#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d4g s GLU 4 N 0.00 1.71 0.34 1.09 -1.05 -1.26 -4.95 118.70 114.58 3d4g s GLU 4 Ca 0.00 -1.85 -0.12 0.00 -0.15 0.00 0.00 54.97 52.85 3d4g s GLU 4 Cb 0.00 -1.61 -0.08 0.00 -0.44 0.00 0.00 34.13 32.01 3d4g s GLU 4 CO 0.00 0.18 0.72 -2.00 0.95 0.00 0.00 175.26 175.11 3d4g s GLU 5 N -3.60 3.88 0.00 -4.83 2.12 -1.26 -4.22 118.70 110.79 3d4g s GLU 5 Ca 0.31 0.52 0.00 0.00 0.36 0.00 0.00 54.97 56.16 3d4g s GLU 5 Cb 0.00 -2.45 0.00 0.00 0.26 0.00 0.00 34.13 31.94 3d4g s GLU 5 CO 0.15 0.11 0.00 0.41 -0.54 0.00 0.00 175.26 175.39 3d4g n GLY 6 N -0.70 0.68 3.75 -1.50 0.00 -1.26 -5.04 105.19 101.12 3d4g n GLY 6 Ca 0.03 -0.27 -0.09 0.00 0.00 0.00 0.00 46.02 45.68 3d4g n GLY 6 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d4g s LYS 7 N -0.74 1.94 -0.09 1.61 -2.85 -1.26 -4.33 119.74 114.01 3d4g s LYS 7 Ca 0.00 -1.30 0.01 0.00 -1.00 0.00 0.00 55.97 53.68 3d4g s LYS 7 Cb 0.00 0.57 0.02 0.00 -2.06 0.00 0.00 37.83 36.36 3d4g s LYS 7 CO 0.00 -0.87 -0.10 -0.51 0.10 0.00 0.00 175.35 173.97 3d4g s LEU 8 N -3.03 1.40 -0.17 2.77 1.43 -0.65 -4.85 118.68 115.57 3d4g s LEU 8 Ca 0.17 -0.31 -0.05 0.00 -1.03 0.00 0.00 54.13 52.91 3d4g s LEU 8 Cb -0.04 -0.84 -0.03 0.00 0.03 0.00 0.00 46.19 45.30 3d4g s LEU 8 CO 0.11 -0.05 0.00 -0.69 0.23 0.00 0.00 176.35 175.95 3d4g s VAL 9 N 1.24 4.23 -0.07 -1.59 1.01 -1.26 -0.62 120.40 123.35 3d4g s VAL 9 Ca -0.04 -0.23 0.04 0.00 0.00 0.00 0.00 61.98 61.75 3d4g s VAL 9 Cb -0.14 -2.88 0.00 0.00 0.00 0.00 0.00 36.38 33.36 3d4g s VAL 9 CO -0.03 0.47 -0.20 -0.63 0.00 0.00 0.00 175.10 174.72 3d4g s ILE 10 N 0.43 1.68 -0.14 2.22 1.01 -0.05 -0.58 121.20 125.77 3d4g s ILE 10 Ca -0.01 -0.82 -0.05 0.00 0.00 0.00 0.00 60.65 59.77 3d4g s ILE 10 Cb -0.14 -1.46 -0.04 0.00 0.01 0.00 0.00 42.46 40.84 3d4g s ILE 10 CO 0.02 0.48 0.03 0.26 0.00 0.00 0.00 174.94 175.73 3d4g s TRP 11 N 0.25 3.21 -0.01 3.97 0.52 -0.60 0.20 118.94 126.48 3d4g s TRP 11 Ca -0.11 0.08 -0.12 0.00 0.02 0.00 0.00 56.10 55.97 3d4g s TRP 11 Cb -0.15 -1.96 0.02 0.00 -1.15 0.00 0.00 33.47 30.23 3d4g s TRP 11 CO 0.05 0.27 0.24 -1.50 0.02 0.00 0.00 176.95 176.03 3d4g s ILE 12 N -0.13 0.06 0.56 2.03 2.07 -0.59 -0.08 121.20 125.12 3d4g s ILE 12 Ca 0.06 -0.52 -0.20 0.00 -1.41 0.00 0.00 60.65 58.58 3d4g s ILE 12 Cb -0.12 -0.53 -0.05 0.00 0.13 0.00 0.00 42.46 41.89 3d4g s ILE 12 CO 0.02 -0.29 1.19 0.21 -1.91 0.00 0.00 174.94 174.16 3d4g s ASN 13 N -1.25 5.45 0.50 4.50 2.47 -1.26 -4.01 114.94 121.34 3d4g s ASN 13 Ca -0.13 2.35 0.34 0.00 0.42 0.00 0.00 52.86 55.84 3d4g s ASN 13 Cb -0.06 -2.60 1.67 0.00 -1.45 0.00 0.00 41.25 38.82 3d4g s ASN 13 CO 0.03 -1.42 2.02 1.23 -3.72 0.00 0.00 177.10 175.25 3d4g h GLY 14 N 1.15 0.00 -0.16 1.21 0.00 -1.87 -2.05 103.07 101.35 3d4g h GLY 14 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.83 3d4g h GLY 14 CO 0.56 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.19 3d4g n ASP 15 N -2.79 1.17 -5.00 0.19 5.75 -1.26 -4.91 116.55 109.71 3d4g n ASP 15 Ca -0.01 -1.40 -0.18 0.00 -0.01 0.00 0.00 54.79 53.19 3d4g n ASP 15 Cb 0.15 -0.01 0.01 0.00 -1.03 0.00 0.00 41.12 40.24 3d4g n ASP 15 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3d4g s LYS 16 N -1.99 2.93 -1.16 0.11 -0.14 -0.77 -4.80 119.74 113.92 3d4g s LYS 16 Ca 0.40 -1.13 -0.15 0.00 -1.36 0.00 0.00 55.97 53.73 3d4g s LYS 16 Cb 0.21 -2.77 -0.06 0.00 -1.68 0.00 0.00 37.83 33.53 3d4g s LYS 16 CO 0.34 -0.17 2.20 0.41 -0.76 0.00 0.00 175.35 177.37 3d4g n GLY 17 N -1.80 3.57 0.15 -3.33 0.00 -1.26 -4.70 105.19 97.82 3d4g n GLY 17 Ca 0.05 -1.37 0.02 0.00 0.00 0.00 0.00 46.02 44.72 3d4g n GLY 17 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 3d4g h TYR 18 N 6.59 0.00 -0.43 1.61 -0.00 -1.91 -1.03 116.97 121.80 3d4g h TYR 18 Ca 0.55 0.00 -0.13 0.00 0.00 0.00 0.00 58.73 59.15 3d4g h TYR 18 Cb 0.54 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.26 3d4g h TYR 18 CO 1.50 0.54 -0.24 -0.91 -0.00 0.00 0.00 178.16 179.05 3d4g h ASN 19 N 0.00 0.96 -0.56 0.10 -0.26 -1.97 -0.58 115.58 113.26 3d4g h ASN 19 Ca -0.01 -0.41 -0.05 0.00 -0.56 0.00 0.00 56.30 55.27 3d4g h ASN 19 Cb 1.19 -0.26 -0.02 0.00 -1.06 0.00 0.00 38.32 38.16 3d4g h ASN 19 CO 0.07 1.16 0.16 1.23 -1.06 0.00 0.00 177.43 178.99 3d4g h GLY 20 N 0.75 0.95 1.28 2.83 0.00 -1.72 -0.59 103.07 106.57 3d4g h GLY 20 Ca 0.09 -0.58 -0.01 0.00 0.00 0.00 0.00 47.33 46.84 3d4g h GLY 20 CO 0.07 0.54 0.42 -2.00 0.00 0.00 0.00 176.54 175.56 3d4g h LEU 21 N 0.79 0.84 -1.20 3.11 5.85 -1.18 -2.10 115.31 121.42 3d4g h LEU 21 Ca 0.18 -0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.80 3d4g h LEU 21 Cb 0.31 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 3d4g h LEU 21 CO -0.00 0.65 0.02 0.00 -0.34 0.00 0.00 178.44 178.77 3d4g h ALA 22 N 1.49 1.35 -0.63 1.25 0.00 -0.62 -1.09 119.26 121.01 3d4g h ALA 22 Ca 0.25 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 3d4g h ALA 22 Cb -0.03 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3d4g h ALA 22 CO -0.05 0.45 0.06 0.93 0.00 0.00 0.00 179.25 180.65 3d4g h GLU 23 N 0.55 1.08 -0.23 0.00 5.08 -0.51 0.71 114.58 121.25 3d4g h GLU 23 Ca 0.12 -0.31 -0.06 0.00 -1.00 0.00 0.00 59.36 58.11 3d4g h GLU 23 Cb 0.32 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 3d4g h GLU 23 CO 0.01 1.01 -0.12 0.28 -1.00 0.00 0.00 179.01 179.19 3d4g h VAL 24 N 0.99 1.21 -0.07 3.13 2.07 -1.00 -2.24 116.25 120.33 3d4g h VAL 24 Ca 0.19 -0.90 -0.13 0.00 0.82 0.00 0.00 66.70 66.67 3d4g h VAL 24 Cb 0.49 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 3d4g h VAL 24 CO 0.02 0.29 -0.56 1.23 0.02 0.00 0.00 177.57 178.57 3d4g h GLY 25 N 0.85 0.22 1.00 2.17 0.00 -0.75 -1.85 103.07 104.70 3d4g h GLY 25 Ca 0.07 -0.26 -0.06 0.00 0.00 0.00 0.00 47.33 47.08 3d4g h GLY 25 CO 0.02 0.23 0.11 0.50 0.00 0.00 0.00 176.54 177.41 3d4g h LYS 26 N 0.15 0.87 -0.56 4.80 1.79 -0.50 -1.82 116.57 121.30 3d4g h LYS 26 Ca -0.00 -0.22 -0.05 0.00 -2.18 0.00 0.00 60.65 58.19 3d4g h LYS 26 Cb 1.04 -0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 31.56 3d4g h LYS 26 CO 0.08 0.84 0.14 -0.22 -1.08 0.00 0.00 179.45 179.21 3d4g h LYS 27 N 0.76 0.90 -0.71 3.15 3.64 -1.35 -1.90 116.57 121.06 3d4g h LYS 27 Ca 0.17 -0.21 0.06 0.00 -1.27 0.00 0.00 60.65 59.39 3d4g h LYS 27 Cb 0.37 -0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 32.02 3d4g h LYS 27 CO 0.01 0.84 0.41 0.35 -2.27 0.00 0.00 179.45 178.78 3d4g h PHE 28 N 0.80 0.76 -0.54 1.91 3.57 -1.22 -2.17 116.94 120.04 3d4g h PHE 28 Ca 0.18 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.61 3d4g h PHE 28 Cb 0.34 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 3d4g h PHE 28 CO 0.02 0.37 -0.02 1.49 -2.23 0.00 0.00 178.31 177.95 3d4g h GLU 29 N 0.76 0.95 -0.23 1.11 4.81 -1.14 -0.86 114.58 119.96 3d4g h GLU 29 Ca 0.31 -0.29 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 3d4g h GLU 29 Cb 0.16 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 3d4g h GLU 29 CO -0.17 0.95 0.15 -0.22 -0.73 0.00 0.00 179.01 178.99 3d4g h LYS 30 N 0.87 0.31 0.04 1.92 3.64 -0.91 0.29 116.57 122.72 3d4g h LYS 30 Ca 