#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h4o s PRO 2 N 0.00 4.27 0.60 0.00 0.02 -1.26 -4.38 135.00 134.25 1h4o s PRO 2 Ca 0.00 2.24 -0.19 0.00 0.02 0.00 0.00 61.00 63.07 1h4o s PRO 2 Cb 0.00 -3.18 -0.03 0.00 0.02 0.00 0.00 34.50 31.32 1h4o s PRO 2 CO 0.00 -0.49 1.29 -1.50 -0.33 0.00 0.00 177.00 175.97 1h4o s ILE 3 N 0.80 2.19 0.13 2.83 2.07 -0.64 -5.00 121.20 123.58 1h4o s ILE 3 Ca 0.65 0.13 -0.06 0.00 -1.41 0.00 0.00 60.65 59.96 1h4o s ILE 3 Cb -0.41 -3.06 -0.02 0.00 0.13 0.00 0.00 42.46 39.11 1h4o s ILE 3 CO 0.34 -0.02 0.18 -1.59 -1.91 0.00 0.00 174.94 171.94 1h4o s LYS 4 N -3.22 0.99 0.18 3.50 -2.85 -1.26 -5.07 119.74 112.01 1h4o s LYS 4 Ca 0.78 -1.20 -0.33 0.00 -1.00 0.00 0.00 55.97 54.23 1h4o s LYS 4 Cb -0.37 0.32 -0.15 0.00 -2.06 0.00 0.00 37.83 35.57 1h4o s LYS 4 CO 0.40 -0.32 1.23 0.28 0.10 0.00 0.00 175.35 177.04 1h4o n VAL 5 N -0.13 0.86 0.00 1.79 0.31 -1.26 -1.50 118.33 118.40 1h4o n VAL 5 Ca -0.09 -0.21 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 1h4o n VAL 5 Cb 0.63 -0.99 0.00 0.00 -0.91 0.00 0.00 33.84 32.57 1h4o n VAL 5 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1h4o n GLY 6 N 2.09 3.31 3.80 2.92 0.00 0.74 -5.00 105.19 113.05 1h4o n GLY 6 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 1h4o n GLY 6 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1h4o s ASP 7 N -0.50 6.16 0.26 1.61 1.01 -0.56 -4.73 116.67 119.92 1h4o s ASP 7 Ca 0.00 1.88 -0.27 0.00 0.71 0.00 0.00 52.55 54.87 1h4o s ASP 7 Cb 0.00 -2.55 -0.09 0.00 1.01 0.00 0.00 42.92 41.29 1h4o s ASP 7 CO 0.00 -0.91 0.90 0.00 0.21 0.00 0.00 175.17 175.38 1h4o s ALA 8 N -2.16 3.31 0.17 5.23 0.00 -1.26 -0.84 121.76 126.20 1h4o s ALA 8 Ca 0.66 0.52 -0.31 0.00 0.00 0.00 0.00 51.96 52.82 1h4o s ALA 8 Cb -0.16 -3.14 -0.10 0.00 0.00 0.00 0.00 23.12 19.72 1h4o s ALA 8 CO 0.26 0.22 1.55 0.42 0.00 0.00 0.00 175.76 178.21 1h4o s ILE 9 N -1.36 2.65 0.65 0.00 -1.09 0.38 -4.89 121.20 117.53 1h4o s ILE 9 Ca 0.44 0.47 -0.15 0.00 -2.23 0.00 0.00 60.65 59.18 1h4o s ILE 9 Cb -0.22 -3.30 -0.01 0.00 -1.58 0.00 0.00 42.46 37.35 1h4o s ILE 9 CO 0.27 0.04 1.10 -2.16 -1.23 0.00 0.00 174.94 172.96 1h4o s PRO 10 N 1.08 2.90 -1.50 2.79 0.04 -1.26 -4.64 135.00 134.40 1h4o s PRO 10 Ca 0.69 1.36 -0.09 0.00 0.04 0.00 0.00 61.00 63.00 1h4o s PRO 10 Cb -0.43 -1.97 -0.00 0.00 0.04 0.00 0.00 34.50 32.14 1h4o s PRO 10 CO 0.32 -1.17 2.70 0.00 0.04 0.00 0.00 177.00 178.89 1h4o n ALA 11 N -2.34 7.17 -2.16 8.56 0.00 -1.26 -3.81 120.51 126.67 1h4o n ALA 11 Ca 0.10 -3.76 -0.39 0.00 0.00 0.00 0.00 53.44 49.39 1h4o n ALA 11 Cb 0.52 -3.16 -0.06 0.00 0.00 0.00 0.00 19.45 16.75 1h4o n ALA 11 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1h4o s VAL 12 N 0.99 4.55 -0.15 0.00 1.01 -1.26 -4.79 120.40 120.75 1h4o s VAL 12 Ca 0.63 1.56 -0.19 0.00 0.00 0.00 0.00 61.98 63.97 1h4o s VAL 12 Cb 0.18 -4.07 -0.03 0.00 0.00 0.00 0.00 36.38 32.45 1h4o s VAL 12 CO -0.07 0.49 0.55 -0.70 0.00 0.00 0.00 175.10 175.37 1h4o s GLU 13 N -0.85 4.28 0.26 2.72 2.12 -1.26 -1.18 118.70 124.79 1h4o s GLU 13 Ca 0.35 0.52 0.02 0.00 0.36 0.00 0.00 54.97 56.22 1h4o s GLU 13 Cb -0.22 -3.51 -0.01 0.00 0.26 0.00 0.00 34.13 30.66 1h4o s GLU 13 CO 0.24 -0.03 0.07 1.33 -0.54 0.00 0.00 175.26 176.32 1h4o n VAL 14 N 4.16 0.00 -4.09 3.70 0.24 0.43 -4.97 118.33 117.80 1h4o n VAL 14 Ca -0.04 -1.46 -0.12 0.00 -2.04 0.00 0.00 64.34 60.68 1h4o n VAL 14 Cb 0.51 0.47 -0.11 0.00 -1.47 0.00 0.00 33.84 33.24 1h4o n VAL 14 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1h4o s PHE 15 N -2.39 0.73 -0.04 6.34 0.08 -0.13 -0.81 117.98 121.74 1h4o s PHE 15 Ca 0.10 -0.63 -0.01 0.00 0.12 0.00 0.00 56.93 56.51 1h4o s PHE 15 Cb 0.00 -0.43 0.03 0.00 -0.57 0.00 0.00 43.02 42.05 1h4o s PHE 15 CO 0.07 -0.11 0.01 -2.00 -0.10 0.00 0.00 175.22 173.09 1h4o s GLU 16 N -2.26 0.32 0.00 0.44 2.12 -0.24 0.42 118.70 119.50 1h4o s GLU 16 Ca -0.04 0.14 0.00 0.00 0.36 0.00 0.00 54.97 55.43 1h4o s GLU 16 Cb -0.05 -0.63 0.00 0.00 0.26 0.00 0.00 34.13 33.71 1h4o s GLU 16 CO -0.01 -0.22 0.00 0.41 -0.54 0.00 0.00 175.26 174.90 1h4o n GLY 17 N 4.64 1.68 3.32 -1.50 0.00 -1.26 -4.48 105.19 107.60 1h4o n GLY 17 Ca -0.16 -0.10 -0.13 0.00 0.00 0.00 0.00 46.02 45.63 1h4o n GLY 17 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1h4o s GLU 18 N 0.00 0.91 0.61 1.61 8.01 -1.26 -4.31 118.70 124.27 1h4o s GLU 18 Ca 0.00 -0.36 0.32 0.00 0.01 0.00 0.00 54.97 54.94 1h4o s GLU 18 Cb 0.00 0.41 1.88 0.00 -4.31 0.00 0.00 34.13 32.11 1h4o s GLU 18 CO 0.00 -0.31 2.21 -1.35 0.01 0.00 0.00 175.26 175.82 1h4o h PRO 19 N 3.03 0.00 -0.02 0.39 0.11 -1.87 -2.22 132.00 131.42 1h4o h PRO 19 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1h4o h PRO 19 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1h4o h PRO 19 CO 0.43 0.00 -0.01 0.41 -0.21 0.00 0.00 178.00 178.62 1h4o n GLY 20 N -1.30 0.06 3.44 -0.55 0.00 -1.26 -4.73 105.19 100.85 1h4o n GLY 20 Ca -0.01 -0.47 -0.44 0.00 0.00 0.00 0.00 46.02 45.10 1h4o n GLY 20 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1h4o s ASN 21 N -2.03 6.22 0.10 1.61 0.01 -0.84 -5.04 114.94 114.97 1h4o s ASN 21 Ca 0.36 -0.97 -0.06 0.00 -0.71 0.00 0.00 52.86 51.48 1h4o s ASN 21 Cb 0.21 -2.28 -0.05 0.00 0.41 0.00 0.00 41.25 39.53 1h4o s ASN 21 CO 0.34 -0.88 0.36 -0.54 -1.51 0.00 0.00 177.10 174.87 1h4o s LYS 22 N 