54.79 53.42 3a0c n ASP 83 Cb 0.52 0.00 -0.12 0.00 2.34 0.00 0.00 41.12 43.86 3a0c n ASP 83 CO 0.00 0.00 0.00 -1.00 0.12 0.00 0.00 177.20 176.32 3a0c s HIS 84 N 2.55 -0.39 0.44 -0.67 3.76 -1.23 -4.66 115.29 115.09 3a0c s HIS 84 Ca 0.00 0.90 0.03 0.00 -0.15 0.00 0.00 55.06 55.84 3a0c s HIS 84 Cb 0.00 0.11 -0.02 0.00 1.11 0.00 0.00 32.58 33.78 3a0c s HIS 84 CO 0.00 -0.23 0.09 0.71 -0.85 0.00 0.00 174.74 174.46 3a0c s TYR 85 N 0.96 1.82 -0.05 1.40 1.51 -1.26 -2.86 117.35 118.88 3a0c s TYR 85 Ca -0.07 -1.19 -0.07 0.00 -1.01 0.00 0.00 57.07 54.73 3a0c s TYR 85 Cb -0.07 -1.29 0.01 0.00 -0.11 0.00 0.00 41.96 40.50 3a0c s TYR 85 CO -0.07 -0.15 0.18 0.54 -1.11 0.00 0.00 175.55 174.95 3a0c s VAL 86 N -3.11 0.03 -0.27 0.71 0.11 -0.38 -0.96 120.40 116.53 3a0c s VAL 86 Ca 0.19 -0.24 -0.07 0.00 -2.93 0.00 0.00 61.98 58.93 3a0c s VAL 86 Cb 0.02 -0.34 -0.01 0.00 -1.53 0.00 0.00 36.38 34.52 3a0c s VAL 86 CO 0.11 -0.13 0.07 -0.22 -3.33 0.00 0.00 175.10 171.61 3a0c s LEU 87 N -0.42 3.61 -0.18 2.54 0.20 0.18 -0.66 118.68 123.94 3a0c s LEU 87 Ca -0.05 -0.44 0.00 0.00 0.69 0.00 0.00 54.13 54.33 3a0c s LEU 87 Cb -0.03 -1.90 0.01 0.00 -0.43 0.00 0.00 46.19 43.84 3a0c s LEU 87 CO 0.01 -0.11 -0.17 -0.69 -0.29 0.00 0.00 176.35 175.10 3a0c s VAL 88 N 1.56 2.31 -0.39 1.68 1.01 0.32 -1.06 120.40 125.83 3a0c s VAL 88 Ca 0.05 -0.86 -0.24 0.00 0.00 0.00 0.00 61.98 60.93 3a0c s VAL 88 Cb -0.16 -1.98 0.01 0.00 0.00 0.00 0.00 36.38 34.25 3a0c s VAL 88 CO 0.03 0.52 0.81 -0.22 0.00 0.00 0.00 175.10 176.23 3a0c s LEU 89 N 1.26 4.13 0.26 3.92 2.96 -0.35 -1.13 118.68 129.72 3a0c s LEU 89 Ca 0.04 0.26 -0.03 0.00 -0.22 0.00 0.00 54.13 54.18 3a0c s LEU 89 Cb -0.14 -3.05 -0.05 0.00 0.50 0.00 0.00 46.19 43.46 3a0c s LEU 89 CO -0.10 -0.80 0.49 -1.10 -1.32 0.00 0.00 176.35 173.52 3a0c s GLN 90 N 3.22 3.58 0.46 1.98 -0.21 -0.69 -4.82 119.66 123.19 3a0c s GLN 90 Ca 0.32 -0.14 0.32 0.00 0.02 0.00 0.00 55.36 55.87 3a0c s GLN 90 Cb -0.13 -2.72 1.59 0.00 1.00 0.00 0.00 33.01 32.75 3a0c s GLN 90 CO 0.19 0.29 1.96 1.96 -2.12 0.00 0.00 175.29 177.56 3a0c h GLN 91 N 1.77 0.00 -0.34 2.91 4.20 -1.88 0.37 115.11 122.13 3a0c h GLN 91 Ca -0.48 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.23 3a0c h GLN 91 Cb 1.