#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h4o n PRO 2 N 0.00 2.43 -1.88 0.00 -0.02 -1.26 -4.42 135.00 129.85 1h4o n PRO 2 Ca 0.00 0.87 -0.36 0.00 -2.02 0.00 0.00 63.50 61.99 1h4o n PRO 2 Cb 0.00 -2.62 0.05 0.00 -0.02 0.00 0.00 33.50 30.91 1h4o n PRO 2 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1h4o s ILE 3 N 0.27 2.48 0.15 4.25 2.07 -0.87 -5.00 121.20 124.56 1h4o s ILE 3 Ca 0.69 0.29 -0.08 0.00 -1.41 0.00 0.00 60.65 60.14 1h4o s ILE 3 Cb -0.57 -3.07 -0.01 0.00 0.13 0.00 0.00 42.46 38.94 1h4o s ILE 3 CO 0.45 -0.07 0.25 -1.59 -1.91 0.00 0.00 174.94 172.06 1h4o s LYS 4 N -3.43 1.10 0.22 3.50 -2.85 -1.26 -5.07 119.74 111.95 1h4o s LYS 4 Ca 0.78 -1.19 -0.32 0.00 -1.00 0.00 0.00 55.97 54.24 1h4o s LYS 4 Cb -0.32 0.36 -0.14 0.00 -2.06 0.00 0.00 37.83 35.67 1h4o s LYS 4 CO 0.36 -0.39 1.34 0.28 0.10 0.00 0.00 175.35 177.04 1h4o n VAL 5 N -0.19 0.95 0.00 1.79 0.31 -1.26 -1.70 118.33 118.23 1h4o n VAL 5 Ca -0.08 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 64.02 1h4o n VAL 5 Cb 0.63 -1.30 0.00 0.00 -0.91 0.00 0.00 33.84 32.26 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 2.11 3.32 3.83 2.92 0.00 0.96 -5.00 105.19 113.32 1h4o n GLY 6 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.92 6.16 0.18 1.61 1.01 -0.69 -4.74 116.67 119.28 1h4o s ASP 7 Ca 0.00 1.65 -0.24 0.00 0.71 0.00 0.00 52.55 54.67 1h4o s ASP 7 Cb 0.00 -2.51 -0.08 0.00 1.01 0.00 0.00 42.92 41.34 1h4o s ASP 7 CO 0.00 -0.91 0.76 0.00 0.21 0.00 0.00 175.17 175.24 1h4o s ALA 8 N -2.66 3.44 0.13 5.23 0.00 -1.26 -0.55 121.76 126.08 1h4o s ALA 8 Ca 0.60 0.31 -0.31 0.00 0.00 0.00 0.00 51.96 52.57 1h4o s ALA 8 Cb -0.13 -2.92 -0.08 0.00 0.00 0.00 0.00 23.12 19.99 1h4o s ALA 8 CO 0.38 0.30 1.35 -1.50 0.00 0.00 0.00 175.76 176.29 1h4o s ILE 9 N -1.24 3.37 0.61 0.00 2.07 0.53 -4.90 121.20 121.64 1h4o s ILE 9 Ca 0.37 1.01 -0.18 0.00 -1.41 0.00 0.00 60.65 60.45 1h4o s ILE 9 Cb -0.21 -3.65 -0.03 0.00 0.13 0.00 0.00 42.46 38.70 1h4o s ILE 9 CO 0.25 0.09 1.17 -2.16 -1.91 0.00 0.00 174.94 172.38 1h4o s PRO 10 N 0.85 2.94 -1.35 3.50 0.04 -1.26 -4.67 135.00 135.04 1h4o s PRO 10 Ca 0.62 1.70 -0.08 0.00 0.04 0.00 0.00 61.00 63.28 1h4o s PRO 10 Cb -0.36 -1.94 -0.02 0.00 0.04 0.00 0.00 34.50 32.22 1h4o s PRO 10 CO 0.32 -1.20 2.79 0.00 0.04 0.00 0.00 177.00 178.95 1h4o n ALA 11 N -1.79 7.17 -1.95 8.56 0.00 -1.26 -4.03 120.51 127.21 1h4o n ALA 11 Ca 0.13 -3.59 -0.40 0.00 0.00 0.00 0.00 53.44 49.58 1h4o n ALA 11 Cb 0.50 -3.03 -0.06 0.00 0.00 0.00 0.00 19.45 16.87 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 0.67 4.31 -0.17 0.00 1.01 -1.26 -4.79 120.40 120.15 1h4o s VAL 12 Ca 0.63 1.84 -0.17 0.00 0.00 0.00 0.00 61.98 64.29 1h4o s VAL 12 Cb 0.20 -4.21 -0.04 0.00 0.00 0.00 0.00 36.38 32.33 1h4o s VAL 12 CO -0.08 0.49 0.45 -0.70 0.00 0.00 0.00 175.10 175.27 1h4o s GLU 13 N -1.01 4.23 0.27 2.72 2.12 -1.26 -1.41 118.70 124.36 1h4o s GLU 13 Ca 0.38 0.33 0.02 0.00 0.36 0.00 0.00 54.97 56.07 1h4o s GLU 13 Cb -0.24 -3.51 -0.01 0.00 0.26 0.00 0.00 34.13 30.63 1h4o s GLU 13 CO 0.28 -0.00 0.09 1.33 -0.54 0.00 0.00 175.26 176.42 1h4o n VAL 14 N 4.17 0.00 -4.14 3.70 0.24 0.34 -4.97 118.33 117.68 1h4o n VAL 14 Ca -0.07 -1.54 -0.13 0.00 -2.04 0.00 0.00 64.34 60.56 1h4o n VAL 14 Cb 0.51 0.53 -0.11 0.00 -1.47 0.00 0.00 33.84 33.30 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 -2.51 0.91 -0.08 6.34 0.08 -0.20 -0.92 117.98 121.61 1h4o s PHE 15 Ca 0.12 -0.65 -0.02 0.00 0.12 0.00 0.00 56.93 56.51 1h4o s PHE 15 Cb 0.01 -0.52 0.03 0.00 -0.57 0.00 0.00 43.02 41.97 1h4o s PHE 15 CO 0.09 -0.05 0.01 -2.00 -0.10 0.00 0.00 175.22 173.17 1h4o s GLU 16 N -2.56 0.50 0.00 0.44 2.12 -0.63 0.26 118.70 118.82 1h4o s GLU 16 Ca 0.01 0.11 0.00 0.00 0.36 0.00 0.00 54.97 55.45 1h4o s GLU 16 Cb -0.04 -1.00 0.00 0.00 0.26 0.00 0.00 34.13 33.35 1h4o s GLU 16 CO -0.01 -0.34 0.00 0.41 -0.54 0.00 0.00 175.26 174.79 1h4o n GLY 17 N 5.17 1.19 3.30 -1.50 0.00 -1.26 -4.50 105.19 107.59 1h4o n GLY 17 Ca -0.07 -0.04 -0.13 0.00 0.00 0.00 0.00 46.02 45.78 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 0.81 0.55 1.61 2.02 -1.26 -4.33 118.70 118.11 1h4o s GLU 18 Ca 0.00 -0.23 0.23 0.00 0.02 0.00 0.00 54.97 54.99 1h4o s GLU 18 Cb 0.00 0.36 1.52 0.00 0.10 0.00 0.00 34.13 36.11 1h4o s GLU 18 CO 0.00 -0.25 2.15 -1.35 0.02 0.00 0.00 175.26 175.83 1h4o h PRO 19 N 3.42 0.00 -0.00 0.39 0.11 -1.87 -2.37 132.00 131.68 1h4o h PRO 19 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1h4o h PRO 19 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1h4o h PRO 19 CO 0.42 0.00 -0.01 0.41 -0.21 0.00 0.00 178.00 178.61 1h4o n GLY 20 N -1.47 -1.34 3.43 -0.55 0.00 -1.26 -4.66 105.19 99.35 1h4o n GLY 20 Ca -0.01 -0.14 -0.44 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.70 6.22 0.15 1.61 0.01 -0.89 -5.04 114.94 114.30 1h4o s ASN 21 Ca 0.24 -1.02 -0.13 0.00 -0.71 0.00 0.00 52.86 51.24 1h4o s ASN 21 Cb 0.20 -2.33 -0.07 0.00 0.41 0.00 0.00 41.25 39.45 1h4o s ASN 21 CO 0.49 -1.10 0.54 -0.54 -1.51 0.00 0.00 177.10 174.97 1h4o s LYS 22 N 3.07 3.93 -0.05 -0.60 1.02 -1.26 -1.61 119.74 124.24 1h4o s LYS 22 Ca 