2.55 3.64 -0.04 -0.60 1.02 -1.26 -1.08 119.74 123.97 1h4o s LYS 22 Ca 0.14 -0.03 -0.00 0.00 0.02 0.00 0.00 55.97 56.10 1h4o s LYS 22 Cb -0.20 -2.93 0.03 0.00 -0.52 0.00 0.00 37.83 34.20 1h4o s LYS 22 CO 0.11 0.53 -0.00 0.08 -0.92 0.00 0.00 175.35 175.15 1h4o s VAL 23 N -1.52 0.27 -0.32 3.17 1.01 0.01 -4.93 120.40 118.09 1h4o s VAL 23 Ca 0.36 0.08 -0.18 0.00 0.00 0.00 0.00 61.98 62.24 1h4o s VAL 23 Cb -0.13 -0.37 -0.01 0.00 0.00 0.00 0.00 36.38 35.87 1h4o s VAL 23 CO 0.21 0.19 0.54 0.21 0.00 0.00 0.00 175.10 176.25 1h4o s ASN 24 N 1.28 6.37 0.45 3.32 3.84 -1.26 -0.43 114.94 128.52 1h4o s ASN 24 Ca -0.06 0.19 0.14 0.00 0.21 0.00 0.00 52.86 53.34 1h4o s ASN 24 Cb -0.13 -2.28 1.07 0.00 -0.55 0.00 0.00 41.25 39.35 1h4o s ASN 24 CO -0.02 -0.43 2.02 -0.07 -2.79 0.00 0.00 177.10 175.81 1h4o h LEU 25 N 9.04 0.30 -0.66 3.21 3.38 -1.40 0.53 115.31 129.71 1h4o h LEU 25 Ca -0.28 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.56 1h4o h LEU 25 Cb 1.13 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 1h4o h LEU 25 CO 0.76 0.19 -0.42 0.00 0.09 0.00 0.00 178.44 179.07 1h4o h ALA 26 N 1.75 0.84 -0.11 1.53 0.00 -1.81 -3.08 119.26 118.39 1h4o h ALA 26 Ca 0.21 -0.45 -0.20 0.00 0.00 0.00 0.00 54.91 54.47 1h4o h ALA 26 Cb 0.38 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1h4o h ALA 26 CO -0.05 0.65 -0.76 0.93 0.00 0.00 0.00 179.25 180.03 1h4o h GLU 27 N 0.46 0.57 -0.93 0.00 5.08 -1.36 -3.01 114.58 115.38 1h4o h GLU 27 Ca 0.04 -0.47 0.09 0.00 -1.00 0.00 0.00 59.36 58.02 1h4o h GLU 27 Cb 0.93 0.10 -0.07 0.00 0.50 0.00 0.00 28.75 30.20 1h4o h GLU 27 CO 0.08 1.09 0.57 1.25 -1.00 0.00 0.00 179.01 181.00 1h4o h LEU 28 N 0.38 0.86 -1.62 1.33 5.85 -0.96 -2.52 115.31 118.63 1h4o h LEU 28 Ca -0.04 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1h4o h LEU 28 Cb 1.35 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.25 1h4o h LEU 28 CO 0.14 0.50 -0.07 0.49 -0.34 0.00 0.00 178.44 179.16 1h4o n PHE 29 N -4.63 0.00 -1.91 1.25 3.72 -1.20 -4.93 117.46 109.75 1h4o n PHE 29 Ca 0.16 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.14 1h4o n PHE 29 Cb 0.27 -0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.78 1h4o n PHE 29 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1h4o s LYS 30 N -2.08 4.21 -0.16 -1.08 2.20 -0.95 -3.02 119.74 118.86 1h4o s LYS 30 Ca 0.28 2.40 0.00 0.00 -0.36 0.00 0.00 55.97 58.29 1h4o s LYS 30 Cb 0.20 -3.12 0.00 0.00 -1.51 0.00 0.00 37.83 33.40 1h4o s LYS 30 CO 0.35 -0.58 0.00 0.41 -0.36 0.00 0.00 175.35 175.17 1h4o n GLY 31 N 3.18 0.47 3.23 5.54 0.00 -1.26 -4.94 105.19 111.41 1h4o n GLY 31 Ca 0.12 -0.18 -0.11 0.00 0.00 0.00 0.00 46.02 45.84 1h4o n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h4o s LYS 32 N -1.06 1.17 -0.17 1.61 1.02 -1.17 -4.91 119.74 116.22 1h4o s LYS 32 Ca 0.00 -1.52 -0.10 0.00 0.02 0.00 0.00 55.97 54.37 1h4o s LYS 32 Cb 0.00 0.29 -0.05 0.00 -0.52 0.00 0.00 37.83 37.55 1h4o s LYS 32 CO 0.00 -0.38 0.16 0.21 -0.92 0.00 0.00 175.35 174.42 1h4o s LYS 33 N -4.11 4.03 0.28 1.68 2.20 -1.26 -0.19 119.74 122.36 1h4o s LYS 33 Ca 0.33 -0.14 -0.03 0.00 -0.36 0.00 0.00 55.97 55.77 1h4o s LYS 33 Cb 0.06 -3.37 -0.02 0.00 -1.51 0.00 0.00 37.83 33.00 1h4o s LYS 33 CO 0.09 0.41 0.34 0.20 -0.36 0.00 0.00 175.35 176.02 1h4o s GLY 34 N 0.04 1.41 -0.05 5.54 0.00 0.82 -0.70 107.32 114.38 1h4o s GLY 34 Ca 0.11 -1.53 0.04 0.00 0.00 0.00 0.00 44.72 43.34 1h4o s GLY 34 CO 0.01 -1.12 -0.17 0.14 0.00 0.00 0.00 173.10 171.96 1h4o s VAL 35 N -3.67 1.43 -0.12 1.40 1.01 -0.21 -0.50 120.40 119.73 1h4o s VAL 35 Ca 0.33 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.64 1h4o s VAL 35 Cb 0.02 -1.24 0.01 0.00 0.00 0.00 0.00 36.38 35.18 1h4o s VAL 35 CO 0.17 0.41 -0.19 -0.22 0.00 0.00 0.00 175.10 175.26 1h4o s LEU 36 N 0.17 1.95 0.02 3.92 2.96 -0.63 -1.28 118.68 125.79 1h4o s LEU 36 Ca -0.07 -0.52 0.05 0.00 -0.22 0.00 0.00 54.13 53.37 1h4o s LEU 36 Cb -0.13 -1.29 -0.02 0.00 0.50 0.00 0.00 46.19 45.26 1h4o s LEU 36 CO 0.03 0.06 -0.14 0.72 -1.32 0.00 0.00 176.35 175.70 1h4o s PHE 37 N 0.81 1.26 0.05 5.38 -0.71 -0.07 0.31 117.98 125.01 1h4o s PHE 37 Ca -0.09 -0.31 0.06 0.00 -1.04 0.00 0.00 56.93 55.56 1h4o s PHE 37 Cb -0.16 -0.77 -0.03 0.00 -1.21 0.00 0.00 43.02 40.85 1h4o s PHE 37 CO -0.00 0.02 -0.11 0.20 -1.34 0.00 0.00 175.22 173.98 1h4o s GLY 38 N -0.81 1.71 0.04 1.99 0.00 0.07 -0.90 107.32 109.41 1h4o s GLY 38 Ca 0.03 -1.14 0.06 0.00 0.00 0.00 0.00 44.72 43.67 1h4o s GLY 38 CO 0.01 -1.05 -0.16 -1.34 0.00 0.00 0.00 173.10 170.55 1h4o s VAL 39 N -1.04 1.29 0.29 1.40 -7.23 -0.63 -2.08 120.40 112.39 1h4o s VAL 39 Ca 0.18 -1.04 -0.00 0.00 -1.81 0.00 0.00 61.98 59.30 1h4o s VAL 39 Cb -0.11 -1.15 0.28 0.00 0.56 0.00 0.00 36.38 35.96 1h4o s VAL 39 CO 0.09 0.09 1.89 -0.65 -0.31 0.00 0.00 175.10 176.21 1h4o h PRO 40 N 4.96 1.05 -1.61 4.82 0.11 -1.82 -3.39 132.00 136.12 1h4o h PRO 40 Ca -0.39 -0.06 0.06 0.00 0.11 0.00 0.00 66.00 65.71 1h4o h PRO 40 Cb 1.17 -0.24 -0.25 0.00 0.11 0.00 0.00 31.00 31.79 1h4o h PRO 40 CO 0.44 0.70 0.46 0.20 -0.21 0.00 0.00 178.00 179.59 1h4o s GLY 41 N -3.37 -0.19 0.39 -0.55 0.00 -1.26 -4.43 107.32 97.90 1h4o s GLY 41 Ca -0.12 2.50 -0.26 0.00 0.00 0.00 0.00 44.72 46.84 1h4o s GLY 41 CO 0.81 1.64 1.18 0.00 0.00 0.00 0.00 173.10 176.73 1h4o n ALA 42 N 1.87 0.87 -0.90 3.20 0.00 -1.26 -2.75 120.51 121.55 1h4o n ALA 42 Ca -0.12 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1h4o n ALA 42 Cb 0.56 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.82 1h4o n ALA 42 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1h4o n PHE 43 N -0.12 0.00 -2.74 0.00 3.72 -1.26 -5.01 117.46 112.05 1h4o n PHE 43 Ca 0.07 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.16 1h4o n PHE 43 Cb 0.38 -0.61 -0.04 0.00 -0.94 0.00 0.00 39.48 38.27 1h4o n PHE 43 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1h4o s THR 44 N -2.39 4.69 0.10 4.37 -4.23 -1.11 -4.91 115.64 112.17 1h4o s THR 44 Ca 0.00 0.86 -0.25 0.00 -1.18 0.00 0.00 61.69 61.11 1h4o s THR 44 Cb 0.00 -3.71 -0.10 0.00 1.34 0.00 0.00 72.50 70.03 1h4o s THR 44 CO 0.00 -0.53 1.67 -0.65 -0.54 0.00 0.00 174.62 174.57 1h4o h PRO 45 N 1.27 -0.32 -0.39 3.99 0.11 -1.95 0.12 132.00 134.82 1h4o h PRO 45 Ca -0.47 0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.61 1h4o h PRO 45 Cb 1.18 0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 1h4o h PRO 45 CO 0.63 -0.22 0.05 0.78 -0.21 0.00 0.00 178.00 179.03 1h4o h GLY 46 N -0.34 0.71 1.16 -0.55 0.00 -1.95 0.67 103.07 102.76 1h4o h GLY 46 Ca 0.02 -0.49 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1h4o h GLY 46 CO -0.08 0.45 0.53 0.00 0.00 0.00 0.00 176.54 177.43 1h4o h SER 48 N 1.15 0.25 0.27 0.00 0.02 -0.60 -0.16 113.55 114.48 1h4o h SER 48 Ca 0.31 -0.38 -0.14 0.00 -0.84 0.00 0.00 61.79 60.73 1h4o h SER 48 Cb -0.09 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.35 1h4o h SER 48 CO -0.06 1.32 -1.86 0.29 -1.14 0.00 0.00 176.83 175.38 1h4o n LYS 49 N -3.35 0.65 0.05 3.45 4.76 0.19 -4.48 118.16 119.44 1h4o n LYS 49 Ca -0.16 -0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.27 1h4o n LYS 49 Cb 1.03 -1.62 0.00 0.00 -1.84 0.00 0.00 35.03 32.60 1h4o n LYS 49 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 1h4o n THR 50 N -2.59 0.89 0.30 -0.18 -1.04 -0.68 -4.76 114.28 106.22 1h4o n THR 50 Ca -0.13 0.30 -0.12 0.00 -2.04 0.00 0.00 64.05 62.06 1h4o n THR 50 Cb 0.79 -1.45 -0.06 0.00 -1.82 0.00 0.00 70.33 67.80 1h4o n THR 50 CO 0.00 0.00 0.00 -0.74 -0.64 0.00 0.00 175.07 173.69 1h4o h HIS 51 N 0.00 -0.71 0.11 -1.42 -0.00 -1.28 -2.13 115.15 109.73 1h4o h HIS 51 Ca 0.00 -0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.35 1h4o h HIS 51 Cb 0.16 0.23 -0.00 0.00 -0.00 0.00 0.00 27.41 27.80 1h4o h HIS 51 CO 0.00 -0.44 -0.08 1.25 -0.00 0.00 0.00 177.93 178.67 1h4o h LEU 52 N -0.82 -0.19 -1.58 0.26 5.85 -1.28 -2.95 115.31 114.60 1h4o h LEU 52 Ca -0.08 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.68 1h4o h LEU 52 Cb 0.58 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.65 1h4o h LEU 52 CO 0.13 -0.12 0.31 -0.65 -0.34 0.00 0.00 178.44 177.76 1h4o h PRO 53 N -0.19 0.54 -0.47 5.25 0.11 -1.78 -0.87 132.00 134.60 1h4o h PRO 53 Ca -0.01 -0.03 0.06 0.00 0.11 0.00 0.00 66.00 66.13 1h4o h PRO 53 Cb 0.16 -0.12 -0.05 0.00 0.11 0.00 0.00 31.00 31.10 1h4o h PRO 53 CO 0.00 0.36 0.17 0.78 -0.21 0.00 0.00 178.00 179.10 1h4o h GLY 54 N 0.56 0.62 1.46 -0.55 0.00 -1.21 0.20 103.07 104.15 1h4o h GLY 54 Ca 0.18 -0.10 -0.14 0.00 0.00 0.00 0.00 47.33 47.27 1h4o h GLY 54 CO -0.04 0.02 -0.45 0.74 0.00 0.00 0.00 176.54 176.81 1h4o h PHE 55 N 0.35 0.71 -0.12 5.60 0.04 -1.22 -1.51 116.94 120.79 1h4o h PHE 55 Ca 0.22 -0.22 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 1h4o h PHE 55 Cb 0.21 -0.15 -0.01 0.00 2.20 0.00 0.00 35.95 38.21 1h4o h PHE 55 CO -0.15 0.93 0.05 0.28 -0.60 0.00 0.00 178.31 178.82 1h4o h VAL 56 N 0.47 1.14 -0.71 -0.55 2.07 -0.88 -2.44 116.25 115.35 1h4o h VAL 56 Ca 0.03 -0.41 0.02 0.00 0.82 0.00 0.00 66.70 67.16 1h4o h VAL 56 Cb 0.97 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 31.89 1h4o h VAL 56 CO 0.09 0.12 0.47 -0.33 0.02 0.00 0.00 177.57 177.94 1h4o h GLU 57 N 0.04 0.90 -0.54 1.57 5.08 -0.50 -2.61 114.58 118.52 1h4o h GLU 57 Ca 0.04 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1h4o h GLU 57 Cb 0.15 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1h4o h GLU 57 CO -0.00 0.59 0.00 1.04 -1.00 0.00 0.00 179.01 179.64 1h4o n GLN 58 N -4.44 2.37 -0.15 2.33 1.13 -0.58 -4.57 117.38 113.48 1h4o n GLN 58 Ca 0.08 -1.87 -0.03 0.00 -1.94 0.00 0.00 57.00 53.24 1h4o n GLN 58 Cb 0.07 -1.48 0.05 0.00 0.11 0.00 0.00 30.24 28.99 1h4o n GLN 58 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1h4o h ALA 59 N 3.85 0.51 -0.33 -1.58 0.00 -1.03 -0.73 119.26 119.95 1h4o h ALA 59 Ca 0.00 0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 1h4o h ALA 59 Cb 0.79 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1h4o h ALA 59 CO 0.05 -0.31 -0.30 0.93 0.00 0.00 0.00 179.25 179.61 1h4o h GLU 60 N 0.22 0.71 -0.50 0.00 3.07 -1.84 -1.82 114.58 114.42 1h4o h GLU 60 Ca 0.23 -0.32 -0.04 0.00 -0.50 0.00 0.00 59.36 58.73 1h4o h GLU 60 Cb 0.30 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.17 1h4o h GLU 60 CO -0.30 0.93 0.15 0.00 -1.40 0.00 0.00 179.01 178.38 1h4o h ALA 61 N 1.05 1.31 -0.06 3.43 0.00 -1.67 -0.27 119.26 123.05 1h4o h ALA 61 Ca 0.07 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1h4o h ALA 61 Cb 0.82 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1h4o h ALA 61 CO 0.07 0.49 -0.12 -0.07 0.00 0.00 0.00 179.25 179.62 1h4o h LEU 62 N 0.73 0.21 -1.49 0.00 3.38 -1.06 -2.68 115.31 114.41 1h4o h LEU 62 Ca 0.17 -0.56 0.12 0.00 0.09 0.00 0.00 57.88 57.69 1h4o h LEU 62 Cb 0.24 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.88 1h4o h LEU 62 CO -0.01 0.73 0.49 0.11 0.09 0.00 0.00 178.44 179.85 1h4o h LYS 63 N -0.31 0.53 0.00 1.13 1.57 -1.10 -0.60 116.57 117.80 1h4o h LYS 63 Ca 0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1h4o h LYS 63 Cb 0.70 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.89 1h4o h LYS 63 CO 0.03 0.35 0.00 0.00 -0.57 0.00 0.00 179.45 179.26 1h4o h ALA 64 N 1.64 1.00 -0.43 3.86 0.00 -0.70 -0.22 119.26 124.42 1h4o h ALA 64 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1h4o h ALA 64 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1h4o h ALA 64 CO -0.12 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.76 1h4o n LYS 65 N -2.36 3.14 -0.67 0.00 5.02 -0.32 -4.94 118.16 118.03 1h4o n LYS 65 Ca 0.01 -2.54 0.00 0.00 -2.02 0.00 0.00 58.31 53.75 1h4o n LYS 65 Cb 0.17 -1.62 0.00 0.00 -0.02 0.00 0.00 35.03 33.56 1h4o n LYS 65 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1h4o n GLY 66 N 0.46 0.67 3.62 0.72 0.00 -0.09 -5.02 105.19 105.55 1h4o n GLY 66 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 1h4o n GLY 66 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h4o s VAL 67 N -2.08 4.15 -0.13 1.61 1.01 -0.67 -4.42 120.40 119.87 1h4o s VAL 67 Ca 0.00 1.27 0.22 0.00 0.00 0.00 0.00 61.98 63.46 1h4o s VAL 67 Cb 0.00 -4.27 -0.17 0.00 0.00 0.00 0.00 36.38 31.94 1h4o s VAL 67 CO 0.00 -0.62 0.74 0.00 0.00 0.00 0.00 175.10 175.22 1h4o n GLN 68 N 7.49 0.63 -4.00 2.72 6.02 0.13 -3.78 117.38 126.59 1h4o n GLN 68 Ca 0.14 -0.02 -0.15 0.00 -0.01 0.00 0.00 57.00 56.97 1h4o n GLN 68 Cb 0.47 -1.68 -0.15 0.00 1.02 0.00 0.00 30.24 29.91 1h4o n GLN 68 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1h4o s VAL 69 N -3.36 0.21 -0.10 5.09 0.11 -1.23 -5.05 120.40 116.06 1h4o s VAL 69 Ca -0.04 -0.07 0.00 0.00 -2.93 0.00 0.00 61.98 58.94 1h4o s VAL 69 Cb 0.11 -0.21 0.02 0.00 -1.53 0.00 0.00 36.38 34.78 1h4o s VAL 69 CO 0.85 0.08 -0.08 -0.69 -3.33 0.00 0.00 175.10 171.93 1h4o s VAL 70 N 0.20 0.99 -0.01 2.04 1.01 -1.26 -1.05 120.40 122.32 1h4o s VAL 70 Ca -0.02 -0.29 0.05 0.00 0.00 0.00 0.00 61.98 61.72 1h4o s VAL 70 Cb -0.04 -0.99 -0.01 0.00 0.00 0.00 0.00 36.38 35.33 1h4o s VAL 70 CO -0.01 0.35 -0.16 0.00 0.00 0.00 0.00 175.10 175.29 1h4o s ALA 71 N 1.53 1.33 -0.16 5.51 0.00 -0.40 -0.68 121.76 128.88 1h4o s ALA 71 Ca 0.01 -0.68 -0.05 0.00 0.00 0.00 0.00 51.96 51.25 1h4o s ALA 71 Cb -0.13 -0.34 -0.03 0.00 0.00 0.00 0.00 23.12 22.62 1h4o s ALA 71 CO -0.06 0.32 -0.01 0.00 0.00 0.00 0.00 175.76 176.01 1h4o s LEU 73 N 0.41 2.53 0.04 0.00 2.96 -0.07 -0.21 118.68 124.34 1h4o s LEU 73 Ca -0.02 -0.33 -0.05 0.00 -0.22 0.00 0.00 54.13 53.51 1h4o s LEU 73 Cb -0.14 -1.51 -0.01 0.00 0.50 0.00 0.00 46.19 45.02 1h4o s LEU 73 CO 0.02 0.27 0.08 -0.94 -1.32 0.00 0.00 176.35 174.46 1h4o s SER 74 N -0.27 0.22 -1.05 3.68 1.04 -0.81 -1.61 113.70 114.90 1h4o s SER 74 Ca 0.01 -0.60 -0.18 0.00 0.48 0.00 0.00 55.95 55.66 1h4o s SER 74 Cb -0.13 0.23 0.13 0.00 0.10 0.00 0.00 66.02 66.35 1h4o s SER 74 CO 0.03 -0.53 1.30 -0.69 0.98 0.00 0.00 173.24 174.33 1h4o s VAL 75 N -2.83 4.68 0.17 5.02 1.01 -1.26 -0.69 120.40 126.50 1h4o s VAL 75 Ca -0.03 -1.81 -0.15 0.00 0.00 0.00 0.00 61.98 59.99 1h4o s VAL 75 Cb 0.00 -4.88 0.02 0.00 0.00 0.00 0.00 36.38 31.52 1h4o s VAL 75 CO -0.06 -1.63 0.44 0.20 0.00 0.00 0.00 175.10 174.05 1h4o s ASN 76 N 3.60 -0.18 0.68 3.32 -0.87 -1.26 -4.90 114.94 115.34 1h4o s ASN 76 Ca 0.39 -0.54 -0.11 0.00 -1.57 0.00 0.00 52.86 51.03 1h4o s ASN 76 Cb -0.03 0.52 -0.00 0.00 -0.02 0.00 0.00 41.25 41.72 1h4o s ASN 76 CO -0.06 -0.97 1.05 1.51 -2.57 0.00 0.00 177.10 176.07 1h4o s ASP 77 N -2.88 5.55 0.45 -1.22 1.47 -1.26 -2.79 116.67 115.99 1h4o s ASP 77 Ca 0.10 1.57 0.25 0.00 1.18 0.00 0.00 52.55 55.64 1h4o s ASP 77 Cb 0.01 -2.48 0.98 0.00 -0.34 0.00 0.00 42.92 41.09 1h4o s ASP 77 CO -0.04 -1.33 1.85 0.00 0.68 0.00 0.00 175.17 176.33 1h4o h ALA 78 N -0.64 1.04 -0.02 2.11 0.00 -1.90 -1.99 119.26 117.86 1h4o h ALA 78 Ca -0.44 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.28 1h4o h ALA 78 Cb 1.21 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 1h4o h ALA 78 CO 0.58 0.26 0.01 0.74 0.00 0.00 0.00 179.25 180.84 1h4o h PHE 79 N 0.00 0.03 -0.22 0.00 0.04 -1.91 -1.24 116.94 113.63 1h4o h PHE 79 Ca -0.00 -0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.76 1h4o h PHE 79 Cb 0.70 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.83 1h4o h PHE 79 CO 0.00 0.13 0.12 0.28 -0.60 0.00 0.00 178.31 178.24 1h4o h VAL 80 N -0.07 1.11 -0.46 -0.55 2.07 -1.85 -2.07 116.25 114.43 1h4o h VAL 80 Ca 0.01 -0.28 -0.10 0.00 0.82 0.00 0.00 66.70 67.15 1h4o h VAL 80 Cb 0.11 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 1h4o h VAL 80 CO -0.00 0.10 -0.10 0.71 0.02 0.00 0.00 177.57 178.30 1h4o h THR 81 N 0.26 1.26 -0.47 2.57 1.35 -1.31 -0.59 112.91 115.98 1h4o h THR 81 Ca 0.08 -1.18 -0.00 0.00 -0.55 0.00 0.00 66.41 64.76 1h4o h THR 81 Cb 0.06 1.01 -0.02 0.00 -1.73 0.00 0.00 68.15 67.47 1h4o h THR 81 CO -0.01 0.41 0.29 1.23 -0.25 0.00 0.00 175.52 177.18 1h4o h GLY 82 N 0.97 0.68 1.39 5.82 0.00 -1.12 -0.43 103.07 110.38 1h4o h GLY 82 Ca 0.13 -0.28 -0.14 0.00 0.00 0.00 0.00 