0.16 -0.02 -0.26 0.00 -1.27 0.00 0.00 60.65 59.25 3d4g h LYS 30 Cb 0.54 -0.07 0.02 0.00 -0.41 0.00 0.00 32.23 32.31 3d4g h LYS 30 CO 0.03 0.21 -1.08 -0.44 -2.27 0.00 0.00 179.45 175.89 3d4g h ASP 31 N 0.31 0.74 0.00 4.20 5.19 -1.34 -3.39 116.42 122.13 3d4g h ASP 31 Ca 0.09 -0.63 -0.15 0.00 -0.62 0.00 0.00 57.03 55.71 3d4g h ASP 31 Cb -0.03 -0.23 -0.03 0.00 0.18 0.00 0.00 39.33 39.22 3d4g h ASP 31 CO -0.02 1.44 -1.80 0.41 -3.12 0.00 0.00 179.24 176.16 3d4g n THR 32 N -3.77 0.58 -0.31 0.35 -1.04 -0.34 -5.01 114.28 104.74 3d4g n THR 32 Ca -0.10 -0.47 0.00 0.00 -2.04 0.00 0.00 64.05 61.44 3d4g n THR 32 Cb 0.91 -0.37 0.00 0.00 -1.82 0.00 0.00 70.33 69.04 3d4g n THR 32 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3d4g n GLY 33 N 2.04 1.05 3.64 3.41 0.00 0.10 -5.03 105.19 110.40 3d4g n GLY 33 Ca -0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 3d4g n GLY 33 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d4g s ILE 34 N -2.81 5.04 0.32 -0.61 1.09 -1.26 -4.98 121.20 118.00 3d4g s ILE 34 Ca 0.00 1.02 -0.28 0.00 -1.10 0.00 0.00 60.65 60.29 3d4g s ILE 34 Cb 0.00 -3.88 -0.09 0.00 -1.06 0.00 0.00 42.46 37.43 3d4g s ILE 34 CO 0.00 0.09 1.13 -0.75 -0.10 0.00 0.00 174.94 175.31 3d4g s LYS 35 N 2.17 4.44 -0.18 2.79 2.20 -1.26 -3.62 119.74 126.28 3d4g s LYS 35 Ca 0.24 1.81 0.01 0.00 -0.36 0.00 0.00 55.97 57.67 3d4g s LYS 35 Cb -0.16 -2.99 0.03 0.00 -1.51 0.00 0.00 37.83 33.20 3d4g s LYS 35 CO 0.09 0.03 -0.15 0.08 -0.36 0.00 0.00 175.35 175.04 3d4g s VAL 36 N -1.28 1.80 -0.32 4.02 1.01 -1.26 -1.64 120.40 122.73 3d4g s VAL 36 Ca 0.49 -0.90 -0.06 0.00 0.00 0.00 0.00 61.98 61.51 3d4g s VAL 36 Cb -0.31 -1.72 0.03 0.00 0.00 0.00 0.00 36.38 34.38 3d4g s VAL 36 CO 0.40 0.38 0.08 -0.89 0.00 0.00 0.00 175.10 175.08 3d4g s THR 37 N 1.37 3.76 -0.20 3.92 2.01 0.21 -4.83 115.64 121.89 3d4g s THR 37 Ca 0.02 -1.00 -0.17 0.00 0.31 0.00 0.00 61.69 60.86 3d4g s THR 37 Cb -0.14 -3.06 -0.04 0.00 0.01 0.00 0.00 72.50 69.27 3d4g s THR 37 CO -0.10 -0.08 0.43 -0.69 -0.69 0.00 0.00 174.62 173.49 3d4g s VAL 38 N 1.42 5.17 0.11 3.82 1.01 -1.26 -0.87 120.40 129.81 3d4g s VAL 38 Ca -0.00 0.78 0.08 0.00 0.00 0.00 0.00 61.98 62.84 3d4g s VAL 38 Cb -0.19 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 3d4g s VAL 38 CO 0.02 0.23 -0.19 -1.61 0.00 0.00 0.00 175.10 173.55 3d4g s GLU 39 N 1.41 1.11 -0.50 2.72 2.02 0.13 -4.96 118.70 120.63 3d4g s GLU 39 Ca 0.21 -1.20 0.08 0.00 0.02 0.00 0.00 54.97 54.07 3d4g s GLU 39 Cb -0.15 -1.28 0.30 0.00 0.10 0.00 0.00 34.13 33.10 3d4g s GLU 39 CO 0.09 0.28 0.75 -2.39 0.02 0.00 0.00 175.26 174.01 3d4g n HIS 40 N 0.89 2.03 -2.03 1.61 1.44 -1.26 -1.54 115.22 116.37 3d4g n HIS 40 Ca -0.18 -3.90 -0.36 0.00 -2.01 0.00 0.00 57.72 51.27 3d4g n HIS 40 Cb 0.55 -0.46 0.03 0.00 0.12 0.00 0.00 29.99 30.23 3d4g n HIS 40 CO 0.00 0.00 0.00 -1.25 -2.81 0.00 0.00 176.34 172.28 3d4g s PRO 41 N -2.45 3.00 0.45 -1.40 0.04 -1.26 -4.56 135.00 128.82 3d4g s PRO 41 Ca 0.41 1.79 -0.23 0.00 0.04 0.00 0.00 61.00 63.01 3d4g s PRO 41 Cb 0.24 -1.94 -0.08 0.00 0.04 0.00 0.00 34.50 32.76 3d4g s PRO 41 CO -0.09 -1.17 1.16 0.34 0.04 0.00 0.00 177.00 177.28 3d4g s ASP 42 N -1.65 6.24 -1.46 6.66 2.15 -1.26 -3.47 116.67 123.87 3d4g s ASP 42 Ca 0.76 2.29 -0.11 0.00 0.43 0.00 0.00 52.55 55.93 3d4g s ASP 42 Cb -0.29 -2.60 0.05 0.00 -0.30 0.00 0.00 42.92 39.78 3d4g s ASP 42 CO 0.33 -0.87 0.94 0.29 -0.17 0.00 0.00 175.17 175.68 3d4g n LYS 43 N -0.42 -5.96 0.20 4.34 4.76 -1.26 -4.86 118.16 114.97 3d4g n LYS 43 Ca 0.07 0.71 0.04 0.00 -2.87 0.00 0.00 58.31 56.25 3d4g n LYS 43 Cb 0.48 -5.63 0.42 0.00 -1.84 0.00 0.00 35.03 28.46 3d4g n LYS 43 CO 0.00 0.00 0.00 1.37 -1.37 0.00 0.00 177.40 177.40 3d4g h LEU 44 N -2.05 0.00 -1.42 -0.35 8.10 -1.96 0.51 115.31 118.15 3d4g h LEU 44 Ca -0.55 0.00 -0.06 0.00 0.11 0.00 0.00 57.88 57.38 3d4g h LEU 44 Cb 1.36 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 41.58 3d4g h LEU 44 CO 0.61 0.31 -0.28 1.05 -4.11 0.00 0.00 178.44 176.02 3d4g h GLU 45 N 0.00 0.00 0.09 0.17 9.09 -1.90 0.65 114.58 122.68 3d4g h GLU 45 Ca -0.00 0.00 -0.34 0.00 0.05 0.00 0.00 59.36 59.07 3d4g h GLU 45 Cb 0.56 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.63 3d4g h GLU 45 CO 0.04 0.28 -1.84 0.93 0.05 0.00 0.00 179.01 178.46 3d4g h GLU 46 N 0.00 0.20 -0.30 1.06 5.08 -1.71 -3.40 114.58 115.51 3d4g h GLU 46 Ca -0.00 -0.34 -0.19 0.00 -1.00 0.00 0.00 59.36 57.84 3d4g h GLU 46 Cb 0.58 0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.96 3d4g h GLU 46 CO 0.04 1.00 -0.54 0.87 -1.00 0.00 0.00 179.01 179.38 3d4g h LYS 47 N 0.05 0.89 -0.26 2.33 1.57 -0.72 -3.33 116.57 117.11 3d4g h LYS 47 Ca -0.36 -0.56 0.06 0.00 -1.87 0.00 0.00 60.65 57.92 3d4g h LYS 47 Cb 2.03 0.06 -0.08 0.00 0.08 0.00 0.00 32.23 34.33 3d4g h LYS 47 CO 0.10 1.20 -0.42 0.35 -0.57 0.00 0.00 179.45 180.11 3d4g h PHE 48 N 0.68 -1.20 0.00 -1.35 3.57 -1.08 -1.00 116.94 116.57 3d4g h PHE 48 Ca 0.02 0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 3d4g h PHE 48 Cb 1.15 0.56 -0.00 0.00 2.79 0.00 0.00 35.95 40.45 3d4g h PHE 48 CO 0.07 -0.45 -0.03 -1.00 -2.23 0.00 0.00 178.31 174.67 3d4g h PRO 49 N -0.41 0.00 -0.10 6.41 0.13 -1.79 0.33 132.00 136.58 3d4g h PRO 49 Ca 0.11 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.21 3d4g h PRO 49 Cb 0.60 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.73 3d4g h PRO 49 CO -0.47 0.03 -0.03 1.96 -0.23 0.00 0.00 178.00 179.26 3d4g h GLN 50 N 0.00 0.19 0.13 0.86 4.20 -1.32 -2.76 115.11 116.40 3d4g h GLN 50 Ca -0.00 -0.07 -0.28 0.00 0.06 0.00 0.00 58.65 58.36 3d4g h GLN 50 Cb 0.05 -0.01 0.01 0.00 0.30 0.00 0.00 27.48 27.84 3d4g h GLN 50 CO 0.00 0.50 -1.23 -0.39 -0.67 0.00 0.00 178.83 177.05 3d4g h VAL 51 N -0.14 1.41 -0.45 -0.54 -1.51 -1.02 -3.32 116.25 110.66 3d4g h VAL 51 Ca 0.02 -2.78 -0.05 0.00 -1.23 0.00 0.00 66.70 62.66 3d4g h VAL 51 Cb 0.44 2.82 -0.02 0.00 -2.13 0.00 0.00 31.29 32.39 3d4g h VAL 51 CO 0.01 0.82 0.08 0.00 -1.23 0.00 0.00 177.57 177.26 3d4g h ALA 52 N 0.49 1.30 0.00 5.19 0.00 -0.44 -1.19 119.26 124.61 3d4g h ALA 52 Ca -0.15 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.51 3d4g h ALA 52 Cb 1.92 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.51 3d4g h ALA 52 CO 0.21 0.49 -0.23 0.00 0.00 0.00 0.00 179.25 179.73 3d4g h ALA 53 N 1.42 1.33 -0.00 0.00 0.00 -1.59 -1.26 119.26 119.16 3d4g h ALA 53 Ca 0.15 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3d4g h ALA 53 Cb 0.29 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3d4g h ALA 53 CO 0.00 0.29 -0.02 0.25 0.00 0.00 0.00 179.25 179.77 3d4g n THR 54 N -3.84 0.00 -0.28 0.00 -2.24 -1.00 -4.90 114.28 102.02 3d4g n THR 54 Ca -0.02 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 3d4g n THR 54 Cb 0.32 -0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.38 3d4g n THR 54 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d4g n GLY 55 N 1.11 0.75 0.00 3.38 0.00 -0.47 -5.06 105.19 104.90 3d4g n GLY 55 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 3d4g n GLY 55 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3d4g n ASP 56 N 