0.17 0.43 -0.02 0.00 0.02 0.00 0.00 55.97 56.57 1h4o s LYS 22 Cb -0.19 -2.89 0.04 0.00 -0.52 0.00 0.00 37.83 34.26 1h4o s LYS 22 CO 0.11 0.46 0.09 0.08 -0.92 0.00 0.00 175.35 175.16 1h4o s VAL 23 N -1.52 -0.13 -0.30 3.17 1.01 -0.10 -4.92 120.40 117.61 1h4o s VAL 23 Ca 0.39 0.34 -0.16 0.00 0.00 0.00 0.00 61.98 62.55 1h4o s VAL 23 Cb -0.14 -0.18 -0.02 0.00 0.00 0.00 0.00 36.38 36.03 1h4o s VAL 23 CO 0.19 0.14 0.44 0.21 0.00 0.00 0.00 175.10 176.09 1h4o s ASN 24 N 1.86 6.30 0.41 3.32 3.84 -1.26 -0.50 114.94 128.91 1h4o s ASN 24 Ca 0.00 0.21 0.11 0.00 0.21 0.00 0.00 52.86 53.39 1h4o s ASN 24 Cb -0.12 -2.24 0.94 0.00 -0.55 0.00 0.00 41.25 39.28 1h4o s ASN 24 CO -0.04 -0.30 1.96 -0.07 -2.79 0.00 0.00 177.10 175.86 1h4o h LEU 25 N 8.79 0.47 -0.63 3.21 3.38 -1.49 0.32 115.31 129.35 1h4o h LEU 25 Ca -0.30 0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.54 1h4o h LEU 25 Cb 1.15 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 1h4o h LEU 25 CO 0.70 0.28 -0.50 0.00 0.09 0.00 0.00 178.44 179.01 1h4o h ALA 26 N 1.66 0.81 -0.11 1.53 0.00 -1.82 -2.93 119.26 118.42 1h4o h ALA 26 Ca 0.30 -0.48 -0.19 0.00 0.00 0.00 0.00 54.91 54.54 1h4o h ALA 26 Cb 0.49 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1h4o h ALA 26 CO -0.09 0.67 -0.71 0.93 0.00 0.00 0.00 179.25 180.04 1h4o h GLU 27 N 0.37 0.49 -0.83 0.00 4.39 -1.40 -3.12 114.58 114.48 1h4o h GLU 27 Ca 0.02 -0.38 0.05 0.00 0.34 0.00 0.00 59.36 59.39 1h4o h GLU 27 Cb 1.01 0.08 -0.06 0.00 -0.10 0.00 0.00 28.75 29.68 1h4o h GLU 27 CO 0.09 1.01 0.51 1.25 -1.16 0.00 0.00 179.01 180.72 1h4o h LEU 28 N 0.34 0.81 -2.92 1.33 5.85 -0.91 -2.59 115.31 117.23 1h4o h LEU 28 Ca -0.03 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1h4o h LEU 28 Cb 1.29 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.16 1h4o h LEU 28 CO 0.13 0.53 0.00 0.49 -0.34 0.00 0.00 178.44 179.25 1h4o n PHE 29 N -4.63 1.22 -2.35 1.25 3.72 -1.17 -4.93 117.46 110.57 1h4o n PHE 29 Ca 0.11 -0.55 -0.41 0.00 -0.05 0.00 0.00 57.45 56.55 1h4o n PHE 29 Cb 0.15 -0.10 -0.03 0.00 -0.94 0.00 0.00 39.48 38.55 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 -1.36 4.47 -1.88 -1.08 2.20 -0.98 -2.61 119.74 118.50 1h4o s LYS 30 Ca 0.51 1.90 0.00 0.00 -0.36 0.00 0.00 55.97 58.02 1h4o s LYS 30 Cb 0.29 -3.24 0.00 0.00 -1.51 0.00 0.00 37.83 33.37 1h4o s LYS 30 CO 0.30 -0.13 0.00 0.41 -0.36 0.00 0.00 175.35 175.57 1h4o n GLY 31 N 2.32 1.34 3.27 5.54 0.00 -1.26 -4.94 105.19 111.46 1h4o n GLY 31 Ca 0.05 -0.13 -0.10 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.85 1.06 -0.19 1.61 1.02 -1.22 -4.94 119.74 113.23 1h4o s LYS 32 Ca 0.00 -1.26 -0.09 0.00 0.02 0.00 0.00 55.97 54.64 1h4o s LYS 32 Cb 0.00 0.33 -0.05 0.00 -0.52 0.00 0.00 37.83 37.59 1h4o s LYS 32 CO 0.00 -0.36 0.11 0.21 -0.92 0.00 0.00 175.35 174.39 1h4o s LYS 33 N -3.99 4.09 0.25 1.68 2.20 -1.26 -0.35 119.74 122.35 1h4o s LYS 33 Ca 0.19 -0.26 -0.01 0.00 -0.36 0.00 0.00 55.97 55.53 1h4o s LYS 33 Cb 0.05 -3.34 -0.03 0.00 -1.51 0.00 0.00 37.83 33.00 1h4o s LYS 33 CO 0.00 0.31 0.25 0.20 -0.36 0.00 0.00 175.35 175.75 1h4o s GLY 34 N 0.31 1.53 -0.05 5.54 0.00 0.11 -0.99 107.32 113.77 1h4o s GLY 34 Ca 0.06 -1.65 0.04 0.00 0.00 0.00 0.00 44.72 43.17 1h4o s GLY 34 CO -0.01 -1.26 -0.19 0.14 0.00 0.00 0.00 173.10 171.78 1h4o s VAL 35 N -3.85 1.56 -0.12 1.40 1.01 -0.04 -0.44 120.40 119.93 1h4o s VAL 35 Ca 0.36 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.59 1h4o s VAL 35 Cb 0.04 -1.35 0.01 0.00 0.00 0.00 0.00 36.38 35.08 1h4o s VAL 35 CO 0.16 0.45 -0.22 -0.22 0.00 0.00 0.00 175.10 175.26 1h4o s LEU 36 N 0.09 2.07 0.07 3.92 2.96 -0.43 -0.93 118.68 126.42 1h4o s LEU 36 Ca -0.06 -0.57 0.07 0.00 -0.22 0.00 0.00 54.13 53.35 1h4o s LEU 36 Cb -0.13 -1.39 -0.03 0.00 0.50 0.00 0.00 46.19 45.14 1h4o s LEU 36 CO 0.03 0.11 -0.18 0.72 -1.32 0.00 0.00 176.35 175.71 1h4o s PHE 37 N 0.58 1.60 -0.01 5.38 -0.71 0.26 0.16 117.98 125.25 1h4o s PHE 37 Ca -0.13 -0.40 0.06 0.00 -1.04 0.00 0.00 56.93 55.42 1h4o s PHE 37 Cb -0.17 -0.92 -0.03 0.00 -1.21 0.00 0.00 43.02 40.70 1h4o s PHE 37 CO 0.04 0.11 -0.17 0.20 -1.34 0.00 0.00 175.22 174.06 1h4o s GLY 38 N -1.49 1.53 0.01 1.99 0.00 -0.06 -0.27 107.32 109.02 1h4o s GLY 38 Ca 0.05 -1.08 0.05 0.00 0.00 0.00 0.00 44.72 43.73 1h4o s GLY 38 CO 0.03 -0.92 -0.16 -1.34 0.00 0.00 0.00 173.10 170.71 1h4o s VAL 39 N -0.81 1.27 0.35 1.40 -7.23 -0.56 -2.51 120.40 112.32 1h4o s VAL 39 Ca 0.13 -0.87 0.05 0.00 -1.81 0.00 0.00 61.98 59.49 1h4o s VAL 39 Cb -0.10 -1.09 0.29 0.00 0.56 0.00 0.00 36.38 36.03 1h4o s VAL 39 CO 0.03 0.21 1.94 -0.65 -0.31 0.00 0.00 175.10 176.32 1h4o h PRO 40 N 5.33 0.77 -1.61 4.82 0.11 -1.83 -3.40 132.00 136.19 1h4o h PRO 40 Ca -0.38 -0.05 0.07 0.00 0.11 0.00 0.00 66.00 65.76 1h4o h PRO 40 Cb 1.16 -0.17 -0.26 0.00 0.11 0.00 0.00 31.00 31.84 1h4o h PRO 40 CO 0.46 0.51 0.40 0.20 -0.21 0.00 0.00 178.00 179.36 1h4o s GLY 41 N -3.56 -0.14 0.42 -0.55 0.00 -1.26 -4.46 107.32 97.77 1h4o s GLY 41 Ca -0.10 2.79 -0.26 0.00 0.00 0.00 0.00 44.72 47.15 1h4o s GLY 41 CO 0.78 2.09 1.31 0.00 0.00 0.00 0.00 173.10 177.27 1h4o n ALA 42 N 2.78 1.45 -0.89 