47.33 47.04 1h4o h GLY 82 CO 0.04 0.27 -0.40 0.83 0.00 0.00 0.00 176.54 177.28 1h4o h GLU 83 N 0.63 0.68 -0.29 4.80 4.39 -1.03 -2.30 114.58 121.45 1h4o h GLU 83 Ca 0.17 -0.35 -0.00 0.00 0.34 0.00 0.00 59.36 59.52 1h4o h GLU 83 Cb -0.02 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 1h4o h GLU 83 CO -0.03 0.96 0.18 2.35 -1.16 0.00 0.00 179.01 181.30 1h4o h TRP 84 N 0.55 0.38 -0.58 4.33 7.01 -0.77 -0.92 115.95 125.96 1h4o h TRP 84 Ca 0.05 0.00 0.04 0.00 2.11 0.00 0.00 58.89 61.09 1h4o h TRP 84 Cb 0.93 -0.12 -0.04 0.00 -2.10 0.00 0.00 29.16 27.82 1h4o h TRP 84 CO 0.04 0.27 0.33 0.78 -2.79 0.00 0.00 178.44 177.08 1h4o h GLY 85 N 0.37 0.83 1.21 2.65 0.00 -0.90 -2.15 103.07 105.07 1h4o h GLY 85 Ca 0.10 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.18 1h4o h GLY 85 CO -0.02 0.18 0.40 3.21 0.00 0.00 0.00 176.54 180.31 1h4o h ARG 86 N 0.64 1.04 0.00 4.80 3.08 -1.14 -1.34 114.38 121.46 1h4o h ARG 86 Ca 0.24 -0.12 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 1h4o h ARG 86 Cb 0.09 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 29.93 1h4o h ARG 86 CO -0.13 0.77 -0.01 0.00 -1.07 0.00 0.00 179.97 179.53 1h4o h ALA 87 N 1.40 1.03 -0.13 0.04 0.00 -0.52 -2.70 119.26 118.37 1h4o h ALA 87 Ca 0.26 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1h4o h ALA 87 Cb 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1h4o h ALA 87 CO -0.04 0.01 0.00 0.72 0.00 0.00 0.00 179.25 179.94 1h4o n HIS 88 N -3.13 0.41 -3.79 0.00 8.25 -0.62 -4.99 115.22 111.35 1h4o n HIS 88 Ca -0.02 -0.86 -0.25 0.00 -0.26 0.00 0.00 57.72 56.34 1h4o n HIS 88 Cb 0.16 -0.19 0.03 0.00 1.12 0.00 0.00 29.99 31.10 1h4o n HIS 88 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1h4o n LYS 89 N -0.82 -5.04 0.09 -0.41 5.02 -0.66 -4.88 118.16 111.45 1h4o n LYS 89 Ca 0.16 0.60 0.13 0.00 -2.02 0.00 0.00 58.31 57.18 1h4o n LYS 89 Cb 0.68 -5.25 0.34 0.00 -0.02 0.00 0.00 35.03 30.79 1h4o n LYS 89 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1h4o n ALA 90 N -4.42 2.49 -1.65 7.82 0.00 -0.60 -4.86 120.51 119.28 1h4o n ALA 90 Ca -0.19 -0.10 -0.51 0.00 0.00 0.00 0.00 53.44 52.65 1h4o n ALA 90 Cb 0.63 -1.38 -0.06 0.00 0.00 0.00 0.00 19.45 18.65 1h4o n ALA 90 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1h4o n GLU 91 N -2.18 1.57 -0.95 0.00 4.07 -1.26 -0.01 120.64 121.88 1h4o n GLU 91 Ca 0.05 0.57 0.00 0.00 -0.06 0.00 0.00 57.16 57.72 1h4o n GLU 91 Cb 0.43 -2.29 0.00 0.00 -0.06 0.00 0.00 31.44 29.52 1h4o n GLU 91 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1h4o n GLY 92 N 3.43 0.54 0.98 8.31 0.00 -1.26 -4.79 105.19 112.40 1h4o n GLY 92 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1h4o n GLY 92 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1h4o n LYS 93 N -2.02 0.00 -4.10 1.61 5.02 0.99 -5.06 118.16 114.61 1h4o n LYS 93 Ca 0.00 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.11 1h4o n LYS 93 Cb 0.07 -0.50 -0.16 0.00 -0.02 0.00 0.00 35.03 34.42 1h4o n LYS 93 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1h4o s VAL 94 N -1.97 0.41 0.00 -0.18 1.01 -0.33 -4.62 120.40 114.71 1h4o s VAL 94 Ca 0.00 -0.07 -0.29 0.00 0.00 0.00 0.00 61.98 61.62 1h4o s VAL 94 Cb 0.00 -0.45 -0.03 0.00 0.00 0.00 0.00 36.38 35.90 1h4o s VAL 94 CO 0.00 0.19 0.93 -0.13 0.00 0.00 0.00 175.10 176.09 1h4o s ARG 95 N 0.82 4.55 -0.32 2.72 1.81 0.15 -4.55 118.95 124.12 1h4o s ARG 95 Ca -0.10 1.34 -0.12 0.00 -1.72 0.00 0.00 55.73 55.13 1h4o s ARG 95 Cb -0.13 -3.45 -0.02 0.00 -0.45 0.00 0.00 34.95 30.90 1h4o s ARG 95 CO -0.00 -0.01 0.22 -0.51 -0.68 0.00 0.00 175.30 174.32 1h4o s LEU 96 N 0.88 4.37 -0.07 2.53 2.01 -1.26 -0.41 118.68 126.73 1h4o s LEU 96 Ca 0.49 -0.35 0.03 0.00 0.01 0.00 0.00 54.13 54.31 1h4o s LEU 96 Cb -0.21 -2.12 -0.02 0.00 0.01 0.00 0.00 46.19 43.85 1h4o s LEU 96 CO 0.27 -0.19 -0.16 -0.76 1.01 0.00 0.00 176.35 176.52 1h4o s LEU 97 N 1.72 2.62 -0.17 1.79 1.43 0.71 -4.30 118.68 122.47 1h4o s LEU 97 Ca 0.06 -0.28 -0.04 0.00 -1.03 0.00 0.00 54.13 52.84 1h4o s LEU 97 Cb -0.17 -1.54 -0.02 0.00 0.03 0.00 0.00 46.19 44.49 1h4o s LEU 97 CO 0.10 0.29 -0.04 0.00 0.23 0.00 0.00 176.35 176.93 1h4o s ALA 98 N -0.40 2.97 -0.59 4.21 0.00 0.17 -1.92 121.76 126.20 1h4o s ALA 98 Ca 0.04 -0.88 0.06 0.00 0.00 0.00 0.00 51.96 51.18 1h4o s ALA 98 Cb -0.12 -1.59 0.22 0.00 0.00 0.00 0.00 23.12 21.63 1h4o s ALA 98 CO 0.02 0.11 0.60 -3.47 0.00 0.00 0.00 175.76 173.01 1h4o n ASP 99 N 3.75 2.51 0.24 0.00 2.03 0.13 -0.96 116.55 124.25 1h4o n ASP 99 Ca -0.17 -3.14 0.08 0.00 0.52 0.00 0.00 54.79 52.07 1h4o n ASP 99 Cb 0.52 -0.68 0.63 0.00 -0.72 0.00 0.00 41.12 40.87 1h4o n ASP 99 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1h4o h PRO 100 N 4.64 0.03 -0.29 -0.67 0.13 -1.75 -1.44 132.00 132.65 1h4o h PRO 100 Ca 0.17 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1h4o h PRO 100 Cb 0.75 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.87 1h4o h PRO 100 CO 0.69 0.02 0.00 0.25 -0.23 0.00 0.00 178.00 178.73 1h4o n THR 101 N -4.53 0.38 -2.79 1.56 -2.24 -1.26 -4.63 114.28 100.76 1h4o n THR 101 Ca -0.03 -0.54 -0.21 0.00 -2.27 0.00 0.00 64.05 61.00 1h4o n THR 101 Cb 0.09 0.61 0.02 0.00 -2.10 0.00 0.00 70.33 68.95 1h4o n THR 101 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h4o n GLY 102 N 1.30 -0.46 0.35 3.38 0.00 -0.54 -4.92 105.19 104.29 