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.97 3a0c h GLN 91 CO 0.67 0.00 0.00 -0.40 -0.67 0.00 0.00 178.83 178.43 3a0c n ASP 92 N -2.66 1.85 0.00 1.46 5.75 -1.26 -4.54 116.55 117.15 3a0c n ASP 92 Ca -0.01 -1.99 0.00 0.00 -0.01 0.00 0.00 54.79 52.78 3a0c n ASP 92 Cb 0.12 -0.23 0.00 0.00 -1.03 0.00 0.00 41.12 39.98 3a0c n ASP 92 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 3a0c n ARG 93 N 0.51 -0.43 -3.26 0.11 0.63 0.13 -5.01 116.66 109.34 3a0c n ARG 93 Ca 0.12 0.11 -0.39 0.00 -0.92 0.00 0.00 57.85 56.77 3a0c n ARG 93 Cb 0.29 -3.70 -0.06 0.00 0.45 0.00 0.00 32.46 29.44 3a0c n ARG 93 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 3a0c s ASN 94 N -2.29 7.08 -0.33 6.15 2.47 -1.25 -4.80 114.94 121.97 3a0c s ASN 94 Ca 0.00 1.28 -0.09 0.00 0.42 0.00 0.00 52.86 54.47 3a0c s ASN 94 Cb 0.00 -2.36 0.01 0.00 -1.45 0.00 0.00 41.25 37.45 3a0c s ASN 94 CO 0.00 0.27 0.15 -0.69 -3.72 0.00 0.00 177.10 173.11 3a0c s VAL 95 N -1.11 4.38 0.09 -5.21 1.01 -1.26 -1.70 120.40 116.59 3a0c s VAL 95 Ca 0.29 -0.66 0.10 0.00 0.00 0.00 0.00 61.98 61.70 3a0c s VAL 95 Cb -0.20 -3.32 -0.03 0.00 0.00 0.00 0.00 36.38 32.83 3a0c s VAL 95 CO 0.19 -0.03 -0.25 -0.69 0.00 0.00 0.00 175.10 174.32 3a0c s VAL 96 N 1.55 2.34 -0.22 2.92 1.01 -0.28 -4.92 120.40 122.80 3a0c s VAL 96 Ca 0.03 -1.53 -0.06 0.00 0.00 0.00 0.00 61.98 60.42 3a0c s VAL 96 Cb -0.18 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 3a0c s VAL 96 CO 0.05 0.22 0.03 -0.63 0.00 0.00 0.00 175.10 174.77 3a0c s ILE 97 N -0.96 4.12 0.18 2.22 1.01 -1.26 0.12 121.20 126.63 3a0c s ILE 97 Ca 0.14 -0.25 0.10 0.00 0.00 0.00 0.00 60.65 60.64 3a0c s ILE 97 Cb -0.10 -2.89 -0.04 0.00 0.01 0.00 0.00 42.46 39.44 3a0c s ILE 97 CO 0.05 0.40 -0.17 -0.31 0.00 0.00 0.00 174.94 174.90 3a0c s TYR 98 N 1.22 2.47 0.00 3.97 1.51 0.16 -4.96 117.35 121.72 3a0c s TYR 98 Ca 0.04 -0.29 0.00 0.00 -1.01 0.00 0.00 57.07 55.81 3a0c s TYR 98 Cb -0.14 -1.23 0.00 0.00 -0.11 0.00 0.00 41.96 40.47 3a0c s TYR 98 CO 0.02 0.48 0.00 0.41 -1.11 0.00 0.00 175.55 175.36 3a0c n GLY 99 N 0.27 2.69 0.00 0.71 0.00 -1.26 -1.25 105.19 106.34 3a0c n GLY 99 Ca -0.12 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 44.93 3a0c n GLY 99 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3a0c n PRO 100 N -0.98 0.37 -2.56 1.61 -0.02 -1.26 -5.07 135.00 127.08 3a0c n PRO 100 Ca 0.00 