3.20 0.00 -1.26 -2.53 120.51 123.26 1h4o n ALA 42 Ca -0.15 0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1h4o n ALA 42 Cb 0.56 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.72 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 -0.18 0.00 -2.66 0.00 3.72 -1.26 -5.01 117.46 112.06 1h4o n PHE 43 Ca 0.06 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.16 1h4o n PHE 43 Cb 0.40 -1.01 -0.02 0.00 -0.94 0.00 0.00 39.48 37.91 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 -1.79 4.79 0.08 4.37 -4.23 -1.05 -4.92 115.64 112.89 1h4o s THR 44 Ca 0.00 0.59 -0.34 0.00 -1.18 0.00 0.00 61.69 60.76 1h4o s THR 44 Cb 0.00 -3.78 -0.17 0.00 1.34 0.00 0.00 72.50 69.90 1h4o s THR 44 CO 0.00 -0.68 1.60 -0.65 -0.54 0.00 0.00 174.62 174.35 1h4o h PRO 45 N 0.81 -0.90 -0.64 3.99 0.11 -1.95 -0.65 132.00 132.78 1h4o h PRO 45 Ca -0.47 0.06 -0.03 0.00 0.11 0.00 0.00 66.00 65.67 1h4o h PRO 45 Cb 1.19 0.20 -0.03 0.00 0.11 0.00 0.00 31.00 32.48 1h4o h PRO 45 CO 0.63 -0.60 0.27 0.78 -0.21 0.00 0.00 178.00 178.87 1h4o h GLY 46 N -0.93 1.03 1.16 -0.55 0.00 -1.96 0.10 103.07 101.92 1h4o h GLY 46 Ca -0.07 -0.55 -0.02 0.00 0.00 0.00 0.00 47.33 46.69 1h4o h GLY 46 CO 0.03 0.52 0.38 0.00 0.00 0.00 0.00 176.54 177.48 1h4o h SER 48 N 1.09 0.25 0.59 0.00 0.02 -0.68 -0.51 113.55 114.32 1h4o h SER 48 Ca 0.27 -0.38 -0.09 0.00 -0.84 0.00 0.00 61.79 60.74 1h4o h SER 48 Cb 0.09 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.53 1h4o h SER 48 CO -0.04 1.32 -1.49 0.29 -1.14 0.00 0.00 176.83 175.78 1h4o n LYS 49 N -3.35 0.63 0.08 3.45 5.02 0.32 -4.51 118.16 119.80 1h4o n LYS 49 Ca -0.15 0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 1h4o n LYS 49 Cb 1.03 -1.73 0.00 0.00 -0.02 0.00 0.00 35.03 34.31 1h4o n LYS 49 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1h4o n THR 50 N -2.67 0.55 0.38 -0.18 -1.04 -0.63 -4.79 114.28 105.91 1h4o n THR 50 Ca -0.07 0.18 -0.15 0.00 -2.04 0.00 0.00 64.05 61.97 1h4o n THR 50 Cb 0.71 -1.08 -0.07 0.00 -1.82 0.00 0.00 70.33 68.08 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 -0.92 0.14 -1.42 2.76 -1.24 -2.28 115.15 112.19 1h4o h HIS 51 Ca 0.00 -0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.14 1h4o h HIS 51 Cb 0.09 0.30 -0.00 0.00 1.55 0.00 0.00 27.41 29.35 1h4o h HIS 51 CO 0.00 -0.57 -0.08 1.25 -1.30 0.00 0.00 177.93 177.23 1h4o h LEU 52 N -1.18 -0.20 -1.80 0.26 5.85 -1.35 -2.90 115.31 113.99 1h4o h LEU 52 Ca -0.10 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.66 1h4o h LEU 52 Cb 0.76 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.83 1h4o h LEU 52 CO 0.17 -0.13 0.20 -0.65 -0.34 0.00 0.00 178.44 177.68 1h4o h PRO 53 N -0.21 0.25 -0.54 5.25 0.11 -1.77 -1.64 132.00 133.45 1h4o h PRO 53 Ca -0.01 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.06 1h4o h PRO 53 Cb 0.18 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.20 1h4o h PRO 53 CO 0.02 0.17 0.26 0.78 -0.21 0.00 0.00 178.00 179.01 1h4o h GLY 54 N 0.26 0.84 1.66 -0.55 0.00 -1.20 0.19 103.07 104.26 1h4o h GLY 54 Ca 0.12 -0.42 -0.12 0.00 0.00 0.00 0.00 47.33 46.92 1h4o h GLY 54 CO -0.02 0.40 -0.41 0.74 0.00 0.00 0.00 176.54 177.24 1h4o h PHE 55 N 0.73 0.44 0.12 5.60 0.04 -1.25 0.19 116.94 122.81 1h4o h PHE 55 Ca 0.19 -0.13 -0.01 0.00 2.80 0.00 0.00 57.97 60.82 1h4o h PHE 55 Cb 0.12 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.17 1h4o h PHE 55 CO -0.00 0.73 -0.06 0.28 -0.60 0.00 0.00 178.31 178.66 1h4o h VAL 56 N 0.31 1.02 -0.60 -0.55 2.07 -1.09 -2.94 116.25 114.46 1h4o h VAL 56 Ca 0.03 -0.57 0.01 0.00 0.82 0.00 0.00 66.70 66.99 1h4o h VAL 56 Cb 0.86 1.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.98 1h4o h VAL 56 CO 0.07 0.14 0.40 -0.33 0.02 0.00 0.00 177.57 177.87 1h4o h GLU 57 N -0.43 0.78 -0.56 1.57 5.08 -0.47 -2.61 114.58 117.94 1h4o h GLU 57 Ca -0.02 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1h4o h GLU 57 Cb 0.35 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1h4o h GLU 57 CO 0.03 0.51 0.00 1.04 -1.00 0.00 0.00 179.01 179.59 1h4o n GLN 58 N -4.45 2.40 -0.18 2.33 1.13 0.04 -4.52 117.38 114.13 1h4o n GLN 58 Ca 0.06 -1.50 -0.01 0.00 -1.94 0.00 0.00 57.00 53.61 1h4o n GLN 58 Cb 0.06 -1.57 0.08 0.00 0.11 0.00 0.00 30.24 28.92 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 3.42 0.55 -0.39 -1.58 0.00 -1.28 -0.57 119.26 119.42 1h4o h ALA 59 Ca 0.00 0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.93 1h4o h ALA 59 Cb 0.85 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1h4o h ALA 59 CO 0.11 -0.37 -0.27 0.93 0.00 0.00 0.00 179.25 179.65 1h4o h GLU 60 N 0.14 0.87 -0.42 0.00 3.07 -1.86 -0.81 114.58 115.57 1h4o h GLU 60 Ca 0.28 -0.42 -0.02 0.00 -0.50 0.00 0.00 59.36 58.71 1h4o h GLU 60 Cb 0.43 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.32 1h4o h GLU 60 CO -0.44 1.06 0.19 0.00 -1.40 0.00 0.00 179.01 178.42 1h4o h ALA 61 N 0.79 1.55 -0.16 3.43 0.00 -1.71 -0.02 119.26 123.13 1h4o h ALA 61 Ca 0.08 -0.10 -0.17 0.00 0.00 0.00 0.00 54.91 54.72 1h4o h ALA 61 Cb 0.85 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.47 1h4o h ALA 61 CO 0.07 0.36 -0.57 -0.07 0.00 0.00 