0.00 0.14 0.00 1.61 8.00 -0.48 -4.43 116.55 121.38 3d4g n ASP 56 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 3d4g n ASP 56 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 3d4g n ASP 56 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d4g n GLY 57 N 5.00 -3.33 3.84 0.44 0.00 -1.26 -3.85 105.19 106.04 3d4g n GLY 57 Ca 0.00 -1.84 -0.30 0.00 0.00 0.00 0.00 46.02 43.88 3d4g n GLY 57 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3d4g s PRO 58 N -0.94 2.24 0.08 1.61 0.04 -1.26 -3.71 135.00 133.05 3d4g s PRO 58 Ca 0.00 0.47 -0.15 0.00 0.04 0.00 0.00 61.00 61.36 3d4g s PRO 58 Cb 0.00 -1.95 -0.16 0.00 0.04 0.00 0.00 34.50 32.43 3d4g s PRO 58 CO 0.00 -1.47 1.29 -0.44 0.04 0.00 0.00 177.00 176.41 3d4g h ASP 59 N -0.97 0.81 -4.40 6.66 3.32 -1.23 -3.40 116.42 117.20 3d4g h ASP 59 Ca -0.47 -0.62 -0.59 0.00 0.02 0.00 0.00 57.03 55.37 3d4g h ASP 59 Cb 1.28 -0.24 -0.29 0.00 0.22 0.00 0.00 39.33 40.30 3d4g h ASP 59 CO 0.62 1.29 -0.85 -0.63 -1.72 0.00 0.00 179.24 177.95 3d4g s ILE 60 N -3.78 1.60 -0.09 0.35 1.01 -0.98 -0.91 121.20 118.40 3d4g s ILE 60 Ca -0.11 -0.89 0.03 0.00 0.00 0.00 0.00 60.65 59.67 3d4g s ILE 60 Cb 0.07 -1.34 0.01 0.00 0.01 0.00 0.00 42.46 41.22 3d4g s ILE 60 CO 0.87 0.43 -0.18 -0.51 0.00 0.00 0.00 174.94 175.55 3d4g s ILE 61 N -0.50 1.59 -0.18 2.92 2.07 -0.47 -1.56 121.20 125.06 3d4g s ILE 61 Ca 0.08 -0.73 -0.09 0.00 -1.41 0.00 0.00 60.65 58.50 3d4g s ILE 61 Cb -0.08 -1.41 -0.05 0.00 0.13 0.00 0.00 42.46 41.05 3d4g s ILE 61 CO -0.01 0.46 0.10 -0.36 -1.91 0.00 0.00 174.94 173.22 3d4g s PHE 62 N 0.63 3.36 0.22 3.50 0.40 0.88 -1.19 117.98 125.79 3d4g s PHE 62 Ca -0.14 0.25 -0.23 0.00 -0.60 0.00 0.00 56.93 56.22 3d4g s PHE 62 Cb -0.16 -2.10 0.04 0.00 0.51 0.00 0.00 43.02 41.30 3d4g s PHE 62 CO 0.04 0.29 0.81 -0.46 0.70 0.00 0.00 175.22 176.59 3d4g s TRP 63 N 0.21 -0.19 0.73 0.36 -0.11 -0.60 -4.38 118.94 114.96 3d4g s TRP 63 Ca 0.07 -0.19 -0.16 0.00 1.22 0.00 0.00 56.10 57.04 3d4g s TRP 63 Cb -0.12 0.67 0.03 0.00 -1.50 0.00 0.00 33.47 32.56 3d4g s TRP 63 CO -0.01 -1.05 1.21 0.00 -4.62 0.00 0.00 176.95 172.49 3d4g n ALA 64 N -0.45 0.47 0.29 5.86 0.00 -1.26 0.48 120.51 125.89 3d4g n ALA 64 Ca -0.05 -0.17 0.17 0.00 0.00 0.00 0.00 53.44 53.39 3d4g n ALA 64 Cb 0.60 -2.27 0.82 0.00 0.00 0.00 0.00 19.45 18.60 3d4g n ALA 64 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 3d4g h HIS 65 N -0.20 0.00 0.00 0.00 2.07 -1.12 -3.17 115.15 112.73 3d4g h HIS 65 Ca -0.48 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.01 3d4g h HIS 65 Cb 1.32 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.30 3d4g h HIS 65 CO 0.43 0.00 -0.14 0.38 -3.07 0.00 0.00 177.93 175.53 3d4g h ASP 66 N 0.00 0.00 1.68 3.10 2.03 -1.86 -2.60 116.42 118.76 3d4g h ASP 66 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3d4g h ASP 66 Cb 0.18 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.68 3d4g h ASP 66 CO 0.00 0.14 -0.26 0.03 -1.03 0.00 0.00 179.24 178.13 3d4g h ARG 67 N 0.00 0.00 0.00 4.15 2.47 -1.85 -3.40 114.38 115.75 3d4g h ARG 67 Ca -0.00 0.00 -0.11 0.00 -1.26 0.00 0.00 59.98 58.61 3d4g h ARG 67 Cb 0.38 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.68 3d4g h ARG 67 CO 0.02 0.00 -0.54 0.74 0.56 0.00 0.00 179.97 180.75 3d4g h PHE 68 N 0.00 0.00 -0.57 3.04 -1.00 -1.69 -3.05 116.94 113.67 3d4g h PHE 68 Ca 0.00 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 3d4g h PHE 68 Cb 0.97 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 40.50 3d4g h PHE 68 CO 0.00 0.54 0.28 0.78 -1.61 0.00 0.00 178.31 178.30 3d4g h GLY 69 N 2.54 0.88 0.81 -1.45 0.00 -1.66 0.17 103.07 104.37 3d4g h GLY 69 Ca -0.01 -0.43 0.03 0.00 0.00 0.00 0.00 47.33 46.92 3d4g h GLY 69 CO 0.07 0.41 0.18 -1.33 0.00 0.00 0.00 176.54 175.87 3d4g h GLY 70 N 0.78 0.49 0.99 4.60 0.00 -1.63 0.41 103.07 108.71 3d4g h GLY 70 Ca 0.20 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.40 3d4g h GLY 70 CO -0.03 0.09 0.23 -0.97 0.00 0.00 0.00 176.54 175.87 3d4g h TYR 71 N 0.37 0.47 0.04 5.60 0.05 -1.38 -1.35 116.97 120.77 3d4g h TYR 71 Ca 0.16 0.01 0.01 0.00 0.05 0.00 0.00 58.73 58.95 3d4g h TYR 71 Cb 0.07 -0.16 -0.02 0.00 1.01 0.00 0.00 36.73 37.64 3d4g h TYR 71 CO -0.10 0.31 -0.09 0.00 -1.05 0.00 0.00 178.16 177.23 3d4g h ALA 72 N 1.12 -0.13 -0.62 3.88 0.00 -0.48 -1.52 119.26 121.50 3d4g h ALA 72 Ca 0.13 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.14 3d4g h ALA 72 Cb -0.03 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 3d4g h ALA 72 CO -0.03 -0.60 0.42 0.37 0.00 0.00 0.00 179.25 179.41 3d4g h GLN 73 N -0.18 0.40 -0.03 0.00 4.15 -0.74 -0.24 115.11 118.48 3d4g h GLN 73 Ca 0.02 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3d4g h GLN 73 Cb 0.20 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 27.80 3d4g h GLN 73 CO -0.07 0.27 0.00 0.43 -1.93 0.00 0.00 178.83 177.53 3d4g n SER 74 N -4.47 0.53 -1.00 -0.69 7.64 -0.52 -4.91 113.62 110.20 3d4g n SER 74 Ca 0.10 -1.31 -0.08 0.00 1.01 0.00 0.00 58.87 58.59 3d4g n SER 74 Cb 0.39 -0.01 -0.00 0.00 -1.01 0.00 0.00 64.21 63.57 3d4g n SER 74 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3d4g n GLY 75 N 1.00 0.04 0.08 0.23 0.00 -0.10 -4.93 105.19 101.50 3d4g n GLY 75 Ca 0.19 -0.52 0.10 0.00 0.00 0.00 0.00 46.02 45.79 3d4g n GLY 75 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3d4g n LEU 76 N -1.27 1.14 -4.38 0.99 4.77 -0.64 -4.77 117.00 112.84 3d4g n LEU 76 Ca -0.09 -0.54 -0.32 0.00 -0.03 0.00 0.00 56.01 55.03 3d4g n LEU 76 Cb 0.57 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.52 3d4g n LEU 76 CO 0.12 0.27 -0.52 -0.76 -1.33 0.00 0.00 177.39 175.17 3d4g s LEU 77 N -2.90 2.35 0.25 2.23 1.43 -1.26 -0.61 118.68 120.17 3d4g s LEU 77 Ca 0.09 -0.35 -0.27 0.00 -1.03 0.00 0.00 54.13 52.57 3d4g s LEU 77 Cb 0.16 -1.43 -0.09 0.00 0.03 0.00 0.00 46.19 44.86 3d4g s LEU 77 CO 0.81 0.33 0.90 0.00 0.23 0.00 0.00 176.35 178.61 3d4g s ALA 78 N -0.67 3.33 0.17 4.21 0.00 0.70 -4.52 121.76 124.98 3d4g s ALA 78 Ca 0.11 0.51 -0.31 0.00 0.00 0.00 0.00 51.96 52.27 3d4g s ALA 78 Cb -0.10 -3.13 -0.09 0.00 0.00 0.00 0.00 23.12 19.80 3d4g s ALA 78 CO -0.00 0.22 1.38 -2.00 0.00 0.00 0.00 175.76 175.36 3d4g s GLU 79 N -1.49 4.33 0.14 0.00 2.12 -1.26 -4.60 118.70 117.93 3d4g s GLU 79 Ca 0.43 2.13 -0.12 0.00 0.36 0.00 0.00 54.97 57.77 3d4g s GLU 79 Cb -0.23 -3.19 -0.07 0.00 0.26 0.00 0.00 34.13 30.90 3d4g s GLU 79 CO 0.28 -0.38 0.50 0.96 -0.54 0.00 0.00 175.26 176.07 3d4g s ILE 80 N 0.53 4.96 -0.43 -3.70 -4.36 -0.94 -5.05 121.20 112.22 3d4g s ILE 80 Ca 0.61 0.61 0.09 0.00 -0.26 0.00 0.00 60.65 61.70 3d4g s ILE 80 Cb -0.38 -3.68 0.29 0.00 1.25 0.00 0.00 42.46 39.94 3d4g s ILE 80 CO 0.36 0.19 0.66 0.35 0.24 0.00 0.00 174.94 176.73 3d4g n THR 81 N 0.62 0.18 -2.66 8.37 -2.24 -1.26 -4.67 114.28 112.62 3d4g n THR 81 Ca -0.05 -4.49 -0.36 0.00 -2.27 0.00 0.00 64.05 56.88 3d4g n THR 81 Cb 0.52 -1.35 -0.05 0.00 -2.10 0.00 0.00 70.33 67.35 3d4g n THR 81 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3d4g s PRO 82 N -1.96 4.27 1.10 -0.78 0.05 -1.26 -5.05 135.00 131.37 3d4g s PRO 82 Ca 0.39 1.38 -0.15 