1h4o n GLY 102 Ca 0.17 0.05 -0.04 0.00 0.00 0.00 0.00 46.02 46.20 1h4o n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h4o h ALA 103 N 0.96 1.12 -0.13 4.61 0.00 -1.93 -1.28 119.26 122.60 1h4o h ALA 103 Ca -0.50 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.29 1h4o h ALA 103 Cb 1.35 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1h4o h ALA 103 CO 0.55 0.59 0.03 0.35 0.00 0.00 0.00 179.25 180.77 1h4o h PHE 104 N 1.21 0.23 -0.68 0.00 3.57 -1.92 -1.81 116.94 117.53 1h4o h PHE 104 Ca 0.31 -0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.76 1h4o h PHE 104 Cb -0.03 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.61 1h4o h PHE 104 CO 0.00 0.39 0.34 0.78 -2.23 0.00 0.00 178.31 177.59 1h4o h GLY 105 N 0.00 1.03 1.06 2.40 0.00 -1.88 -1.99 103.07 103.70 1h4o h GLY 105 Ca 0.04 -0.48 -0.07 0.00 0.00 0.00 0.00 47.33 46.82 1h4o h GLY 105 CO 0.00 0.46 0.17 0.50 0.00 0.00 0.00 176.54 177.67 1h4o h LYS 106 N 0.96 1.11 0.00 4.80 1.57 -0.99 -0.88 116.57 123.14 1h4o h LYS 106 Ca 0.24 -0.27 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 1h4o h LYS 106 Cb 0.07 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 1h4o h LYS 106 CO -0.03 0.98 -0.28 1.49 -0.57 0.00 0.00 179.45 181.04 1h4o h GLU 107 N 1.04 0.00 -0.04 3.15 4.57 -0.77 -3.32 114.58 119.21 1h4o h GLU 107 Ca 0.22 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.40 1h4o h GLU 107 Cb 0.37 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.96 1h4o h GLU 107 CO 0.00 0.28 0.00 0.25 -1.18 0.00 0.00 179.01 178.37 1h4o n THR 108 N -3.32 0.16 -3.43 0.32 -2.24 -0.80 -4.67 114.28 100.29 1h4o n THR 108 Ca 0.01 -0.58 -0.24 0.00 -2.27 0.00 0.00 64.05 60.97 1h4o n THR 108 Cb 0.52 1.04 0.06 0.00 -2.10 0.00 0.00 70.33 69.85 1h4o n THR 108 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1h4o n ASP 109 N 0.33 -6.14 -1.10 3.42 2.03 -0.42 -1.63 116.55 113.05 1h4o n ASP 109 Ca 0.04 -0.47 0.08 0.00 0.52 0.00 0.00 54.79 54.96 1h4o n ASP 109 Cb 0.20 -4.88 0.26 0.00 -0.72 0.00 0.00 41.12 35.98 1h4o n ASP 109 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1h4o n LEU 110 N -4.65 3.79 -4.85 -2.67 4.77 -0.71 -4.90 117.00 107.78 1h4o n LEU 110 Ca -0.03 -2.24 -0.32 0.00 -0.03 0.00 0.00 56.01 53.38 1h4o n LEU 110 Cb 0.58 -0.43 -0.06 0.00 -2.33 0.00 0.00 43.42 41.18 1h4o n LEU 110 CO 0.60 0.81 0.39 -0.76 -1.33 0.00 0.00 177.39 177.10 1h4o s LEU 111 N -1.45 4.08 1.09 2.23 1.43 -1.24 -0.88 118.68 123.94 1h4o s LEU 111 Ca 0.39 1.23 -0.13 0.00 -1.03 0.00 0.00 54.13 54.59 1h4o s LEU 111 Cb 0.24 -4.01 0.24 0.00 0.03 0.00 0.00 46.19 42.68 1h4o s LEU 111 CO 0.22 -0.18 1.06 -0.76 0.23 0.00 0.00 176.35 176.91 1h4o s LEU 112 N -2.95 1.15 0.00 1.79 1.43 0.34 -4.69 118.68 115.75 1h4o s LEU 112 Ca 0.53 1.30 0.00 0.00 -1.03 0.00 0.00 54.13 54.93 1h4o s LEU 112 Cb -0.10 -3.33 0.00 0.00 0.03 0.00 0.00 46.19 42.79 1h4o s LEU 112 CO 0.18 -3.69 0.00 -0.90 0.23 0.00 0.00 176.35 172.17 1h4o n ASP 113 N -4.56 0.00 -0.40 2.29 5.68 -1.26 -4.75 116.55 113.56 1h4o n ASP 113 Ca 0.04 -0.11 0.14 0.00 -0.50 0.00 0.00 54.79 54.36 1h4o n ASP 113 Cb 0.56 0.00 0.59 0.00 -1.14 0.00 0.00 41.12 41.13 1h4o n ASP 113 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1h4o n ASP 114 N -0.32 1.23 -0.10 -1.12 5.75 -1.26 -4.43 116.55 116.30 1h4o n ASP 114 Ca 0.00 -1.42 0.05 0.00 -0.01 0.00 0.00 54.79 53.41 1h4o n ASP 114 Cb 0.00 -0.01 0.38 0.00 -1.03 0.00 0.00 41.12 40.47 1h4o n ASP 114 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 1h4o h SER 115 N 1.91 0.58 -0.38 -1.12 0.02 -1.98 -2.61 113.55 109.97 1h4o h SER 115 Ca 0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1h4o h SER 115 Cb 0.41 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.81 1h4o h SER 115 CO 0.00 0.40 0.00 0.18 -1.14 0.00 0.00 176.83 176.27 1h4o n LEU 116 N -4.47 3.31 -0.01 5.07 4.77 -1.26 -4.55 117.00 119.86 1h4o n LEU 116 Ca 0.07 -2.21 0.02 0.00 -0.03 0.00 0.00 56.01 53.86 1h4o n LEU 116 Cb 0.15 -0.33 0.36 0.00 -2.33 0.00 0.00 43.42 41.27 1h4o n LEU 116 CO 0.35 0.75 1.06 0.58 -1.33 0.00 0.00 177.39 178.80 1h4o h VAL 117 N 2.31 1.15 0.00 4.08 2.07 -1.65 -0.53 116.25 123.68 1h4o h VAL 117 Ca 0.00 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 67.04 1h4o h VAL 117 Cb 0.93 0.69 -0.00 0.00 -1.52 0.00 0.00 31.29 31.39 1h4o h VAL 117 CO 0.06 0.18 -0.08 0.77 0.02 0.00 0.00 177.57 178.52 1h4o h SER 118 N 0.55 0.00 0.04 0.57 4.64 -1.80 0.23 113.55 117.78 1h4o h SER 118 Ca 0.14 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 61.07 1h4o h SER 118 Cb 0.11 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.15 1h4o h SER 118 CO -0.01 0.08 -2.28 -0.38 -0.87 0.00 0.00 176.83 173.36 1h4o n ILE 119 N -3.43 1.59 0.01 0.95 5.41 -0.69 -4.60 119.36 118.60 1h4o n ILE 119 Ca -0.01 -0.56 -0.03 0.00 1.00 0.00 0.00 62.75 63.15 1h4o n ILE 119 Cb 0.23 -1.58 -0.11 0.00 -0.71 0.00 0.00 39.64 37.47 1h4o n ILE 119 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 1h4o n PHE 120 N -3.46 0.91 0.00 1.39 3.72 -0.29 -4.98 117.46 114.75 1h4o n PHE 120 Ca -0.42 0.31 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 1h4o n PHE 120 Cb 0.99 -1.10 0.00 0.00 -0.94 0.00 0.00 39.48 38.43 1h4o n PHE 120 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1h4o n GLY 121 N 1.46 1.45 2.74 1.37 0.00 0.80 -4.98 105.19 108.01 1h4o n GLY 121 Ca -0.13 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.85 1h4o n GLY 121 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1h4o n ASN 122 N 0.00 -1.40 -4.60 1.61 0.23 -1.25 -4.97 115.26 104.88 1h4o n ASN 122 Ca 0.00 -1.84 -0.41 0.00 -0.53 0.00 0.00 54.58 51.80 1h4o n ASN 122 Cb 0.00 2.30 -0.07 0.00 -2.08 0.00 0.00 39.78 39.93 1h4o n ASN 122 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 1h4o s ARG 123 N -2.05 3.95 0.60 -3.83 0.52 -1.26 -4.28 118.95 112.60 1h4o s ARG 123 Ca 0.15 0.33 0.01 0.00 -0.52 0.00 0.00 55.73 55.70 1h4o s ARG 123 Cb -0.03 -3.71 0.06 0.00 0.52 0.00 0.00 34.95 31.80 1h4o s ARG 123 CO 0.06 -0.52 0.84 1.03 0.02 0.00 0.00 175.30 176.73 1h4o s ARG 124 N 2.55 2.27 0.40 3.54 1.81 -1.26 -4.82 118.95 123.44 1h4o s ARG 124 Ca 0.25 -0.92 -0.24 0.00 -1.72 0.00 0.00 55.73 53.10 1h4o s ARG 124 Cb -0.15 -2.45 -0.09 0.00 -0.45 0.00 0.00 34.95 31.81 1h4o s ARG 124 CO 0.11 -0.94 1.05 -0.51 -0.68 0.00 0.00 175.30 174.33 1h4o s LEU 125 N -4.87 4.14 0.56 2.53 1.43 -1.26 -0.51 118.68 120.70 1h4o s LEU 125 Ca 0.60 2.04 -0.20 0.00 -1.03 0.00 0.00 54.13 55.54 1h4o s LEU 125 Cb -0.09 -4.18 -0.04 0.00 0.03 0.00 0.00 46.19 41.91 1h4o s LEU 125 CO 0.40 -0.49 1.24 -0.54 0.23 0.00 0.00 176.35 177.19 1h4o s LYS 126 N -2.49 3.14 0.06 1.70 1.02 -0.06 -3.23 119.74 119.88 1h4o s LYS 126 Ca 0.58 1.94 -0.31 0.00 0.02 0.00 0.00 55.97 58.20 1h4o s LYS 126 Cb -0.22 -2.10 -0.06 0.00 -0.52 0.00 0.00 37.83 34.93 1h4o s LYS 126 CO 0.28 -1.10 1.31 0.50 -0.92 0.00 0.00 175.35 175.41 1h4o s ARG 127 N -3.10 4.36 0.18 1.68 3.52 0.20 -4.46 118.95 121.33 1h4o s ARG 127 Ca 0.74 1.91 -0.16 0.00 -0.13 0.00 0.00 55.73 58.09 1h4o s ARG 127 Cb -0.33 -3.37 0.02 0.00 -1.56 0.00 0.00 34.95 29.71 1h4o s ARG 127 CO 0.37 -0.39 0.47 -0.59 -0.81 0.00 0.00 175.30 174.35 1h4o s PHE 128 N 1.41 -0.06 0.03 5.12 -0.12 -0.89 -1.70 117.98 121.77 1h4o s PHE 128 Ca 0.62 -0.28 -0.00 0.00 -0.05 0.00 0.00 56.93 57.21 1h4o s PHE 128 Cb -0.32 0.30 -0.02 0.00 -0.63 0.00 0.00 43.02 42.35 1h4o s PHE 128 CO 0.29 -0.85 -0.03 -1.54 -0.05 0.00 0.00 175.22 173.04 1h4o s SER 129 N -2.87 0.30 -0.02 1.98 1.04 -0.24 -0.75 113.70 113.14 1h4o s SER 129 Ca 0.09 -0.62 -0.05 0.00 0.48 0.00 0.00 55.95 55.85 1h4o s SER 129 Cb 0.00 0.12 0.01 0.00 0.10 0.00 0.00 66.02 66.25 1h4o s SER 129 CO -0.04 -0.37 0.12 -0.04 0.98 0.00 0.00 173.24 173.89 1h4o s MET 130 N -2.05 0.31 -0.21 4.02 -1.94 0.15 -0.55 119.30 119.03 1h4o s MET 130 Ca -0.10 -0.13 -0.10 0.00 -1.71 0.00 0.00 55.69 53.65 1h4o s MET 130 Cb -0.06 0.13 -0.05 0.00 2.01 0.00 0.00 34.83 36.87 1h4o s MET 130 CO -0.03 -0.06 0.13 0.08 -0.01 0.00 0.00 175.02 175.13 1h4o s VAL 131 N -0.68 5.34 -0.10 -6.03 1.01 -0.63 -1.61 120.40 117.70 1h4o s VAL 131 Ca -0.08 0.17 0.04 0.00 0.00 0.00 0.00 61.98 62.11 1h4o s VAL 131 Cb -0.05 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.88 1h4o s VAL 131 CO 0.01 0.41 -0.23 -0.69 0.00 0.00 0.00 175.10 174.60 1h4o s VAL 132 N 0.58 1.97 -0.20 2.92 1.01 0.34 -0.58 120.40 126.45 1h4o s VAL 132 Ca 0.07 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.11 1h4o s VAL 132 Cb -0.12 -1.71 0.04 0.00 0.00 0.00 0.00 36.38 34.58 1h4o s VAL 132 CO 0.00 0.54 -0.13 -1.10 0.00 0.00 0.00 175.10 174.41 1h4o s GLN 133 N 0.44 2.33 -1.49 2.72 -0.21 -0.00 -0.12 119.66 123.33 1h4o s GLN 133 Ca -0.17 -0.89 -0.05 0.00 0.02 0.00 0.00 55.36 54.27 1h4o s GLN 133 Cb -0.17 -2.50 0.04 0.00 1.00 0.00 0.00 33.01 31.38 1h4o s GLN 133 CO 0.07 -0.38 0.53 -3.47 -2.12 0.00 0.00 175.29 169.92 1h4o n ASP 134 N 4.64 -1.25 0.00 5.90 2.03 0.73 -1.26 116.55 127.33 1h4o n ASP 134 Ca -0.16 -1.00 0.00 0.00 0.52 0.00 0.00 54.79 54.15 1h4o n ASP 134 Cb 0.47 -3.01 0.00 0.00 -0.72 0.00 0.00 41.12 37.86 1h4o n ASP 134 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1h4o n GLY 135 N -1.84 1.43 3.58 0.27 0.00 -1.17 -4.70 105.19 102.77 1h4o n GLY 135 Ca -0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.48 1h4o n GLY 135 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h4o s ILE 136 N -3.17 4.20 -0.18 -0.61 -1.09 -0.39 -0.47 121.20 119.49 1h4o s ILE 136 Ca 0.00 -0.26 -0.29 0.00 -2.23 0.00 0.00 60.65 57.87 1h4o s ILE 136 Cb 0.00 -2.83 -0.03 0.00 -1.58 0.00 0.00 42.46 38.02 1h4o s ILE 136 CO 0.00 0.52 1.61 -0.69 -1.23 0.00 0.00 174.94 175.15 1h4o s VAL 137 N -0.04 3.70 -0.13 2.92 1.01 -0.02 -0.82 120.40 127.01 1h4o s VAL 137 Ca 0.03 0.80 0.19 0.00 0.00 0.00 0.00 61.98 63.00 1h4o s VAL 137 Cb -0.13 -3.67 -0.27 0.00 0.00 0.00 0.00 36.38 32.32 1h4o s VAL 137 CO 0.02 -0.23 0.21 0.29 0.00 0.00 0.00 175.10 175.39 1h4o n LYS 138 N 7.50 0.76 -3.75 2.72 4.76 0.26 -0.18 118.16 130.22 1h4o n LYS 138 Ca 0.18 -0.07 -0.13 0.00 -2.87 0.00 0.00 58.31 55.42 1h4o n LYS 138 Cb 0.45 -1.50 -0.10 0.00 -1.84 0.00 0.00 35.03 32.03 1h4o n LYS 138 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1h4o s ALA 139 N -2.82 -0.86 -0.06 7.82 0.00 -1.16 -4.89 121.76 119.79 1h4o s ALA 139 Ca -0.09 0.94 -0.01 0.00 0.00 0.00 0.00 51.96 52.80 1h4o s ALA 139 Cb 0.08 -0.53 0.03 0.00 0.00 0.00 0.00 23.12 22.70 1h4o s ALA 139 CO 0.82 -0.17 0.01 -1.17 0.00 0.00 0.00 175.76 175.24 1h4o s LEU 140 N 0.08 0.68 -0.25 0.00 2.96 -1.26 -1.60 118.68 119.28 1h4o s LEU 140 Ca -0.01 -0.06 0.02 0.00 -0.22 0.00 0.00 54.13 53.87 1h4o s LEU 140 Cb -0.03 -0.37 0.06 0.00 0.50 0.00 0.00 46.19 