0.00 179.25 179.04 1h4o h LEU 62 N 0.59 0.79 -1.29 0.00 3.38 -0.67 -3.09 115.31 115.02 1h4o h LEU 62 Ca 0.15 -0.60 0.02 0.00 0.09 0.00 0.00 57.88 57.53 1h4o h LEU 62 Cb 0.08 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.56 1h4o h LEU 62 CO -0.02 1.26 0.49 0.11 0.09 0.00 0.00 178.44 180.36 1h4o h LYS 63 N 0.36 0.93 0.00 1.13 1.57 -0.81 -0.66 116.57 119.09 1h4o h LYS 63 Ca -0.03 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1h4o h LYS 63 Cb 1.20 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.30 1h4o h LYS 63 CO 0.12 0.61 0.00 0.00 -0.57 0.00 0.00 179.45 179.62 1h4o h ALA 64 N 1.55 1.00 -0.66 3.86 0.00 -0.93 0.43 119.26 124.52 1h4o h ALA 64 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1h4o h ALA 64 Cb -0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1h4o h ALA 64 CO -0.07 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.81 1h4o n LYS 65 N -3.07 2.91 -0.69 0.00 4.76 -0.33 -4.94 118.16 116.80 1h4o n LYS 65 Ca -0.02 -2.52 0.00 0.00 -2.87 0.00 0.00 58.31 52.91 1h4o n LYS 65 Cb 0.16 -1.64 0.00 0.00 -1.84 0.00 0.00 35.03 31.71 1h4o n LYS 65 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1h4o n GLY 66 N 1.41 0.71 3.68 0.72 0.00 0.15 -5.02 105.19 106.84 1h4o n GLY 66 Ca 0.23 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.40 4.16 -0.54 1.61 1.01 -0.76 -4.47 120.40 119.01 1h4o s VAL 67 Ca 0.00 1.46 0.17 0.00 0.00 0.00 0.00 61.98 63.62 1h4o s VAL 67 Cb 0.00 -3.94 -0.21 0.00 0.00 0.00 0.00 36.38 32.22 1h4o s VAL 67 CO 0.00 -0.06 0.61 0.00 0.00 0.00 0.00 175.10 175.65 1h4o n GLN 68 N 5.86 1.09 -3.80 2.72 6.02 -0.17 -4.03 117.38 125.08 1h4o n GLN 68 Ca 0.13 -0.05 -0.13 0.00 -0.01 0.00 0.00 57.00 56.93 1h4o n GLN 68 Cb 0.45 -1.34 -0.14 0.00 1.02 0.00 0.00 30.24 30.23 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 -2.82 -0.02 -0.09 5.09 0.11 -1.24 -5.06 120.40 116.38 1h4o s VAL 69 Ca 0.02 0.08 -0.00 0.00 -2.93 0.00 0.00 61.98 59.15 1h4o s VAL 69 Cb 0.12 -0.18 0.02 0.00 -1.53 0.00 0.00 36.38 34.82 1h4o s VAL 69 CO 0.71 0.03 -0.06 -0.69 -3.33 0.00 0.00 175.10 171.76 1h4o s VAL 70 N 0.54 0.85 0.02 2.04 1.01 -1.26 -0.86 120.40 122.74 1h4o s VAL 70 Ca -0.04 -0.20 0.05 0.00 0.00 0.00 0.00 61.98 61.79 1h4o s VAL 70 Cb -0.06 -0.88 -0.02 0.00 0.00 0.00 0.00 36.38 35.42 1h4o s VAL 70 CO -0.02 0.33 -0.15 0.00 0.00 0.00 0.00 175.10 175.25 1h4o s ALA 71 N 1.55 1.29 -0.17 5.51 0.00 -0.11 -0.80 121.76 129.03 1h4o s ALA 71 Ca 0.01 -0.81 -0.03 0.00 0.00 0.00 0.00 51.96 51.13 1h4o s ALA 71 Cb -0.13 -0.25 -0.02 0.00 0.00 0.00 0.00 23.12 22.72 1h4o s ALA 71 CO -0.05 0.27 -0.06 0.00 0.00 0.00 0.00 175.76 175.92 1h4o s LEU 73 N 0.68 3.09 0.03 0.00 2.96 0.62 0.02 118.68 126.09 1h4o s LEU 73 Ca -0.03 -0.12 -0.04 0.00 -0.22 0.00 0.00 54.13 53.72 1h4o s LEU 73 Cb -0.15 -1.70 -0.01 0.00 0.50 0.00 0.00 46.19 44.83 1h4o s LEU 73 CO 0.02 0.26 0.05 -0.94 -1.32 0.00 0.00 176.35 174.42 1h4o s SER 74 N -0.18 0.21 -1.04 3.68 1.04 -0.73 -1.49 113.70 115.18 1h4o s SER 74 Ca 0.02 -0.52 -0.19 0.00 0.48 0.00 0.00 55.95 55.73 1h4o s SER 74 Cb -0.13 0.18 0.10 0.00 0.10 0.00 0.00 66.02 66.28 1h4o s SER 74 CO 0.03 -0.44 1.35 -0.69 0.98 0.00 0.00 173.24 174.47 1h4o s VAL 75 N -2.23 4.43 0.18 5.02 1.01 -1.26 -1.01 120.40 126.54 1h4o s VAL 75 Ca -0.08 -1.50 -0.17 0.00 0.00 0.00 0.00 61.98 60.22 1h4o s VAL 75 Cb -0.04 -4.94 0.03 0.00 0.00 0.00 0.00 36.38 31.43 1h4o s VAL 75 CO -0.03 -1.73 0.50 0.20 0.00 0.00 0.00 175.10 174.04 1h4o s ASN 76 N 4.03 -0.27 0.69 3.32 -0.87 -1.26 -4.90 114.94 115.68 1h4o s ASN 76 Ca 0.41 -0.43 -0.11 0.00 -1.57 0.00 0.00 52.86 51.17 1h4o s ASN 76 Cb -0.02 0.56 0.01 0.00 -0.02 0.00 0.00 41.25 41.78 1h4o s ASN 76 CO -0.06 -1.01 1.06 1.51 -2.57 0.00 0.00 177.10 176.02 1h4o s ASP 77 N -2.86 5.40 0.44 -1.22 1.47 -1.26 -3.00 116.67 115.64 1h4o s ASP 77 Ca 0.08 1.62 0.22 0.00 1.18 0.00 0.00 52.55 55.64 1h4o s ASP 77 Cb -0.00 -2.49 1.00 0.00 -0.34 0.00 0.00 42.92 41.08 1h4o s ASP 77 CO -0.05 -1.43 1.88 0.00 0.68 0.00 0.00 175.17 176.25 1h4o h ALA 78 N -0.71 1.14 -0.32 2.11 0.00 -1.90 -2.14 119.26 117.45 1h4o h ALA 78 Ca -0.44 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.21 1h4o h ALA 78 Cb 1.21 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1h4o h ALA 78 CO 0.57 0.32 0.08 0.74 0.00 0.00 0.00 179.25 180.95 1h4o h PHE 79 N 0.00 0.53 -0.16 0.00 0.04 -1.91 -1.69 116.94 113.75 1h4o h PHE 79 Ca -0.00 -0.06 -0.01 0.00 2.80 0.00 0.00 57.97 60.69 1h4o h PHE 79 Cb 0.65 -0.15 -0.01 0.00 2.20 0.00 0.00 35.95 38.64 1h4o h PHE 79 CO 0.00 0.56 0.04 0.28 -0.60 0.00 0.00 178.31 178.59 1h4o h VAL 80 N 0.35 1.20 -0.37 -0.55 2.07 -1.85 -2.13 116.25 114.98 1h4o h VAL 80 Ca 0.10 -0.62 -0.07 0.00 0.82 0.00 0.00 66.70 66.93 1h4o h VAL 80 Cb 0.29 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 1h4o h VAL 80 CO 0.00 0.19 -0.04 0.71 0.02 0.00 0.00 177.57 178.44 1h4o h THR 81 N 0.07 1.22 -0.36 2.57 1.35 -1.33 0.05 112.91 116.48 1h4o h THR 81 Ca 0.05 -0.94 -0.10 0.00 -0.55 0.00 0.00 66.41 64.87 1h4o h THR 81 Cb 0.25 0.99 -0.01 0.00 -1.73 0.00 0.00 68.15 67.66 1h4o h THR 81 CO 0.00 0.32 -0.17 1.23 -0.25 0.00 0.00 175.52 