0.00 0.05 0.00 0.00 61.00 62.67 3d4g s PRO 82 Cb 0.24 -2.52 0.24 0.00 0.05 0.00 0.00 34.50 32.51 3d4g s PRO 82 CO -0.09 -0.02 1.08 0.16 0.05 0.00 0.00 177.00 178.18 3d4g s ASP 83 N -1.71 1.74 0.22 6.66 1.47 -1.26 -4.82 116.67 118.97 3d4g s ASP 83 Ca 0.57 1.03 -0.09 0.00 1.18 0.00 0.00 52.55 55.25 3d4g s ASP 83 Cb -0.18 -1.59 0.17 0.00 -0.34 0.00 0.00 42.92 40.98 3d4g s ASP 83 CO 0.23 -3.66 1.85 0.50 0.68 0.00 0.00 175.17 174.77 3d4g h LYS 84 N -2.26 1.11 -0.59 2.11 1.63 -1.98 -1.96 116.57 114.64 3d4g h LYS 84 Ca -0.53 -0.11 0.06 0.00 -0.85 0.00 0.00 60.65 59.22 3d4g h LYS 84 Cb 1.32 -0.23 -0.05 0.00 -0.60 0.00 0.00 32.23 32.68 3d4g h LYS 84 CO 0.50 0.80 0.29 0.00 -3.45 0.00 0.00 179.45 177.59 3d4g h ALA 85 N 1.25 0.77 -0.30 5.00 0.00 -2.00 0.22 119.26 124.20 3d4g h ALA 85 Ca 0.29 0.03 -0.17 0.00 0.00 0.00 0.00 54.91 55.06 3d4g h ALA 85 Cb -0.01 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 3d4g h ALA 85 CO -0.05 -0.06 -0.49 0.35 0.00 0.00 0.00 179.25 178.99 3d4g h PHE 86 N 0.55 1.03 -0.04 0.00 3.57 -1.90 -3.12 116.94 117.03 3d4g h PHE 86 Ca 0.27 -0.35 -0.05 0.00 3.53 0.00 0.00 57.97 61.37 3d4g h PHE 86 Cb 0.20 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 3d4g h PHE 86 CO -0.11 1.16 -0.20 1.96 -2.23 0.00 0.00 178.31 178.89 3d4g h GLN 87 N 0.66 0.07 -0.30 1.11 4.20 -0.63 -2.08 115.11 118.14 3d4g h GLN 87 Ca 0.03 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.68 3d4g h GLN 87 Cb 1.09 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.84 3d4g h GLN 87 CO 0.11 0.27 -0.02 -0.44 -0.67 0.00 0.00 178.83 178.08 3d4g h ASP 88 N 0.06 0.43 0.23 1.46 3.32 -0.54 -3.10 116.42 118.28 3d4g h ASP 88 Ca 0.01 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 56.95 3d4g h ASP 88 Cb 0.40 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.83 3d4g h ASP 88 CO 0.03 0.51 -0.14 0.11 -1.72 0.00 0.00 179.24 178.02 3d4g h LYS 89 N 0.44 0.00 -6.22 3.56 1.57 -1.35 -3.44 116.57 111.14 3d4g h LYS 89 Ca 0.09 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.33 3d4g h LYS 89 Cb 0.32 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.56 3d4g h LYS 89 CO 0.01 0.14 -0.57 -0.51 -0.57 0.00 0.00 179.45 177.95 3d4g s LEU 90 N -8.04 3.65 0.29 2.94 1.43 -1.17 -1.06 118.68 116.72 3d4g s LEU 90 Ca -0.04 -0.30 -0.29 0.00 -1.03 0.00 0.00 54.13 52.48 3d4g s LEU 90 Cb 0.15 -2.22 -0.10 0.00 0.03 0.00 0.00 46.19 44.05 3d4g s LEU 90 CO 0.64 0.02 1.27 -0.31 0.23 0.00 0.00 176.35 178.19 3d4g s TYR 91 N -2.00 3.20 0.36 0.29 2.02 -0.84 -4.90 117.35 115.49 3d4g s TYR 91 Ca 0.31 1.42 0.08 0.00 -0.37 0.00 0.00 57.07 58.52 3d4g s TYR 91 Cb -0.08 -3.59 0.81 0.00 -0.40 0.00 0.00 41.96 38.70 3d4g s TYR 91 CO 0.23 -1.62 1.89 -1.35 -1.57 0.00 0.00 175.55 173.13 3d4g h PRO 92 N 3.96 0.68 -0.63 -1.71 0.11 -1.94 -1.92 132.00 130.56 3d4g h PRO 92 Ca -0.47 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 3d4g h PRO 92 Cb 1.22 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.15 3d4g h PRO 92 CO 0.69 0.45 0.35 0.35 -0.21 0.00 0.00 178.00 179.63 3d4g h PHE 93 N 0.70 0.84 -0.18 0.65 3.57 -1.99 -1.06 116.94 119.47 3d4g h PHE 93 Ca 0.42 -0.01 -0.21 0.00 3.53 0.00 0.00 57.97 61.70 3d4g h PHE 93 Cb 0.64 -0.27 0.01 0.00 2.79 0.00 0.00 35.95 39.11 3d4g h PHE 93 CO -0.00 0.58 -0.72 1.79 -2.23 0.00 0.00 178.31 177.72 3d4g h THR 94 N 0.87 1.28 -0.68 4.41 1.35 -1.74 -2.73 112.91 115.67 3d4g h THR 94 Ca 0.22 -1.93 -0.03 0.00 -0.55 0.00 0.00 66.41 64.12 3d4g h THR 94 Cb 0.00 1.91 -0.03 0.00 -1.73 0.00 0.00 68.15 68.30 3d4g h THR 94 CO -0.04 0.61 0.30 -0.50 -0.25 0.00 0.00 175.52 175.64 3d4g h TRP 95 N 0.55 1.00 -0.80 4.73 4.06 -1.26 -2.53 115.95 121.71 3d4g h TRP 95 Ca -0.04 -0.06 0.15 0.00 2.06 0.00 0.00 58.89 61.00 3d4g h TRP 95 Cb 1.34 -0.31 -0.10 0.00 -1.00 0.00 0.00 29.16 29.10 3d4g h TRP 95 CO 0.08 0.77 0.37 -0.44 -3.56 0.00 0.00 178.44 175.66 3d4g h ASP 96 N 0.95 0.40 0.09 -3.49 3.32 -1.14 -2.37 116.42 114.19 3d4g h ASP 96 Ca 0.23 0.10 -0.03 0.00 0.02 0.00 0.00 57.03 57.35 3d4g h ASP 96 Cb 0.16 0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 3d4g h ASP 96 CO -0.02 0.16 -0.12 0.00 -1.72 0.00 0.00 179.24 177.54 3d4g h ALA 97 N 1.56 1.71 -0.79 3.45 0.00 -1.13 -2.64 119.26 121.41 3d4g h ALA 97 Ca 0.44 -0.14 -0.37 0.00 0.00 0.00 0.00 54.91 54.84 3d4g h ALA 97 Cb 0.66 -0.04 -0.22 0.00 0.00 0.00 0.00 17.79 18.18 3d4g h ALA 97 CO -0.39 0.22 0.41 1.33 0.00 0.00 0.00 179.25 180.82 3d4g n VAL 98 N -4.36 2.99 -4.33 0.00 0.24 -0.90 -4.88 118.33 107.10 3d4g n VAL 98 Ca -0.02 -2.04 -0.34 0.00 -2.04 0.00 0.00 64.34 59.90 3d4g n VAL 98 Cb 0.21 -0.41 -0.14 0.00 -1.47 0.00 0.00 33.84 32.03 3d4g n VAL 98 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3d4g s ARG 99 N -3.22 3.38 -0.05 7.34 3.52 -1.00 -1.41 118.95 127.52 3d4g s ARG 99 Ca 0.54 -0.65 -0.00 0.00 -0.13 0.00 0.00 55.73 55.48 3d4g s ARG 99 Cb 0.45 -2.81 0.03 0.00 -1.56 0.00 0.00 34.95 31.06 3d4g s ARG 99 CO 0.09 0.02 -0.01 -0.47 -0.81 0.00 0.00 175.30 174.12 3d4g s TYR 100 N 0.89 0.54 -1.45 5.12 5.04 0.41 -4.87 117.35 123.02 3d4g s TYR 100 Ca -0.02 -0.10 -0.01 0.00 -2.44 0.00 0.00 57.07 54.51 3d4g s TYR 100 Cb -0.15 -0.62 0.00 0.00 0.35 0.00 0.00 41.96 41.54 3d4g s TYR 100 CO 0.00 -0.22 0.29 0.09 -1.34 0.00 0.00 175.55 174.37 3d4g n ASN 101 N 4.54 0.03 -0.02 4.32 3.02 -1.26 -1.59 115.26 124.29 3d4g n ASN 101 Ca -0.18 -1.10 -0.00 0.00 -0.03 0.00 0.00 54.58 53.27 3d4g n ASN 101 Cb 0.50 -2.58 -0.00 0.00 -0.61 0.00 0.00 39.78 37.10 3d4g n ASN 101 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3d4g n GLY 102 N -2.18 0.35 3.29 7.41 0.00 -1.26 -5.01 105.19 107.80 3d4g n GLY 102 Ca -0.31 -0.03 -0.26 0.00 0.00 0.00 0.00 46.02 45.42 3d4g n GLY 102 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d4g s LYS 103 N -0.76 1.35 -0.17 1.61 1.02 -0.62 -5.11 119.74 117.05 3d4g s LYS 103 Ca 0.00 -1.08 -0.27 0.00 0.02 0.00 0.00 55.97 54.64 3d4g s LYS 103 Cb 0.00 -1.57 -0.01 0.00 -0.52 0.00 0.00 37.83 35.73 3d4g s LYS 103 CO 0.00 0.39 0.90 -0.51 -0.92 0.00 0.00 175.35 175.21 3d4g s LEU 104 N -1.53 4.17 0.00 3.17 1.43 -1.26 -0.45 118.68 124.20 3d4g s LEU 104 Ca 0.08 1.27 0.03 0.00 -1.03 0.00 0.00 54.13 54.48 3d4g s LEU 104 Cb -0.09 -3.35 0.05 0.00 0.03 0.00 0.00 46.19 42.83 3d4g s LEU 104 CO 0.03 -0.46 0.82 2.30 0.23 0.00 0.00 176.35 179.27 3d4g n ILE 105 N 4.84 0.48 -3.53 -0.59 -5.35 -0.50 -2.21 119.36 112.50 3d4g n ILE 105 Ca 0.07 -0.74 -0.09 0.00 -0.27 0.00 0.00 62.75 61.72 3d4g n ILE 105 Cb 0.48 0.79 -0.03 0.00 -1.74 0.00 0.00 39.64 39.15 3d4g n ILE 105 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3d4g s ALA 106 N -0.61 -1.87 -0.14 -1.28 0.00 -1.25 -4.56 121.76 112.04 3d4g s ALA 106 Ca 0.05 1.22 -0.22 0.00 0.00 0.00 0.00 51.96 53.00 3d4g s ALA 106 Cb 0.03 0.09 -0.03 0.00 0.00 0.00 0.00 23.12 23.21 3d4g s ALA 106 CO 0.04 -0.58 0.67 0.71 0.00 0.00 0.00 175.76 176.60 3d4g s TYR 107 N -2.54 3.46 0.23 0.00 2.02 0.26 -4.84 117.35 115.94 3d4g s TYR 107 Ca 0.04 1.08 -0.30 0.00 -0.37 0.00 0.00 57.07 57.52 3d4g s TYR 107 Cb -0.01 -2.81 -0.09 0.00 -0.40 0.00 0.00 41.96 38.65 3d4g s TYR 107 CO -0.06 -0.07 1.00 -1.25 -1.57 0.00 0.00 175.55 173.60 3d4g s PRO 108 N 1.47 4.76 -0.07 -1.71 0.04 -1.26 -0.26 135.00 137.97 3d4g s PRO 108 Ca 0.33 1.59 -0.07 0.00 0.04 0.00 0.00 61.00 62.88 3d4g s PRO 108 Cb -0.16 -3.27 -0.04 0.00 0.04 0.00 0.00 34.50 31.07 3d4g s PRO 108 CO 0.13 0.36 -0.16 -0.89 0.04 0.00 0.00 177.00 176.48 3d4g n ILE 109 N 1.68 1.04 -3.58 0.56 2.08 0.14 -4.74 119.36 116.54 3d4g n ILE 109 Ca -0.01 0.07 -0.16 0.00 0.56 0.00 0.00 62.75 63.21 3d4g n ILE 109 Cb 0.47 -1.81 -0.06 0.00 -0.75 0.00 0.00 39.64 37.48 3d4g n ILE 109 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3d4g s ALA 110 N -2.33 -1.45 -0.14 -1.39 0.00 -1.16 -0.38 121.76 114.91 3d4g s ALA 110 Ca -0.15 0.93 -0.20 0.00 0.00 0.00 0.00 51.96 52.53 3d4g s ALA 110 Cb 0.04 0.11 -0.04 0.00 0.00 0.00 0.00 23.12 23.24 3d4g s ALA 110 CO 0.21 -0.38 0.56 0.08 0.00 0.00 0.00 175.76 176.23 3d4g s VAL 111 N -1.53 5.11 0.04 0.00 1.01 0.17 -0.59 120.40 124.61 3d4g s VAL 111 Ca -0.10 1.10 0.07 0.00 0.00 0.00 0.00 61.98 63.04 3d4g s VAL 111 Cb -0.01 -3.89 -0.03 0.00 0.00 0.00 0.00 36.38 32.44 3d4g s VAL 111 CO 0.06 0.24 -0.18 -1.61 0.00 0.00 0.00 175.10 173.61 3d4g s GLU 112 N 1.10 2.06 -0.16 2.72 2.02 0.17 -1.87 118.70 124.76 3d4g s GLU 112 Ca 0.28 -0.99 -0.27 0.00 0.02 0.00 0.00 54.97 54.02 3d4g s GLU 112 Cb -0.16 -2.19 0.07 0.00 0.10 0.00 0.00 34.13 31.95 3d4g s GLU 112 CO 0.12 0.54 0.68 0.00 0.02 0.00 0.00 175.26 176.62 3d4g s ALA 113 N -0.93 -1.73 0.52 5.21 0.00 -1.26 -1.86 121.76 121.71 3d4g s ALA 113 Ca 0.15 1.62 -0.20 0.00 0.00 0.00 0.00 51.96 53.53 3d4g s ALA 113 Cb -0.10 -0.57 -0.07 0.00 0.00 0.00 0.00 23.12 22.37 3d4g s ALA 113 CO 0.05 -0.35 1.08 -0.51 0.00 0.00 0.00 175.76 176.04 3d4g s LEU 114 N -0.41 3.79 0.14 0.00 1.43 -1.26 -4.53 118.68 117.82 3d4g s LEU 114 Ca -0.06 2.05 0.01 0.00 -1.03 0.00 0.00 54.13 55.10 3d4g s LEU 114 Cb -0.03 -4.57 -0.04 0.00 0.03 0.00 0.00 46.19 41.58 3d4g s LEU 114 CO 0.05 -1.01 0.01 -0.44 0.23 0.00 0.00 176.35 175.19 3d4g s SER 115 N -1.90 0.83 -0.19 2.29 0.01 -0.45 -4.77 113.70 109.52 3d4g s SER 115 Ca 0.70 -1.15 -0.29 0.00 1.31 0.00 0.00 55.95 56.52 3d4g s SER 115 Cb -0.20 0.18 -0.01 0.00 0.21 0.00 0.00 66.02 66.21 3d4g s SER 115 CO 0.24 -0.61 1.18 -0.22 0.41 0.00 0.00 173.24 174.23 3d4g s LEU 116 N -3.09 4.16 -0.14 2.44 2.96 -0.74 -2.47 118.68 121.80 3d4g s LEU 116 Ca 0.21 1.58 -0.04 0.00 -0.22 0.00 0.00 54.13 55.65 3d4g s LEU 116 Cb 0.07 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.18 3d4g s LEU 116 CO 0.01 -0.72 0.01 -0.63 -1.32 0.00 0.00 176.35 173.70 3d4g s ILE 117 N 3.34 4.39 0.00 6.68 1.01 0.09 -0.31 121.20 136.40 3d4g s ILE 117 Ca 0.51 -0.19 -0.01 0.00 0.00 0.00 0.00 60.65 60.95 3d4g s ILE 117 Cb -0.19 -2.91 -0.01 0.00 0.01 0.00 0.00 42.46 39.36 3d4g s ILE 117 CO 0.12 0.53 0.02 -0.72 0.00 0.00 0.00 174.94 174.88 3d4g s TYR 118 N -0.16 0.09 -0.34 3.97 1.13 -0.41 -0.40 117.35 121.22 3d4g s TYR 118 Ca 0.05 -0.18 -0.29 0.00 -1.41 0.00 0.00 57.07 55.24 3d4g s TYR 118 Cb -0.12 -0.07 0.01 0.00 -1.10 0.00 0.00 41.96 40.67 3d4g s TYR 118 CO 0.02 -0.11 1.17 1.21 -2.51 0.00 0.00 175.55 175.33 3d4g s ASN 119 N -0.70 6.77 0.38 -0.18 3.84 0.43 -1.03 114.94 124.46 3d4g s ASN 119 Ca -0.08 0.99 0.12 0.00 0.21 0.00 0.00 52.86 54.10 3d4g s ASN 119 Cb -0.05 -2.54 0.76 0.00 -0.55 0.00 0.00 41.25 38.86 3d4g s ASN 119 CO -0.00 -1.03 1.86 0.11 -2.79 0.00 0.00 177.10 175.25 3d4g h LYS 120 N 8.77 0.07 -0.04 0.43 1.57 -0.71 0.61 116.57 127.27 3d4g h LYS 120 Ca -0.23 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.46 3d4g h LYS 120 Cb 1.07 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.38 3d4g h LYS 120 CO 1.05 0.36 -0.22 -0.44 -0.57 0.00 0.00 179.45 179.64 3d4g h ASP 121 N 0.07 0.27 0.64 0.86 3.32 -1.92 -2.51 116.42 117.14 3d4g h ASP 121 Ca 0.01 -0.66 -0.11 0.00 0.02 0.00 0.00 57.03 56.28 3d4g h ASP 121 Cb 0.56 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.01 3d4g h ASP 121 CO 0.04 0.89 -0.54 -0.07 -1.72 0.00 0.00 179.24 177.84 3d4g h LEU 122 N -0.34 0.00 -6.05 1.55 3.38 -1.90 -3.41 115.31 108.54 3d4g h LEU 122 Ca -0.02 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.62 3d4g h LEU 122 Cb 0.88 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 41.35 3d4g h LEU 122 CO 0.05 0.54 -0.67 -0.22 0.09 0.00 0.00 178.44 178.22 3d4g s LEU 123 N -7.55 -0.24 0.29 1.67 2.96 0.20 -5.01 118.68 111.00 3d4g s LEU 123 Ca -0.01 -1.80 0.04 0.00 -0.22 0.00 0.00 54.13 52.14 3d4g s LEU 123 Cb 0.12 0.81 0.45 0.00 0.50 0.00 0.00 46.19 48.07 3d4g s LEU 123 CO 0.74 -0.19 1.73 -0.65 -1.32 0.00 0.00 176.35 176.66 3d4g h PRO 124 N 6.37 0.40 -4.43 0.98 0.11 -1.64 -3.37 132.00 130.42 3d4g h PRO 124 Ca 0.09 -0.16 -0.70 0.00 0.11 0.00 0.00 66.00 65.35 3d4g h PRO 124 Cb 1.05 -0.02 -0.33 0.00 0.11 0.00 0.00 31.00 31.81 3d4g h PRO 124 CO 0.18 0.65 -0.50 -0.80 -0.21 0.00 0.00 178.00 177.32 3d4g s ASN 125 N -6.84 5.39 0.46 -2.05 -0.87 -1.26 -4.98 114.94 104.79 3d4g s ASN 125 Ca -0.06 -1.98 -0.22 0.00 -1.57 0.00 0.00 52.86 49.02 3d4g s ASN 125 Cb 0.14 -1.88 -0.08 0.00 -0.02 0.00 0.00 41.25 39.40 3d4g s ASN 125 CO 0.78 -0.59 1.08 -2.16 -2.57 0.00 0.00 177.10 173.65 3d4g s PRO 126 N 1.21 3.86 0.27 -0.60 0.04 -1.26 -4.97 135.00 133.55 3d4g s PRO 126 Ca 0.07 1.55 -0.29 0.00 0.04 0.00 0.00 61.00 62.37 3d4g s PRO 126 Cb -0.24 -2.31 -0.10 0.00 0.04 0.00 0.00 34.50 31.89 3d4g s PRO 126 CO -0.03 -0.41 1.27 -1.25 0.04 0.00 0.00 177.00 176.62 3d4g s PRO 127 N -2.85 4.42 0.26 0.56 0.04 -1.26 -4.93 135.00 131.24 3d4g s PRO 127 Ca 0.64 2.08 0.24 0.00 0.04 0.00 0.00 61.00 64.00 3d4g s PRO 127 Cb -0.22 -3.14 0.41 0.00 0.04 0.00 0.00 34.50 31.59 3d4g s PRO 127 CO 0.27 -0.14 1.49 0.87 0.04 0.00 0.00 177.00 179.53 3d4g h LYS 128 N 4.24 0.00 -5.85 4.56 1.79 -1.95 -3.42 116.57 115.93 3d4g h LYS 128 Ca -0.47 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 57.49 3d4g h LYS 128 Cb 1.22 0.00 -0.23 0.00 -1.58 0.00 0.00 32.23 31.64 3d4g h LYS 128 CO 0.70 0.00 -0.81 0.95 -1.08 0.00 0.00 179.45 179.21 3d4g s THR 129 N -3.20 1.49 0.31 -0.16 -4.23 -1.26 -0.28 115.64 108.32 3d4g s THR 129 Ca 0.07 -1.36 0.02 0.00 -1.18 0.00 0.00 61.69 59.24 3d4g s THR 129 Cb 0.10 -1.36 0.15 0.00 1.34 0.00 0.00 72.50 72.73 3d4g s THR 129 CO 0.68 -0.04 1.85 -0.50 -0.54 0.00 0.00 174.62 176.07 3d4g h TRP 130 N 4.38 0.65 0.00 3.99 4.06 -0.77 -3.02 115.95 125.24 3d4g h TRP 130 Ca -0.43 -0.07 -0.01 0.00 2.06 0.00 0.00 58.89 60.44 3d4g h TRP 130 Cb 1.18 -0.19 -0.00 0.00 -1.00 0.00 0.00 29.16 29.15 3d4g h TRP 130 CO 0.59 0.60 -0.07 0.93 -3.56 0.00 0.00 178.44 176.93 3d4g h GLU 131 N 0.60 0.00 -0.16 0.49 3.07 -1.97 -2.05 114.58 114.56 3d4g h GLU 131 Ca 0.13 0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 58.92 3d4g h GLU 131 Cb 0.33 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.23 3d4g h GLU 131 CO 0.01 0.07 -0.20 0.93 -1.40 0.00 0.00 179.01 178.42 3d4g h GLU 132 N 0.00 0.28 -0.68 2.33 5.08 -1.92 -3.39 114.58 116.27 3d4g h GLU 132 Ca -0.00 -0.08 0.03 0.00 -1.00 0.00 0.00 59.36 58.31 3d4g h GLU 132 Cb 0.20 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.38 3d4g h