46.35 1h4o s LEU 140 CO 0.01 -0.17 -0.10 0.20 -1.32 0.00 0.00 176.35 174.97 1h4o s ASN 141 N 1.76 4.23 -0.14 3.68 0.01 0.29 -5.00 114.94 119.77 1h4o s ASN 141 Ca 0.01 -1.31 -0.01 0.00 -0.71 0.00 0.00 52.86 50.84 1h4o s ASN 141 Cb -0.13 -1.44 -0.02 0.00 0.41 0.00 0.00 41.25 40.08 1h4o s ASN 141 CO -0.04 -0.20 -0.10 -0.69 -1.51 0.00 0.00 177.10 174.56 1h4o s VAL 142 N 1.19 3.30 0.13 1.60 1.01 -1.26 -1.08 120.40 125.29 1h4o s VAL 142 Ca -0.08 -0.57 -0.32 0.00 0.00 0.00 0.00 61.98 61.01 1h4o s VAL 142 Cb -0.19 -2.41 -0.12 0.00 0.00 0.00 0.00 36.38 33.66 1h4o s VAL 142 CO -0.06 0.51 1.77 -0.62 0.00 0.00 0.00 175.10 176.70 1h4o n GLU 143 N 3.56 2.60 0.25 2.72 -0.58 -0.69 -4.84 120.64 123.65 1h4o n GLU 143 Ca -0.18 0.94 0.14 0.00 -0.42 0.00 0.00 57.16 57.65 1h4o n GLU 143 Cb 0.53 -2.80 0.81 0.00 -0.57 0.00 0.00 31.44 29.40 1h4o n GLU 143 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 1h4o h PRO 144 N 7.72 0.00 -0.52 3.49 0.13 -1.96 -0.19 132.00 140.68 1h4o h PRO 144 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1h4o h PRO 144 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1h4o h PRO 144 CO 0.94 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.31 1h4o n ASP 145 N -4.06 3.58 0.00 1.44 5.68 -1.26 -4.97 116.55 116.97 1h4o n ASP 145 Ca -0.01 -2.11 0.00 0.00 -0.50 0.00 0.00 54.79 52.17 1h4o n ASP 145 Cb 0.18 -0.39 0.00 0.00 -1.14 0.00 0.00 41.12 39.77 1h4o n ASP 145 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1h4o n GLY 146 N 0.94 2.24 0.00 6.12 0.00 -0.08 -4.59 105.19 109.82 1h4o n GLY 146 Ca 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1h4o n GLY 146 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1h4o n THR 147 N 0.00 0.00 -0.46 2.61 -2.24 -1.26 -0.63 114.28 112.30 1h4o n THR 147 Ca 0.00 -0.27 -0.07 0.00 -2.27 0.00 0.00 64.05 61.44 1h4o n THR 147 Cb 0.00 0.87 0.06 0.00 -2.10 0.00 0.00 70.33 69.17 1h4o n THR 147 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h4o n GLY 148 N 0.86 -2.88 2.63 3.38 0.00 -1.26 -4.94 105.19 102.97 1h4o n GLY 148 Ca 0.00 -1.40 -0.28 0.00 0.00 0.00 0.00 46.02 44.34 1h4o n GLY 148 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h4o s LEU 149 N 0.00 2.55 0.00 0.99 1.43 -1.26 -4.94 118.68 117.45 1h4o s LEU 149 Ca 0.16 -2.96 0.00 0.00 -1.03 0.00 0.00 54.13 50.30 1h4o s LEU 149 Cb -0.02 -0.90 0.00 0.00 0.03 0.00 0.00 46.19 45.30 1h4o s LEU 149 CO 0.13 -0.20 0.00 0.35 0.23 0.00 0.00 176.35 176.85 1h4o n THR 150 N 3.06 0.00 0.33 5.49 -2.24 -1.26 -4.98 114.28 114.69 1h4o n THR 150 Ca 0.18 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 62.11 1h4o n THR 150 Cb 0.39 0.00 0.61 0.00 -2.10 0.00 0.00 70.33 69.23 1h4o n THR 150 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1h4o n SER 152 N -2.70 1.45 -4.86 0.00 3.41 -1.26 -4.72 113.62 104.94 1h4o n SER 152 Ca 0.01 -1.34 -0.31 0.00 -0.26 0.00 0.00 58.87 56.97 1h4o n SER 152 Cb 0.26 0.05 -0.00 0.00 -0.26 0.00 0.00 64.21 64.26 1h4o n SER 152 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1h4o s LEU 153 N -2.16 3.36 0.21 1.04 1.43 -1.09 -4.49 118.68 116.96 1h4o s LEU 153 Ca 0.33 1.48 -0.10 0.00 -1.03 0.00 0.00 54.13 54.80 1h4o s LEU 153 Cb 0.20 -4.48 0.28 0.00 0.03 0.00 0.00 46.19 42.22 1h4o s LEU 153 CO 0.39 -0.79 1.71 0.00 0.23 0.00 0.00 176.35 177.89 1h4o h ALA 154 N 0.08 0.69 -0.58 4.21 0.00 -1.88 -2.07 119.26 119.70 1h4o h ALA 154 Ca -0.45 0.13 0.07 0.00 0.00 0.00 0.00 54.91 54.66 1h4o h ALA 154 Cb 1.19 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 19.11 1h4o h ALA 154 CO 0.62 -0.30 0.39 -1.35 0.00 0.00 0.00 179.25 178.60 1h4o h PRO 155 N 0.26 0.48 -0.12 0.00 0.11 -1.93 -1.52 132.00 129.29 1h4o h PRO 155 Ca 0.31 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 66.29 1h4o h PRO 155 Cb 0.45 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.44 1h4o h PRO 155 CO -0.39 0.32 -0.36 -0.97 -0.21 0.00 0.00 178.00 176.38 1h4o h ASN 156 N 0.50 0.24 -0.24 -2.05 -1.24 -1.67 -3.04 115.58 108.08 1h4o h ASN 156 Ca 0.26 -0.09 -0.18 0.00 0.71 0.00 0.00 56.30 57.00 1h4o h ASN 156 Cb 0.38 -0.07 0.00 0.00 0.73 0.00 0.00 38.32 39.36 1h4o h ASN 156 CO -0.07 0.60 -0.56 0.40 -1.29 0.00 0.00 177.43 176.51 1h4o h ILE 157 N 0.20 1.29 -0.53 2.57 2.04 -1.25 -3.15 117.51 118.68 1h4o h ILE 157 Ca 0.02 -1.75 0.09 0.00 1.00 0.00 0.00 64.86 64.22 1h4o h ILE 157 Cb 0.74 1.75 -0.07 0.00 -0.74 0.00 0.00 36.82 38.51 1h4o h ILE 157 CO 0.06 0.56 0.14 0.40 0.00 0.00 0.00 178.15 179.31 1h4o h ILE 158 N 0.56 0.73 0.00 -0.67 2.04 -1.35 0.50 117.51 119.32 1h4o h ILE 158 Ca -0.00 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.76 1h4o h ILE 158 Cb 1.17 0.42 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1h4o h ILE 158 CO 0.12 0.05 0.00 0.77 0.00 0.00 0.00 178.15 179.09 1h4o h SER 159 N 0.29 0.00 -0.37 1.72 4.64 -1.49 -2.37 113.55 115.96 1h4o h SER 159 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 1h4o h SER 159 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1h4o h SER 159 CO -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.64 1h4o n GLN 160 N -2.49 2.34 0.00 4.77 6.02 0.17 -5.13 117.38 123.06 1h4o n GLN 160 Ca -0.01 -2.12 0.12 0.00 -0.01 0.00 0.00 57.00 54.98 1h4o n GLN 160 Cb 0.08 -1.41 0.72 0.00 1.02 0.00 0.00 30.24 30.65 1h4o n GLN 160 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33