176.65 1h4o h GLY 82 N 0.91 0.82 1.46 5.82 0.00 -1.17 -1.17 103.07 109.74 1h4o h GLY 82 Ca 0.11 -0.73 -0.12 0.00 0.00 0.00 0.00 47.33 46.59 1h4o h GLY 82 CO 0.02 0.67 -0.33 0.83 0.00 0.00 0.00 176.54 177.73 1h4o h GLU 83 N 0.54 0.61 -0.40 4.80 4.39 -1.11 -2.47 114.58 120.94 1h4o h GLU 83 Ca 0.08 -0.28 0.01 0.00 0.34 0.00 0.00 59.36 59.51 1h4o h GLU 83 Cb 0.71 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.33 1h4o h GLU 83 CO 0.05 0.86 0.25 2.35 -1.16 0.00 0.00 179.01 181.36 1h4o h TRP 84 N 0.52 0.47 -0.77 4.33 7.01 -0.74 -1.38 115.95 125.39 1h4o h TRP 84 Ca 0.06 0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.09 1h4o h TRP 84 Cb 0.82 -0.16 -0.04 0.00 -2.10 0.00 0.00 29.16 27.68 1h4o h TRP 84 CO 0.03 0.29 0.50 0.78 -2.79 0.00 0.00 178.44 177.25 1h4o h GLY 85 N 0.51 1.11 1.67 2.65 0.00 -1.02 -1.84 103.07 106.15 1h4o h GLY 85 Ca 0.15 -0.39 -0.08 0.00 0.00 0.00 0.00 47.33 47.01 1h4o h GLY 85 CO -0.05 0.35 -0.24 3.21 0.00 0.00 0.00 176.54 179.81 1h4o h ARG 86 N 1.00 0.38 0.00 4.80 3.08 -1.14 -1.15 114.38 121.35 1h4o h ARG 86 Ca 0.30 -0.13 -0.00 0.00 0.07 0.00 0.00 59.98 60.21 1h4o h ARG 86 Cb -0.04 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 29.98 1h4o h ARG 86 CO -0.09 0.60 -0.01 0.00 -1.07 0.00 0.00 179.97 179.40 1h4o h ALA 87 N 1.41 1.01 -0.16 0.04 0.00 -0.42 -2.94 119.26 118.20 1h4o h ALA 87 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1h4o h ALA 87 Cb 0.61 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1h4o h ALA 87 CO 0.04 0.01 0.00 0.72 0.00 0.00 0.00 179.25 180.02 1h4o n HIS 88 N -3.11 0.59 -3.91 0.00 8.25 -0.51 -4.99 115.22 111.54 1h4o n HIS 88 Ca -0.01 -0.92 -0.25 0.00 -0.26 0.00 0.00 57.72 56.28 1h4o n HIS 88 Cb 0.21 -0.25 -0.01 0.00 1.12 0.00 0.00 29.99 31.06 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 -0.86 -3.73 0.05 -0.41 5.02 -0.79 -4.86 118.16 112.58 1h4o n LYS 89 Ca 0.19 0.46 0.13 0.00 -2.02 0.00 0.00 58.31 57.07 1h4o n LYS 89 Cb 0.80 -4.73 0.44 0.00 -0.02 0.00 0.00 35.03 31.52 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 -4.38 2.50 -1.66 7.82 0.00 -0.73 -4.86 120.51 119.20 1h4o n ALA 90 Ca -0.28 -0.11 -0.50 0.00 0.00 0.00 0.00 53.44 52.55 1h4o n ALA 90 Cb 0.67 -1.40 -0.05 0.00 0.00 0.00 0.00 19.45 18.67 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 -1.88 1.74 -0.93 0.00 2.13 -1.26 -0.37 120.64 120.07 1h4o n GLU 91 Ca 0.06 0.63 0.00 0.00 0.66 0.00 0.00 57.16 58.51 1h4o n GLU 91 Cb 0.39 -2.38 0.00 0.00 0.27 0.00 0.00 31.44 29.72 1h4o n GLU 91 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1h4o n GLY 92 N 3.61 0.64 0.47 8.31 0.00 -1.26 -4.78 105.19 112.18 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 -2.05 0.00 -3.82 1.61 5.02 0.50 -5.04 118.16 114.38 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 0.04 -0.73 -0.17 0.00 -0.02 0.00 0.00 35.03 34.16 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 -1.93 0.08 0.01 -0.18 1.01 -0.56 -4.60 120.40 114.23 1h4o s VAL 94 Ca 0.00 0.19 -0.29 0.00 0.00 0.00 0.00 61.98 61.88 1h4o s VAL 94 Cb 0.00 -0.22 -0.04 0.00 0.00 0.00 0.00 36.38 36.12 1h4o s VAL 94 CO 0.00 0.15 0.93 -0.13 0.00 0.00 0.00 175.10 176.05 1h4o s ARG 95 N 1.35 4.57 -0.28 2.72 1.81 0.02 -4.58 118.95 124.55 1h4o s ARG 95 Ca -0.05 1.34 -0.13 0.00 -1.72 0.00 0.00 55.73 55.17 1h4o s ARG 95 Cb -0.13 -3.44 -0.04 0.00 -0.45 0.00 0.00 34.95 30.89 1h4o s ARG 95 CO -0.03 0.03 0.28 -0.51 -0.68 0.00 0.00 175.30 174.39 1h4o s LEU 96 N 0.76 4.05 -0.10 2.53 2.01 -1.26 -0.78 118.68 125.89 1h4o s LEU 96 Ca 0.49 0.11 0.03 0.00 0.01 0.00 0.00 54.13 54.77 1h4o s LEU 96 Cb -0.21 -2.26 -0.01 0.00 0.01 0.00 0.00 46.19 43.72 1h4o s LEU 96 CO 0.27 -0.12 -0.20 -0.76 1.01 0.00 0.00 176.35 176.55 1h4o s LEU 97 N 1.90 2.36 -0.18 1.79 1.43 0.10 -4.30 118.68 121.78 1h4o s LEU 97 Ca 0.11 -0.44 -0.08 0.00 -1.03 0.00 0.00 54.13 52.69 1h4o s LEU 97 Cb -0.16 -1.48 -0.04 0.00 0.03 0.00 0.00 46.19 44.53 1h4o s LEU 97 CO 0.11 0.20 0.07 0.00 0.23 0.00 0.00 176.35 176.96 1h4o s ALA 98 N 0.14 3.46 -0.61 4.21 0.00 0.14 -1.78 121.76 127.32 1h4o s ALA 98 Ca -0.10 -0.73 0.05 0.00 0.00 0.00 0.00 51.96 51.18 1h4o s ALA 98 Cb -0.16 -1.96 0.20 0.00 0.00 0.00 0.00 23.12 21.20 1h4o s ALA 98 CO 0.06 0.18 0.56 -3.47 0.00 0.00 0.00 175.76 173.09 1h4o n ASP 99 N 3.51 2.45 0.09 0.00 2.03 -0.18 -1.03 116.55 123.42 1h4o n ASP 99 Ca -0.16 -3.11 0.05 0.00 0.52 0.00 0.00 54.79 52.08 1h4o n ASP 99 Cb 0.52 -0.69 0.48 0.00 -0.72 0.00 0.00 41.12 40.71 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 4.89 0.35 -0.09 -0.67 0.13 -1.76 -1.62 132.00 133.24 1h4o h PRO 100 Ca 0.17 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1h4o h PRO 100 Cb 0.76 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.81 1h4o h PRO 100 CO 0.68 0.27 0.00 0.25 -0.23 0.00 0.00 178.00 178.97 1h4o n THR 101 N -4.46 0.10 -1.78 1.56 -2.24 -1.26 -4.60 114.28 101.59 1h4o n THR 101 Ca 0.01 -0.36 -0.10 0.00 -2.27 0.00 0.00 64.05 61.33 1h4o n THR 101 Cb 0.10 0.69 -0.02 0.00 -2.10 0.00 0.00 70.33 68.99 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 1.22 0.50 0.37 3.38 0.00 -0.61 -4.92 105.19 105.14 1h4o n