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.07 3a0c n PRO 100 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 33.44 3a0c n PRO 100 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3a0c s VAL 101 N -0.39 3.89 -0.12 -1.45 -7.23 -1.13 -4.94 120.40 109.02 3a0c s VAL 101 Ca 0.00 1.71 0.09 0.00 -1.81 0.00 0.00 61.98 61.97 3a0c s VAL 101 Cb 0.00 -4.09 -0.14 0.00 0.56 0.00 0.00 36.38 32.71 3a0c s VAL 101 CO 0.00 0.33 0.01 0.52 -0.31 0.00 0.00 175.10 175.65 3a0c n VAL 102 N 2.04 0.82 -3.51 1.32 0.31 -1.26 -5.04 118.33 113.02 3a0c n VAL 102 Ca 0.01 -0.47 -0.10 0.00 -0.01 0.00 0.00 64.34 63.77 3a0c n VAL 102 Cb 0.46 -0.74 -0.03 0.00 -0.91 0.00 0.00 33.84 32.62 3a0c n VAL 102 CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 3a0c s TRP 103 N -2.29 -0.40 0.08 3.52 -0.00 -1.26 -5.18 118.94 113.40 3a0c s TRP 103 Ca -0.08 0.38 -0.20 0.00 -0.00 0.00 0.00 56.10 56.20 3a0c s TRP 103 Cb 0.04 0.51 0.04 0.00 -0.00 0.00 0.00 33.47 34.07 3a0c s TRP 103 CO 0.46 -0.55 0.47 0.00 -0.00 0.00 0.00 176.95 177.33 3a0c s ALA 104 N -2.68 -1.16 -0.17 5.86 0.00 -1.26 -5.05 121.76 117.29 3a0c s ALA 104 Ca 0.02 0.34 0.16 0.00 0.00 0.00 0.00 51.96 52.48 3a0c s ALA 104 Cb -0.01 0.50 0.06 0.00 0.00 0.00 0.00 23.12 23.67 3a0c s ALA 104 CO -0.06 -0.55 1.40 1.79 0.00 0.00 0.00 175.76 178.33 3a0c h THR 105 N 2.66 0.77 0.00 0.00 1.35 -2.03 -3.47 112.91 112.19 3a0c h THR 105 Ca -0.32 -2.11 0.00 0.00 -0.55 0.00 0.00 66.41 63.43 3a0c h THR 105 Cb 1.23 2.35 0.00 0.00 -1.73 0.00 0.00 68.15 70.00 3a0c h THR 105 CO 0.43 0.44 0.00 0.61 -0.25 0.00 0.00 175.52 176.75 3a0c n GLY 106 N 1.23 0.49 0.24 5.82 0.00 -1.26 -4.87 105.19 106.83 3a0c n GLY 106 Ca 0.01 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.19 3a0c n GLY 106 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3a0c h SER 107 N 0.00 0.00 -3.92 1.61 4.64 -2.05 -3.44 113.55 110.39 3a0c h SER 107 Ca 0.00 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 60.99 3a0c h SER 107 Cb 0.03 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.04 3a0c h SER 107 CO 0.00 0.00 -0.29 0.61 -0.87 0.00 0.00 176.83 176.28 3a0c n GLY 108 N 0.27 3.54 0.00 -0.77 0.00 -1.26 -5.32 105.19 101.64 3a0c n GLY 108 Ca 0.02 -2.00 0.10 0.00 0.00 0.00 0.00 46.02 44.14 3a0c n GLY 108 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77