GLU 132 CO 0.01 0.47 0.43 0.82 -1.00 0.00 0.00 179.01 179.73 3d4g h ILE 133 N 0.25 1.09 -0.72 3.13 2.04 -1.53 -1.96 117.51 119.81 3d4g h ILE 133 Ca 0.05 -0.29 0.05 0.00 1.00 0.00 0.00 64.86 65.67 3d4g h ILE 133 Cb 0.50 0.18 -0.04 0.00 -0.74 0.00 0.00 36.82 36.72 3d4g h ILE 133 CO 0.03 0.15 0.47 -0.65 0.00 0.00 0.00 178.15 178.16 3d4g h PRO 134 N 0.83 0.80 -0.22 2.37 0.11 -1.78 0.52 132.00 134.63 3d4g h PRO 134 Ca 0.28 -0.05 -0.18 0.00 0.11 0.00 0.00 66.00 66.15 3d4g h PRO 134 Cb 0.02 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 30.96 3d4g h PRO 134 CO -0.11 0.53 -0.58 0.00 -0.21 0.00 0.00 178.00 177.63 3d4g h ALA 135 N 1.59 0.37 -0.43 -0.75 0.00 -1.68 -2.78 119.26 115.58 3d4g h ALA 135 Ca 0.30 -0.53 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 3d4g h ALA 135 Cb 0.13 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3d4g h ALA 135 CO -0.09 0.61 -0.05 1.25 0.00 0.00 0.00 179.25 180.97 3d4g h LEU 136 N 0.53 0.70 -0.71 0.00 5.85 -0.64 -2.77 115.31 118.27 3d4g h LEU 136 Ca -0.01 -0.18 -0.05 0.00 0.84 0.00 0.00 57.88 58.48 3d4g h LEU 136 Cb 1.20 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 42.01 3d4g h LEU 136 CO 0.13 0.80 0.26 -0.78 -0.34 0.00 0.00 178.44 178.51 3d4g h ASP 137 N 0.67 1.01 -0.53 1.25 3.58 -0.01 -2.65 116.42 119.75 3d4g h ASP 137 Ca 0.13 -0.19 0.04 0.00 0.42 0.00 0.00 57.03 57.43 3d4g h ASP 137 Cb 0.49 -0.26 -0.04 0.00 1.72 0.00 0.00 39.33 41.23 3d4g h ASP 137 CO 0.03 0.92 0.28 0.50 -2.88 0.00 0.00 179.24 178.09 3d4g h LYS 138 N 1.03 0.53 -0.11 0.28 3.64 -1.21 0.25 116.57 120.97 3d4g h LYS 138 Ca 0.23 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.58 3d4g h LYS 138 Cb 0.25 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 3d4g h LYS 138 CO -0.01 0.35 0.07 0.93 -2.27 0.00 0.00 179.45 178.52 3d4g h GLU 139 N 0.54 0.15 -0.22 1.90 5.08 -1.44 -2.78 114.58 117.81 3d4g h GLU 139 Ca 0.23 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.49 3d4g h GLU 139 Cb 0.12 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 3d4g h GLU 139 CO -0.15 0.13 -0.25 -0.07 -1.00 0.00 0.00 179.01 177.67 3d4g h LEU 140 N 0.13 0.42 -1.20 1.33 3.38 -1.08 -2.60 115.31 115.69 3d4g h LEU 140 Ca 0.04 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 3d4g h LEU 140 Cb 0.01 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 3d4g h LEU 140 CO -0.01 0.67 0.39 0.11 0.09 0.00 0.00 178.44 179.69 3d4g h LYS 141 N 0.37 0.93 -0.25 1.13 1.79 0.02 0.23 116.57 120.80 3d4g h LYS 141 Ca 0.06 -0.09 0.01 0.00 -2.18 0.00 0.00 60.65 58.45 3d4g h LYS 141 Cb 0.64 -0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 31.09 3d4g h LYS 141 CO 0.05 0.67 0.16 0.00 -1.08 0.00 0.00 179.45 179.26 3d4g h ALA 142 N 1.48 1.89 -0.77 3.86 0.00 -1.18 -2.34 119.26 122.20 3d4g h ALA 142 Ca 0.24 -0.01 -0.51 0.00 0.00 0.00 0.00 54.91 54.63 3d4g h ALA 142 Cb 0.00 -0.08 -0.30 0.00 0.00 0.00 0.00 17.79 17.41 3d4g h ALA 142 CO -0.04 0.09 0.06 0.36 0.00 0.00 0.00 179.25 179.72 3d4g n LYS 143 N -4.50 2.78 -2.59 0.00 2.85 -0.93 -4.96 118.16 110.81 3d4g n LYS 143 Ca 0.01 -3.55 -0.15 0.00 -1.05 0.00 0.00 58.31 53.57 3d4g n LYS 143 Cb 0.12 -2.17 0.01 0.00 -0.65 0.00 0.00 35.03 32.34 3d4g n LYS 143 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3d4g n GLY 144 N -0.91 -0.20 3.30 2.58 0.00 -0.88 -5.01 105.19 104.07 3d4g n GLY 144 Ca 0.50 -0.19 -0.17 0.00 0.00 0.00 0.00 46.02 46.16 3d4g n GLY 144 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d4g s LYS 145 N -5.11 1.46 0.28 1.61 -0.14 0.75 -4.99 119.74 113.62 3d4g s LYS 145 Ca 0.13 -1.81 0.11 0.00 -1.36 0.00 0.00 55.97 53.04 3d4g s LYS 145 Cb -0.06 -0.08 -0.05 0.00 -1.68 0.00 0.00 37.83 35.96 3d4g s LYS 145 CO 0.16 -0.39 -0.18 -1.54 -0.76 0.00 0.00 175.35 172.64 3d4g s SER 146 N -3.31 3.53 -0.13 2.83 1.04 -1.02 -2.13 113.70 114.51 3d4g s SER 146 Ca 0.37 -1.05 -0.19 0.00 0.48 0.00 0.00 55.95 55.56 3d4g s SER 146 Cb 0.06 -0.29 -0.17 0.00 0.10 0.00 0.00 66.02 65.72 3d4g s SER 146 CO 0.15 -0.01 0.48 0.00 0.98 0.00 0.00 173.24 174.84 3d4g h ALA 147 N 2.26 0.01 -3.65 5.32 0.00 -1.86 -0.25 119.26 121.09 3d4g h ALA 147 Ca -0.40 -0.36 -0.25 0.00 0.00 0.00 0.00 54.91 53.90 3d4g h ALA 147 Cb 1.26 0.03 -0.30 0.00 0.00 0.00 0.00 17.79 18.78 3d4g h ALA 147 CO 0.62 0.03 -0.72 -1.17 0.00 0.00 0.00 179.25 178.01 3d4g s LEU 148 N -8.32 1.67 -0.03 0.00 2.96 -1.26 -0.71 118.68 112.99 3d4g s LEU 148 Ca -0.13 0.03 -0.01 0.00 -0.22 0.00 0.00 54.13 53.80 3d4g s LEU 148 Cb -0.02 -0.00 0.03 0.00 0.50 0.00 0.00 46.19 46.70 3d4g s LEU 148 CO 0.45 -0.04 0.05 -0.04 -1.32 0.00 0.00 176.35 175.44 3d4g s MET 149 N 0.36 -0.03 0.28 1.98 -1.94 -0.65 -4.79 119.30 114.52 3d4g s MET 149 Ca -0.03 0.23 -0.13 0.00 -1.71 0.00 0.00 55.69 54.05 3d4g s MET 149 Cb -0.04 -0.26 0.01 0.00 2.01 0.00 0.00 34.83 36.55 3d4g s MET 149 CO -0.01 -0.18 0.56 -0.59 -0.01 0.00 0.00 175.02 174.79 3d4g s PHE 150 N 1.18 0.33 -0.30 -0.03 -0.71 -1.26 -4.04 117.98 113.15 3d4g s PHE 150 Ca -0.08 -0.73 -0.28 0.00 -1.04 0.00 0.00 56.93 54.80 3d4g s PHE 150 Cb -0.13 0.32 -0.02 0.00 -1.21 0.00 0.00 43.02 41.98 3d4g s PHE 150 CO -0.03 -1.13 1.86 1.21 -1.34 0.00 0.00 175.22 175.79 3d4g s ASN 151 N -3.04 5.84 0.00 1.98 2.47 -1.26 -4.60 114.94 116.33 3d4g s ASN 151 Ca 0.21 1.42 0.25 0.00 0.42 0.00 0.00 52.86 55.15 3d4g s ASN 151 Cb -0.02 -2.52 0.40 0.00 -1.45 0.00 0.00 41.25 37.65 3d4g s ASN 151 CO 0.10 -1.73 1.38 0.18 -3.72 0.00 0.00 177.10 173.31 3d4g n LEU 152 N 10.44 2.66 0.09 3.21 4.77 -0.76 -4.27 117.00 133.15 3d4g n LEU 152 Ca 0.24 -0.90 0.12 0.00 -0.03 0.00 0.00 56.01 55.43 3d4g n LEU 152 Cb 0.46 -0.01 0.03 0.00 -2.33 0.00 0.00 43.42 41.58 3d4g n LEU 152 CO 0.68 0.45 0.08 0.00 -1.33 0.00 0.00 177.39 177.27 3d4g n GLN 153 N 1.08 0.52 -4.44 3.23 1.13 -1.25 -4.76 117.38 112.89 3d4g n GLN 153 Ca 0.15 0.10 -0.33 0.00 -1.94 0.00 0.00 57.00 54.99 3d4g n GLN 153 Cb 0.54 -1.78 -0.16 0.00 0.11 0.00 0.00 30.24 28.95 3d4g n GLN 153 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 3d4g s GLU 154 N -3.32 3.10 0.60 -1.09 0.41 -1.26 -4.98 118.70 112.18 3d4g s GLU 154 Ca 0.01 -0.80 0.32 0.00 -0.41 0.00 0.00 54.97 54.09 3d4g s GLU 154 Cb 0.11 -2.57 1.90 0.00 -1.78 0.00 0.00 34.13 31.79 3d4g s GLU 154 CO 0.78 -0.06 2.25 -1.00 -0.49 0.00 0.00 175.26 176.74 3d4g h PRO 155 N 7.52 0.00 -1.06 0.39 0.13 -1.89 -2.08 132.00 135.00 3d4g h PRO 155 Ca -0.36 0.00 0.30 0.00 -0.87 0.00 0.00 66.00 65.07 3d4g h PRO 155 Cb 1.18 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.19 3d4g h PRO 155 CO 0.58 0.00 0.65 -0.92 -0.23 0.00 0.00 178.00 178.09 3d4g h TYR 156 N 0.00 0.79 0.02 1.56 3.20 -1.95 0.92 116.97 121.51 3d4g h TYR 156 Ca 0.01 0.03 -0.27 0.00 3.14 0.00 0.00 58.73 61.64 3d4g h TYR 156 Cb 0.07 -0.22 -0.04 0.00 1.54 0.00 0.00 36.73 38.08 3d4g h TYR 156 CO 0.00 -0.03 -1.44 0.74 -1.64 0.00 0.00 178.16 175.79 3d4g h PHE 157 N 0.38 0.07 0.00 -3.82 -1.00 -1.63 -3.35 116.94 107.59 3d4g h PHE 157 Ca 0.67 -0.05 -0.11 0.00 2.81 0.00 0.00 57.97 61.30 3d4g h PHE 157 Cb 1.63 -0.00 -0.02 0.00 3.61 0.00 0.00 35.95 41.17 3d4g h PHE 157 CO -0.01 1.06 -1.12 1.79 -1.61 0.00 