GLY 102 Ca 0.17 -0.52 -0.03 0.00 0.00 0.00 0.00 46.02 45.64 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 0.25 1.24 0.04 4.61 0.00 -1.93 -0.86 119.26 122.61 1h4o h ALA 103 Ca -0.22 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 1h4o h ALA 103 Cb 0.93 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1h4o h ALA 103 CO 0.28 0.66 -0.02 0.35 0.00 0.00 0.00 179.25 180.53 1h4o h PHE 104 N 1.33 -0.05 -0.91 0.00 3.57 -1.92 -1.73 116.94 117.23 1h4o h PHE 104 Ca 0.35 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.86 1h4o h PHE 104 Cb -0.11 0.02 -0.05 0.00 2.79 0.00 0.00 35.95 38.60 1h4o h PHE 104 CO 0.00 0.07 0.60 0.78 -2.23 0.00 0.00 178.31 177.54 1h4o h GLY 105 N -0.16 1.28 0.99 2.40 0.00 -1.86 -2.13 103.07 103.59 1h4o h GLY 105 Ca -0.01 -0.47 -0.03 0.00 0.00 0.00 0.00 47.33 46.82 1h4o h GLY 105 CO 0.01 0.45 0.25 0.50 0.00 0.00 0.00 176.54 177.75 1h4o h LYS 106 N 1.21 0.86 0.00 4.80 1.57 -0.94 -0.19 116.57 123.88 1h4o h LYS 106 Ca 0.34 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 58.95 1h4o h LYS 106 Cb -0.12 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.04 1h4o h LYS 106 CO -0.08 0.73 -0.08 0.93 -0.57 0.00 0.00 179.45 180.37 1h4o h GLU 107 N 0.80 0.00 -0.00 3.15 4.39 -0.77 -3.30 114.58 118.85 1h4o h GLU 107 Ca 0.20 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.90 1h4o h GLU 107 Cb 0.17 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 1h4o h GLU 107 CO -0.02 0.08 0.00 0.25 -1.16 0.00 0.00 179.01 178.16 1h4o n THR 108 N -3.20 0.01 -3.26 1.13 -2.24 -0.85 -4.69 114.28 101.18 1h4o n THR 108 Ca 0.01 -0.50 -0.23 0.00 -2.27 0.00 0.00 64.05 61.05 1h4o n THR 108 Cb 0.37 1.03 0.05 0.00 -2.10 0.00 0.00 70.33 69.69 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 0.09 -6.24 -1.00 3.42 2.03 -0.18 -2.04 116.55 112.62 1h4o n ASP 109 Ca 0.01 -0.39 0.09 0.00 0.52 0.00 0.00 54.79 55.02 1h4o n ASP 109 Cb 0.04 -4.98 0.23 0.00 -0.72 0.00 0.00 41.12 35.69 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 -4.43 3.38 -4.79 -2.67 4.77 -0.62 -4.92 117.00 107.72 1h4o n LEU 110 Ca -0.06 -1.87 -0.36 0.00 -0.03 0.00 0.00 56.01 53.68 1h4o n LEU 110 Cb 0.60 -0.33 -0.06 0.00 -2.33 0.00 0.00 43.42 41.29 1h4o n LEU 110 CO 0.55 0.82 0.62 -0.76 -1.33 0.00 0.00 177.39 177.28 1h4o s LEU 111 N -1.07 4.30 1.03 2.23 1.43 -1.24 -0.46 118.68 124.91 1h4o s LEU 111 Ca 0.35 1.76 -0.12 0.00 -1.03 0.00 0.00 54.13 55.10 1h4o s LEU 111 Cb 0.19 -4.00 0.21 0.00 0.03 0.00 0.00 46.19 42.62 1h4o s LEU 111 CO 0.25 -0.08 1.08 -0.76 0.23 0.00 0.00 176.35 177.07 1h4o s LEU 112 N -2.15 1.70 0.00 1.79 1.43 0.10 -4.70 118.68 116.85 1h4o s LEU 112 Ca 0.50 1.66 0.00 0.00 -1.03 0.00 0.00 54.13 55.26 1h4o s LEU 112 Cb -0.17 -3.82 0.00 0.00 0.03 0.00 0.00 46.19 42.23 1h4o s LEU 112 CO 0.22 -3.52 0.00 -0.90 0.23 0.00 0.00 176.35 172.38 1h4o n ASP 113 N -4.48 0.00 -0.14 2.29 5.68 -1.26 -4.71 116.55 113.94 1h4o n ASP 113 Ca 0.06 0.00 0.12 0.00 -0.50 0.00 0.00 54.79 54.47 1h4o n ASP 113 Cb 0.54 0.00 0.63 0.00 -1.14 0.00 0.00 41.12 41.15 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 0.00 0.42 0.02 -1.12 5.68 -1.26 -4.42 116.55 115.87 1h4o n ASP 114 Ca 0.00 -1.36 -0.01 0.00 -0.50 0.00 0.00 54.79 52.92 1h4o n ASP 114 Cb 0.00 -0.02 0.28 0.00 -1.14 0.00 0.00 41.12 40.25 1h4o n ASP 114 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 1h4o h SER 115 N 0.60 0.46 -0.50 -1.12 0.02 -1.97 -2.60 113.55 108.43 1h4o h SER 115 Ca 0.00 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 1h4o h SER 115 Cb 0.13 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.55 1h4o h SER 115 CO 0.00 0.58 0.00 0.18 -1.14 0.00 0.00 176.83 176.45 1h4o n LEU 116 N -4.24 3.60 -0.14 5.07 4.77 -1.26 -4.52 117.00 120.27 1h4o n LEU 116 Ca 0.01 -2.15 0.08 0.00 -0.03 0.00 0.00 56.01 53.91 1h4o n LEU 116 Cb 0.29 -0.39 0.39 0.00 -2.33 0.00 0.00 43.42 41.38 1h4o n LEU 116 CO 0.40 0.82 1.20 0.58 -1.33 0.00 0.00 177.39 179.06 1h4o h VAL 117 N 2.99 0.99 0.00 4.08 2.07 -1.64 -1.29 116.25 123.45 1h4o h VAL 117 Ca 0.00 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 1h4o h VAL 117 Cb 0.98 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 31.03 1h4o h VAL 117 CO 0.05 0.12 -0.09 0.77 0.02 0.00 0.00 177.57 178.45 1h4o h SER 118 N 0.65 0.00 0.06 0.57 4.64 -1.79 0.26 113.55 117.94 1h4o h SER 118 Ca 0.29 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 61.25 1h4o h SER 118 Cb 0.31 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.34 1h4o h SER 118 CO -0.09 0.09 -2.33 2.30 -0.87 0.00 0.00 176.83 175.93 1h4o n ILE 119 N -4.03 1.46 0.00 0.95 -5.35 -0.82 -4.63 119.36 106.95 1h4o n ILE 119 Ca -0.03 -0.76 0.02 0.00 -0.27 0.00 0.00 62.75 61.71 1h4o n ILE 119 Cb 0.17 -0.85 -0.11 0.00 -1.74 0.00 0.00 39.64 37.12 1h4o n ILE 119 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1h4o n PHE 120 N -2.96 0.55 0.00 4.28 3.72 -0.55 -5.00 117.46 117.50 1h4o n PHE 120 Ca -0.35 0.18 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 1h4o n PHE 120 Cb 1.10 -0.91 0.00 0.00 -0.94 0.00 0.00 39.48 38.73 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 1.40 1.69 3.73 1.37 0.00 0.91 -4.99 105.19 109.31 1h4o n GLY 121 Ca -0.12 0.00 -0.05 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 -1.90 -4.59 1.61 0.23 -1.25 -4.97 115.26 104.38 1h4o n ASN 122 Ca 0.00 -2.14 -0.41 0.00 -0.53 0.00 0.00 54.58 51.50 1h4o n ASN 122 Cb 0.00 3.13 -0.07 0.00 -2.08 0.00 0.00 39.78 40.76 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 -2.06 3.85 0.67 -3.83 0.52 -1.26 -4.28 118.95 112.55 1h4o s ARG 123 Ca 0.20 0.24 -0.02 0.00 -0.52 0.00 0.00 55.73 55.63 1h4o s ARG 123 Cb -0.04 -3.74 0.08 0.00 0.52 0.00 0.00 34.95 31.77 1h4o s ARG 123 CO 0.08 -0.60 0.93 1.03 0.02 0.00 0.00 175.30 176.76 1h4o s ARG 124 N 2.62 2.04 0.30 3.54 1.81 -1.26 -4.79 118.95 123.19 1h4o s ARG 124 Ca 0.25 -0.81 -0.29 0.00 -1.72 0.00 0.00 55.73 53.16 1h4o s ARG 124 Cb -0.15 -2.34 -0.10 0.00 -0.45 0.00 0.00 34.95 31.92 1h4o s ARG 124 CO 0.12 -1.19 1.11 -0.51 -0.68 0.00 0.00 175.30 174.15 1h4o s LEU 125 N -5.06 4.50 0.73 2.53 1.43 -1.26 0.00 118.68 121.55 1h4o s LEU 125 Ca 0.62 2.28 -0.15 0.00 -1.03 0.00 0.00 54.13 55.85 1h4o s LEU 125 Cb -0.08 -3.69 0.04 0.00 0.03 0.00 0.00 46.19 42.49 1h4o s LEU 125 CO 0.43 -0.21 1.21 -0.54 0.23 0.00 0.00 176.35 177.47 1h4o s LYS 126 N -1.58 2.14 -0.07 1.70 1.02 0.39 -3.40 119.74 119.94 1h4o s LYS 126 Ca 0.46 1.78 -0.30 0.00 0.02 0.00 0.00 55.97 57.93 1h4o s LYS 126 Cb -0.32 -1.83 -0.03 0.00 -0.52 0.00 0.00 37.83 35.14 1h4o s LYS 126 CO 0.41 -1.84 1.13 0.50 -0.92 0.00 0.00 175.35 174.63 1h4o s ARG 127 N -3.89 4.38 0.20 1.68 3.52 0.11 -4.49 118.95 120.46 1h4o s ARG 127 Ca 0.75 1.58 -0.12 0.00 -0.13 0.00 0.00 55.73 57.80 1h4o s ARG 127 Cb -0.30 -3.55 0.00 0.00 -1.56 0.00 0.00 34.95 29.54 1h4o s ARG 127 CO 0.45 -0.40 0.40 -0.59 -0.81 0.00 0.00 175.30 174.35 1h4o s PHE 128 N 2.14 0.29 0.02 5.12 -0.12 -1.04 -1.65 117.98 122.74 1h4o s PHE 128 Ca 0.53 -0.65 -0.03 0.00 -0.05 0.00 0.00 56.93 56.73 1h4o s PHE 128 Cb -0.22 0.12 -0.01 0.00 -0.63 0.00 0.00 43.02 42.27 1h4o s PHE 128 CO 0.20 -0.86 0.04 -1.54 -0.05 0.00 0.00 175.22 173.02 1h4o s SER 129 N -2.97 0.17 -0.03 1.98 1.04 0.31 -0.88 113.70 113.31 1h4o s SER 129 Ca 0.18 -0.42 -0.10 0.00 0.48 0.00 0.00 55.95 56.09 1h4o s SER 129 Cb 0.01 0.15 0.01 0.00 0.10 0.00 0.00 66.02 66.30 1h4o s SER 129 CO 0.03 -0.36 0.22 0.00 0.98 0.00 0.00 173.24 174.11 1h4o s MET 130 N -1.65 0.47 -0.15 4.02 0.23 0.12 -0.46 119.30 121.88 1h4o s MET 130 Ca -0.14 -0.10 -0.15 0.00 -1.03 0.00 0.00 55.69 54.27 1h4o s MET 130 Cb -0.08 0.21 -0.05 0.00 -1.53 0.00 0.00 34.83 33.39 1h4o s MET 130 CO -0.01 -0.11 0.34 0.08 -2.03 0.00 0.00 175.02 173.29 1h4o s VAL 131 N -0.88 5.28 -0.13 5.16 1.01 -0.80 -1.31 120.40 128.71 1h4o s VAL 131 Ca -0.10 0.65 0.02 0.00 0.00 0.00 0.00 61.98 62.55 1h4o s VAL 131 Cb -0.05 -3.68 0.01 0.00 0.00 0.00 0.00 36.38 32.66 1h4o s VAL 131 CO 0.02 0.37 -0.19 -0.69 0.00 0.00 0.00 175.10 174.61 1h4o s VAL 132 N 0.52 1.83 -0.21 2.92 1.01 0.42 -0.78 120.40 126.11 1h4o s VAL 132 Ca 0.19 -0.83 -0.00 0.00 0.00 0.00 0.00 61.98 61.34 1h4o s VAL 132 Cb -0.13 -1.64 0.02 0.00 0.00 0.00 0.00 36.38 34.62 1h4o s VAL 132 CO 0.05 0.50 -0.14 -1.58 0.00 0.00 0.00 175.10 173.94 1h4o s GLN 133 N 0.98 2.96 -1.56 2.72 0.74 0.07 0.09 119.66 125.66 1h4o s GLN 133 Ca -0.05 -0.87 -0.05 0.00 0.05 0.00 0.00 55.36 54.44 1h4o s GLN 133 Cb -0.15 -2.76 0.05 0.00 1.10 0.00 0.00 33.01 31.25 1h4o s GLN 133 CO -0.04 -0.28 0.30 -3.47 -0.55 0.00 0.00 175.29 171.26 1h4o n ASP 134 N 4.65 -0.32 0.00 6.67 2.03 0.52 -1.18 116.55 128.92 1h4o n ASP 134 Ca -0.19 -1.15 0.00 0.00 0.52 0.00 0.00 54.79 53.97 1h4o n ASP 134 Cb 0.49 -2.21 0.00 0.00 -0.72 0.00 0.00 41.12 38.68 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 -2.06 3.30 3.78 0.27 0.00 -1.07 -4.68 105.19 104.73 1h4o n GLY 135 Ca -0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.48 1h4o n GLY 135 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1h4o s ILE 136 N -2.21 4.68 -0.18 -0.61 -0.00 -0.32 -0.35 121.20 122.21 1h4o s ILE 136 Ca 0.00 -0.53 -0.29 0.00 -0.00 0.00 0.00 60.65 59.83 1h4o s ILE 136 Cb 0.00 -3.18 -0.02 0.00 -0.00 0.00 0.00 42.46 39.26 1h4o s ILE 136 CO 0.00 0.27 1.35 -0.69 -0.00 0.00 0.00 174.94 175.87 1h4o s VAL 137 N -1.27 4.11 -0.06 8.37 1.01 0.28 -0.75 120.40 132.09 1h4o s VAL 137 Ca 0.25 1.32 0.18 0.00 0.00 0.00 0.00 61.98 63.74 1h4o s VAL 137 Cb -0.12 -3.93 -0.28 0.00 0.00 0.00 0.00 36.38 32.05 1h4o s VAL 137 CO 0.17 -0.21 0.34 0.29 0.00 0.00 0.00 175.10 175.69 1h4o n LYS 138 N 6.91 0.70 -3.73 2.72 4.76 0.04 -0.03 118.16 129.53 1h4o n LYS 138 Ca 0.15 -0.14 -0.13 0.00 -2.87 0.00 0.00 58.31 55.32 1h4o n LYS 138 Cb 0.45 -1.45 -0.10 0.00 -1.84 0.00 0.00 35.03 32.09 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 -3.12 -1.02 -0.04 7.82 0.00 -1.21 -4.89 121.76 119.31 1h4o s ALA 139 Ca -0.07 1.14 -0.02 0.00 0.00 0.00 0.00 51.96 53.01 1h4o s ALA 139 Cb 0.11 -0.65 0.03 0.00 0.00 0.00 0.00 23.12 22.61 1h4o s ALA 139 CO 0.77 -0.20 0.06 -1.17 0.00 0.00 0.00 175.76 175.23 1h4o s LEU 140 N 0.15 0.37 -0.20 0.00 2.96 -1.26 -1.91 118.68 118.79 1h4o s LEU 140 Ca -0.01 0.09 0.01 0.00 -0.22 0.00 0.00 54.13 54.01 1h4o s LEU 140 Cb -0.03 -0.08 0.04 