0.00 178.31 178.42 3d4g h THR 158 N 0.01 0.38 -0.84 -1.55 1.35 -1.53 -3.39 112.91 107.35 3d4g h THR 158 Ca -0.18 -1.71 0.14 0.00 -0.55 0.00 0.00 66.41 64.11 3d4g h THR 158 Cb 1.93 1.93 -0.09 0.00 -1.73 0.00 0.00 68.15 70.19 3d4g h THR 158 CO 0.11 0.22 0.43 -0.25 -0.25 0.00 0.00 175.52 175.77 3d4g h TRP 159 N 0.00 0.75 -0.90 4.73 2.91 -0.97 -1.97 115.95 120.49 3d4g h TRP 159 Ca -0.09 0.03 0.14 0.00 1.13 0.00 0.00 58.89 60.11 3d4g h TRP 159 Cb 1.37 -0.21 -0.07 0.00 -0.51 0.00 0.00 29.16 29.75 3d4g h TRP 159 CO 0.00 0.18 0.58 -1.35 -1.03 0.00 0.00 178.44 176.82 3d4g h PRO 160 N 0.62 0.70 -0.18 2.65 0.11 -1.77 0.43 132.00 134.55 3d4g h PRO 160 Ca 0.45 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 66.41 3d4g h PRO 160 Cb 0.63 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.58 3d4g h PRO 160 CO -0.36 0.46 -0.32 1.25 -0.21 0.00 0.00 178.00 178.82 3d4g h LEU 161 N 0.72 0.60 -0.72 2.35 5.85 -1.66 -1.68 115.31 120.76 3d4g h LEU 161 Ca 0.46 -0.54 -0.02 0.00 0.84 0.00 0.00 57.88 58.61 3d4g h LEU 161 Cb 0.71 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.53 3d4g h LEU 161 CO -0.22 1.02 0.36 0.40 -0.34 0.00 0.00 178.44 179.67 3d4g h ILE 162 N 0.19 1.23 0.00 4.05 2.04 -0.79 -2.84 117.51 121.40 3d4g h ILE 162 Ca 0.01 -0.63 -0.08 0.00 1.00 0.00 0.00 64.86 65.16 3d4g h ILE 162 Cb 0.91 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 3d4g h ILE 162 CO 0.07 0.27 -0.36 0.00 0.00 0.00 0.00 178.15 178.13 3d4g h ALA 163 N 1.18 1.04 -0.58 1.87 0.00 -0.28 -3.06 119.26 119.44 3d4g h ALA 163 Ca 0.25 -0.33 0.12 0.00 0.00 0.00 0.00 54.91 54.95 3d4g h ALA 163 Cb 0.09 -0.06 -0.11 0.00 0.00 0.00 0.00 17.79 17.72 3d4g h ALA 163 CO -0.03 0.45 -0.10 0.00 0.00 0.00 0.00 179.25 179.57 3d4g h ALA 164 N 1.64 0.44 -0.59 0.00 0.00 -1.22 -1.19 119.26 118.35 3d4g h ALA 164 Ca -0.00 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3d4g h ALA 164 Cb 0.85 0.40 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3d4g h ALA 164 CO 0.05 -0.42 0.00 -3.47 0.00 0.00 0.00 179.25 175.40 3d4g n ASP 165 N -5.36 4.04 0.00 0.00 2.03 -1.26 -4.71 116.55 111.29 3d4g n ASP 165 Ca 0.07 -2.30 0.00 0.00 0.52 0.00 0.00 54.79 53.08 3d4g n ASP 165 Cb 0.31 -0.51 0.00 0.00 -0.72 0.00 0.00 41.12 40.20 3d4g n ASP 165 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3d4g n GLY 166 N 1.16 -0.21 3.77 0.27 0.00 -0.47 -3.97 105.19 105.73 3d4g n GLY 166 Ca 0.22 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.86 3d4g n GLY 166 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d4g s GLY 167 N -0.13 2.86 0.20 -0.02 0.00 -1.09 -4.65 107.32 104.50 3d4g s GLY 167 Ca 0.00 1.12 -0.13 0.00 0.00 0.00 0.00 44.72 45.71 3d4g s GLY 167 CO 0.00 1.64 0.43 -2.52 0.00 0.00 0.00 173.10 172.65 3d4g s TYR 168 N -1.38 0.17 0.00 1.90 -0.85 -0.24 -4.46 117.35 112.50 3d4g s TYR 168 Ca 0.62 -0.53 0.00 0.00 -0.52 0.00 0.00 57.07 56.63 3d4g s TYR 168 Cb -0.34 0.19 0.00 0.00 0.38 0.00 0.00 41.96 42.18 3d4g s TYR 168 CO 0.43 -0.86 0.00 0.00 -1.52 0.00 0.00 175.55 173.59 3d4g n ALA 169 N -0.30 0.00 -3.06 9.51 0.00 -1.26 -1.85 120.51 123.54 3d4g n ALA 169 Ca -0.07 -0.05 -0.18 0.00 0.00 0.00 0.00 53.44 53.13 3d4g n ALA 169 Cb 0.62 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.92 3d4g n ALA 169 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3d4g s PHE 170 N -0.71 0.69 -0.03 0.00 0.08 -1.26 -2.79 117.98 113.96 3d4g s PHE 170 Ca 0.00 -0.15 -0.30 0.00 0.12 0.00 0.00 56.93 56.60 3d4g s PHE 170 Cb 0.00 -0.51 -0.05 0.00 -0.57 0.00 0.00 43.02 41.89 3d4g s PHE 170 CO 0.00 -0.08 1.49 0.21 -0.10 0.00 0.00 175.22 176.75 3d4g s LYS 171 N 0.23 4.23 -0.28 0.44 2.20 -0.78 -4.80 119.74 120.99 3d4g s LYS 171 Ca -0.03 2.05 -0.26 0.00 -0.36 0.00 0.00 55.97 57.37 3d4g s LYS 171 Cb -0.07 -3.73 0.00 0.00 -1.51 0.00 0.00 37.83 32.53 3d4g s LYS 171 CO -0.00 -0.70 0.91 -0.47 -0.36 0.00 0.00 175.35 174.73 3d4g s TYR 172 N 3.07 3.25 -0.19 4.03 5.04 -1.26 -0.73 117.35 130.55 3d4g s TYR 172 Ca 0.67 1.11 -0.10 0.00 -2.44 0.00 0.00 57.07 56.32 3d4g s TYR 172 Cb -0.32 -3.28 0.07 0.00 0.35 0.00 0.00 41.96 38.77 3d4g s TYR 172 CO 0.27 -0.55 0.46 -2.00 -1.34 0.00 0.00 175.55 172.39 3d4g s GLU 173 N 3.12 0.43 -1.30 4.97 2.12 0.11 -4.93 118.70 123.24 3d4g s GLU 173 Ca 0.38 0.89 -0.05 0.00 0.36 0.00 0.00 54.97 56.56 3d4g s GLU 173 Cb -0.14 0.06 0.01 0.00 0.26 0.00 0.00 34.13 34.32 3d4g s GLU 173 CO 0.10 -0.17 1.06 0.09 -0.54 0.00 0.00 175.26 175.81 3d4g n ASN 174 N 4.43 -4.09 -0.40 -1.70 3.02 -1.26 -2.81 115.26 112.45 3d4g n ASN 174 Ca -0.21 -0.61 -0.05 0.00 -0.03 0.00 0.00 54.58 53.68 3d4g n ASN 174 Cb 0.55 -4.94 -0.02 0.00 -0.61 0.00 0.00 39.78 34.76 3d4g n ASN 174 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3d4g n GLY 175 N -1.59 0.75 3.47 7.41 0.00 -1.26 -5.00 105.19 108.97 3d4g n GLY 175 Ca -0.14 -0.38 -0.10 0.00 0.00 0.00 0.00 46.02 45.40 3d4g n GLY 175 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d4g s LYS 176 N -1.98 1.31 0.02 1.61 -2.85 -1.12 -5.15 119.74 111.57 3d4g s LYS 176 Ca 0.00 -0.90 -0.24 0.00 -1.00 0.00 0.00 55.97 53.82 3d4g s LYS 176 Cb 0.00 0.49 -0.05 0.00 -2.06 0.00 0.00 37.83 36.21 3d4g s LYS 176 CO 0.00 -0.54 0.75 0.71 0.10 0.00 0.00 175.35 176.37 3d4g s TYR 177 N -3.88 3.70 -0.47 1.78 2.02 -1.26 0.10 117.35 119.33 3d4g s TYR 177 Ca 0.10 1.41 -0.22 0.00 -0.37 0.00 0.00 57.07 57.99 3d4g s TYR 177 Cb 0.00 -2.81 0.03 0.00 -0.40 0.00 0.00 41.96 38.78 3d4g s TYR 177 CO -0.03 0.23 0.75 0.34 -1.57 0.00 0.00 175.55 175.27 3d4g s ASP 178 N 0.15 6.36 0.06 2.29 2.15 0.09 -4.93 116.67 122.84 3d4g s ASP 178 Ca 0.38 -0.30 0.21 0.00 0.43 0.00 0.00 52.55 53.27 3d4g s ASP 178 Cb -0.20 -2.37 0.87 0.00 -0.30 0.00 0.00 42.92 40.93 3d4g s ASP 178 CO 0.22 -0.93 1.67 2.30 -0.17 0.00 0.00 175.17 178.26 3d4g n ILE 179 N 6.02 0.65 0.34 4.11 -5.35 -1.26 -2.16 119.36 121.71 3d4g n ILE 179 Ca 0.00 0.12 0.11 0.00 -0.27 0.00 0.00 62.75 62.72 3d4g n ILE 179 Cb 0.48 -0.85 -0.09 0.00 -1.74 0.00 0.00 39.64 37.44 3d4g n ILE 179 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 3d4g n LYS 180 N -1.70 0.43 -2.98 6.28 4.76 -1.26 -4.50 118.16 119.20 3d4g n LYS 180 Ca 0.04 -0.07 -0.44 0.00 -2.87 0.00 0.00 58.31 54.97 3d4g n LYS 180 Cb 0.25 -1.57 -0.03 0.00 -1.84 0.00 0.00 35.03 31.85 3d4g n LYS 180 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 3d4g s ASP 181 N -4.18 6.59 -0.18 4.39 -1.08 -0.92 -4.93 116.67 116.37 3d4g s ASP 181 Ca -0.01 -2.01 -0.06 0.00 -0.52 0.00 0.00 52.55 49.95 3d4g s ASP 181 Cb 0.14 -2.37 -0.03 0.00 -1.46 0.00 0.00 42.92 39.19 3d4g s ASP 181 CO 0.86 -1.03 0.01 -0.69 0.52 0.00 0.00 175.17 174.84 3d4g s VAL 182 N 2.48 4.31 -0.66 1.11 1.01 -1.26 -1.86 120.40 125.53 3d4g s VAL 182 Ca 0.29 -0.20 -0.02 0.00 0.00 0.00 0.00 61.98 62.05 3d4g s VAL 182 Cb -0.07 -2.93 0.45 0.00 0.00 0.00 0.00 36.38 33.83 3d4g s VAL 182 CO -0.07 0.47 2.03 0.61 0.00 0.00 0.00 175.10 178.13 3d4g n GLY 183 N 3.65 5.86 0.04 4.51 0.00 -0.77 -4.40 105.19 114.08 3d4g n GLY 183 Ca -0.17 -2.29 0.11 0.00 0.00 0.00 0.00 46.02 43.67 3d4g n GLY 183 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3d4g n VAL 