0.00 0.50 0.00 0.00 46.19 46.62 1h4o s LEU 140 CO 0.01 -0.22 -0.10 0.20 -1.32 0.00 0.00 176.35 174.92 1h4o s ASN 141 N 1.88 3.48 -0.12 3.68 0.01 0.39 -5.00 114.94 119.25 1h4o s ASN 141 Ca 0.01 -0.93 0.03 0.00 -0.71 0.00 0.00 52.86 51.25 1h4o s ASN 141 Cb -0.12 -1.26 0.00 0.00 0.41 0.00 0.00 41.25 40.28 1h4o s ASN 141 CO -0.03 -0.15 -0.21 -0.69 -1.51 0.00 0.00 177.10 174.51 1h4o s VAL 142 N 1.37 2.27 0.20 1.60 1.01 -1.26 -0.53 120.40 125.05 1h4o s VAL 142 Ca -0.02 -0.93 -0.33 0.00 0.00 0.00 0.00 61.98 60.71 1h4o s VAL 142 Cb -0.16 -1.90 -0.13 0.00 0.00 0.00 0.00 36.38 34.18 1h4o s VAL 142 CO -0.08 0.55 1.59 -0.62 0.00 0.00 0.00 175.10 176.53 1h4o n GLU 143 N 3.76 2.33 0.28 2.72 -0.58 -0.66 -4.85 120.64 123.64 1h4o n GLU 143 Ca -0.19 0.84 0.14 0.00 -0.42 0.00 0.00 57.16 57.53 1h4o n GLU 143 Cb 0.52 -2.61 0.79 0.00 -0.57 0.00 0.00 31.44 29.58 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 5.77 0.00 -0.45 3.49 0.13 -1.96 -1.60 132.00 137.37 1h4o h PRO 144 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1h4o h PRO 144 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1h4o h PRO 144 CO 0.88 0.09 0.00 -0.40 -0.23 0.00 0.00 178.00 178.33 1h4o n ASP 145 N -3.57 3.48 0.00 1.44 5.75 -1.26 -4.98 116.55 117.41 1h4o n ASP 145 Ca -0.02 -2.17 0.00 0.00 -0.01 0.00 0.00 54.79 52.59 1h4o n ASP 145 Cb 0.21 -0.36 0.00 0.00 -1.03 0.00 0.00 41.12 39.94 1h4o n ASP 145 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1h4o n GLY 146 N 0.70 2.56 0.00 6.12 0.00 -0.60 -4.63 105.19 109.34 1h4o n GLY 146 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.49 0.00 -0.65 2.61 -2.24 -1.26 -0.71 114.28 111.54 1h4o n THR 147 Ca 0.00 -0.10 -0.15 0.00 -2.27 0.00 0.00 64.05 61.53 1h4o n THR 147 Cb 0.00 0.64 0.13 0.00 -2.10 0.00 0.00 70.33 68.99 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 0.62 -2.82 2.73 3.38 0.00 -1.26 -4.93 105.19 102.91 1h4o n GLY 148 Ca 0.00 -1.43 -0.28 0.00 0.00 0.00 0.00 46.02 44.31 1h4o n GLY 148 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1h4o n LEU 149 N 0.00 1.92 0.00 0.99 4.77 -1.26 -4.93 117.00 118.49 1h4o n LEU 149 Ca 0.07 -4.95 0.00 0.00 -0.03 0.00 0.00 56.01 51.10 1h4o n LEU 149 Cb 0.29 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 1h4o n LEU 149 CO 0.20 1.80 0.00 0.35 -1.33 0.00 0.00 177.39 178.40 1h4o n THR 150 N 2.21 0.00 0.36 -5.08 -2.24 -1.26 -4.94 114.28 103.33 1h4o n THR 150 Ca 0.23 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 62.14 1h4o n THR 150 Cb 0.39 0.00 0.54 0.00 -2.10 0.00 0.00 70.33 69.16 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 -2.37 1.28 -4.79 0.00 3.41 -1.26 -4.69 113.62 105.20 1h4o n SER 152 Ca 0.02 -1.11 -0.32 0.00 -0.26 0.00 0.00 58.87 57.19 1h4o n SER 152 Cb 0.22 0.14 0.04 0.00 -0.26 0.00 0.00 64.21 64.35 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 -2.38 3.34 0.23 1.04 1.43 -1.04 -4.52 118.68 116.77 1h4o s LEU 153 Ca 0.27 1.84 -0.06 0.00 -1.03 0.00 0.00 54.13 55.15 1h4o s LEU 153 Cb 0.19 -4.53 0.40 0.00 0.03 0.00 0.00 46.19 42.28 1h4o s LEU 153 CO 0.48 -1.48 1.72 0.00 0.23 0.00 0.00 176.35 177.30 1h4o h ALA 154 N -0.09 0.92 -0.75 4.21 0.00 -1.88 -2.17 119.26 119.51 1h4o h ALA 154 Ca -0.46 0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.63 1h4o h ALA 154 Cb 1.23 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 19.11 1h4o h ALA 154 CO 0.55 -0.26 0.49 -1.35 0.00 0.00 0.00 179.25 178.69 1h4o h PRO 155 N 0.36 0.82 -0.19 0.00 0.11 -1.93 -1.66 132.00 129.51 1h4o h PRO 155 Ca 0.38 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.36 1h4o h PRO 155 Cb 0.58 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.49 1h4o h PRO 155 CO -0.41 0.54 -0.24 -0.97 -0.21 0.00 0.00 178.00 176.71 1h4o h ASN 156 N 0.84 0.34 0.43 -2.05 -1.24 -1.69 -2.85 115.58 109.37 1h4o h ASN 156 Ca 0.31 -0.11 -0.17 0.00 0.71 0.00 0.00 56.30 57.05 1h4o h ASN 156 Cb 0.16 -0.09 -0.01 0.00 0.73 0.00 0.00 38.32 39.11 1h4o h ASN 156 CO -0.10 0.59 -0.72 -0.29 -1.29 0.00 0.00 177.43 175.62 1h4o h ILE 157 N 0.31 1.43 -0.73 2.57 2.10 -1.24 -3.04 117.51 118.91 1h4o h ILE 157 Ca 0.05 -2.24 0.01 0.00 1.08 0.00 0.00 64.86 63.76 1h4o h ILE 157 Cb 0.59 2.19 -0.04 0.00 -1.09 0.00 0.00 36.82 38.48 1h4o h ILE 157 CO 0.04 0.66 0.48 0.40 -1.08 0.00 0.00 178.15 178.66 1h4o h ILE 158 N 0.16 1.18 0.00 2.19 2.04 -1.21 0.12 117.51 122.00 1h4o h ILE 158 Ca -0.02 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 65.50 1h4o h ILE 158 Cb 1.28 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.47 1h4o h ILE 158 CO 0.11 0.18 0.00 0.77 0.00 0.00 0.00 178.15 179.21 1h4o h SER 159 N 0.99 0.00 -0.02 1.72 4.64 -1.42 -2.51 113.55 116.95 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 -0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.99 1h4o h SER 159 CO -0.06 0.00 -0.12 0.00 -0.87 0.00 0.00 176.83 175.77 1h4o n GLN 160 N -2.73 1.84 0.00 4.77 6.02 0.36 -5.13 117.38 122.51 1h4o n GLN 160 Ca -0.01 -1.56 0.14 0.00 -0.01 0.00 0.00 57.00 55.57 1h4o n GLN 160 Cb 0.16 -1.42 0.59 0.00 1.02 0.00 0.00 30.24 30.59 1h4o n GLN 160 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33