184 N -0.92 0.21 -1.08 1.61 0.24 -1.19 -1.08 118.33 116.13 3d4g n VAL 184 Ca 0.63 -0.27 0.09 0.00 -2.04 0.00 0.00 64.34 62.75 3d4g n VAL 184 Cb 0.68 0.13 0.19 0.00 -1.47 0.00 0.00 33.84 33.38 3d4g n VAL 184 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 3d4g n ASP 185 N -2.02 2.96 -4.95 -1.34 5.75 -1.26 -4.59 116.55 111.09 3d4g n ASP 185 Ca 0.02 -3.12 -0.24 0.00 -0.01 0.00 0.00 54.79 51.44 3d4g n ASP 185 Cb 0.45 -0.49 0.05 0.00 -1.03 0.00 0.00 41.12 40.10 3d4g n ASP 185 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3d4g s ASN 186 N -2.50 5.06 0.34 -1.12 2.20 -1.26 -4.89 114.94 112.77 3d4g s ASN 186 Ca 0.37 0.25 0.06 0.00 -0.94 0.00 0.00 52.86 52.60 3d4g s ASN 186 Cb 0.31 -1.02 0.73 0.00 -2.00 0.00 0.00 41.25 39.28 3d4g s ASN 186 CO 0.05 -1.37 1.88 0.00 -2.94 0.00 0.00 177.10 174.72 3d4g h ALA 187 N -0.27 1.73 -0.47 3.54 0.00 -1.94 -1.47 119.26 120.38 3d4g h ALA 187 Ca -0.43 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.41 3d4g h ALA 187 Cb 1.31 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 3d4g h ALA 187 CO 0.57 0.05 0.01 0.78 0.00 0.00 0.00 179.25 180.66 3d4g h GLY 188 N 0.79 0.89 0.93 0.00 0.00 -1.86 -0.74 103.07 103.07 3d4g h GLY 188 Ca 0.44 -0.65 -0.05 0.00 0.00 0.00 0.00 47.33 47.07 3d4g h GLY 188 CO -0.20 0.60 0.03 0.00 0.00 0.00 0.00 176.54 176.97 3d4g h ALA 189 N 0.93 0.50 -0.76 3.60 0.00 -1.49 -2.17 119.26 119.87 3d4g h ALA 189 Ca 0.14 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 3d4g h ALA 189 Cb 0.49 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 3d4g h ALA 189 CO 0.02 0.24 0.41 0.87 0.00 0.00 0.00 179.25 180.79 3d4g h LYS 190 N 0.47 1.06 -0.42 0.00 1.57 -1.20 -1.41 116.57 116.65 3d4g h LYS 190 Ca 0.11 -0.13 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 3d4g h LYS 190 Cb 0.41 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 3d4g h LYS 190 CO 0.01 0.79 0.14 0.00 -0.57 0.00 0.00 179.45 179.82 3d4g h ALA 191 N 1.21 0.55 -0.15 3.86 0.00 -1.06 -0.08 119.26 123.59 3d4g h ALA 191 Ca 0.27 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 3d4g h ALA 191 Cb 0.04 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3d4g h ALA 191 CO -0.04 0.18 0.08 0.78 0.00 0.00 0.00 179.25 180.26 3d4g h GLY 192 N 0.53 0.22 1.26 0.00 0.00 -1.17 -2.05 103.07 101.87 3d4g h GLY 192 Ca 0.14 -0.10 -0.13 0.00 0.00 0.00 0.00 47.33 47.23 3d4g h GLY 192 CO -0.01 0.09 -0.29 -2.00 0.00 0.00 0.00 176.54 174.34 3d4g h LEU 193 N 0.15 0.86 -0.77 3.11 5.85 -1.22 -2.54 115.31 120.76 3d4g h LEU 193 Ca 0.05 -0.35 0.05 0.00 0.84 0.00 0.00 57.88 58.47 3d4g h LEU 193 Cb 0.06 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 40.80 3d4g h LEU 193 CO -0.01 1.09 0.47 0.74 -0.34 0.00 0.00 178.44 180.40 3d4g h THR 194 N 0.71 1.06 -0.28 1.05 2.02 -0.93 0.18 112.91 116.71 3d4g h THR 194 Ca 0.08 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.96 3d4g h THR 194 Cb 0.84 0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 67.32 3d4g h THR 194 CO 0.07 0.16 0.18 0.15 0.37 0.00 0.00 175.52 176.46 3d4g h PHE 195 N 0.89 0.36 -0.13 3.16 3.57 -1.18 0.95 116.94 124.57 3d4g h PHE 195 Ca 0.32 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.84 3d4g h PHE 195 Cb 0.10 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.70 3d4g h PHE 195 CO -0.04 0.24 0.03 1.25 -2.23 0.00 0.00 178.31 177.55 3d4g h LEU 196 N 0.37 0.01 -1.40 0.59 5.85 -0.99 -1.28 115.31 118.47 3d4g h LEU 196 Ca 0.10 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 3d4g h LEU 196 Cb -0.02 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 3d4g h LEU 196 CO -0.02 0.03 -0.08 0.58 -0.34 0.00 0.00 178.44 178.61 3d4g h VAL 197 N 0.08 1.17 -0.44 1.05 2.07 -0.43 -2.09 116.25 117.66 3d4g h VAL 197 Ca 0.06 -0.72 -0.07 0.00 0.82 0.00 0.00 66.70 66.79 3d4g h VAL 197 Cb 0.05 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 3d4g h VAL 197 CO -0.07 0.23 0.02 0.44 0.02 0.00 0.00 177.57 178.21 3d4g h ASP 198 N 0.29 0.75 -0.97 0.57 3.32 -0.46 0.41 116.42 120.33 3d4g h ASP 198 Ca 0.06 -0.30 0.13 0.00 0.02 0.00 0.00 57.03 56.95 3d4g h ASP 198 Cb 0.33 -0.20 -0.08 0.00 0.22 0.00 0.00 39.33 39.59 3d4g h ASP 198 CO 0.02 0.86 0.61 -0.07 -1.72 0.00 0.00 179.24 178.94 3d4g h LEU 199 N 0.62 0.84 -0.05 1.55 3.38 -0.56 0.36 115.31 121.45 3d4g h LEU 199 Ca 0.13 0.05 -0.06 0.00 0.09 0.00 0.00 57.88 58.09 3d4g h LEU 199 Cb 0.47 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3d4g h LEU 199 CO 0.02 0.43 -0.19 0.40 0.09 0.00 0.00 178.44 179.19 3d4g h ILE 200 N 0.90 1.45 -0.60 1.22 2.04 -1.26 0.27 117.51 121.52 3d4g h ILE 200 Ca 0.49 -1.61 0.12 0.00 1.00 0.00 0.00 64.86 64.86 3d4g h ILE 200 Cb 0.58 2.36 -0.09 0.00 -0.74 0.00 0.00 36.82 38.93 3d4g h ILE 200 CO -0.25 0.45 0.07 0.11 0.00 0.00 0.00 178.15 178.53 3d4g h LYS 201 N -0.32 0.18 -0.21 2.37 1.57 -0.30 -0.51 116.57 119.36 3d4g h LYS 201 Ca -0.01 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3d4g h LYS 201 Cb 0.83 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.09 3d4g h LYS 201 CO 0.04 0.12 0.00 0.09 -0.57 0.00 0.00 179.45 179.13 3d4g n ASN 202 N -5.20 1.14 -2.14 0.86 5.03 0.06 -4.91 115.26 110.10 3d4g n ASN 202 Ca 0.09 -1.98 -0.18 0.00 0.87 0.00 0.00 54.58 53.38 3d4g n ASN 202 Cb 0.34 -0.14 0.00 0.00 -1.02 0.00 0.00 39.78 38.96 3d4g n ASN 202 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3d4g n LYS 203 N 0.12 -2.06 0.13 3.52 5.02 -0.20 -4.87 118.16 119.82 3d4g n LYS 203 Ca 0.08 0.83 0.10 0.00 -2.02 0.00 0.00 58.31 57.30 3d4g n LYS 203 Cb 0.18 -5.33 0.03 0.00 -0.02 0.00 0.00 35.03 29.89 3d4g n LYS 203 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3d4g h HIS 204 N -0.28 0.00 -4.23 2.13 3.86 -0.70 -3.47 115.15 112.46 3d4g h HIS 204 Ca -0.43 0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 58.65 3d4g h HIS 204 Cb 1.31 0.00 -0.15 0.00 1.06 0.00 0.00 27.41 29.63 3d4g h HIS 204 CO 0.46 0.08 -0.68 -1.64 0.86 0.00 0.00 177.93 177.01 3d4g s MET 205 N -3.27 0.65 -0.09 2.45 -1.94 -0.94 -4.67 119.30 111.50 3d4g s MET 205 Ca 0.01 -1.25 0.01 0.00 -1.71 0.00 0.00 55.69 52.75 3d4g s MET 205 Cb 0.08 0.19 -0.02 0.00 2.01 0.00 0.00 34.83 37.09 3d4g s MET 205 CO 0.76 -0.12 -0.10 1.21 -0.01 0.00 0.00 175.02 176.76 3d4g s ASN 206 N -2.94 4.34 0.42 3.03 3.84 -1.26 -4.19 114.94 118.19 3d4g s ASN 206 Ca 0.09 -0.16 0.12 0.00 0.21 0.00 0.00 52.86 53.12 3d4g s ASN 206 Cb 0.08 -1.26 0.92 0.00 -0.55 0.00 0.00 41.25 40.43 3d4g s ASN 206 CO -0.09 0.29 1.98 0.00 -2.79 0.00 0.00 177.10 176.49 3d4g h ALA 207 N 5.81 1.64 -0.00 1.71 0.00 -1.92 -2.78 119.26 123.72 3d4g h ALA 207 Ca -0.40 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.35 3d4g h ALA 207 Cb 1.18 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3d4g h ALA 207 CO 0.54 0.26 -0.02 -0.25 0.00 0.00 0.00 179.25 179.78 3d4g n ASP 208 N -4.34 0.20 -4.68 0.00 8.00 -1.26 -4.80 116.55 109.68 3d4g n ASP 208 Ca -0.01 -0.68 -0.42 0.00 0.71 0.00 0.00 54.79 54.38 3d4g n ASP 208 Cb 0.22 -0.10 -0.03 0.00 -0.02 0.00 0.00 41.12 41.19 3d4g n ASP 208 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3d4g s THR 209 N -2.27 2.97 0.13 -3.53 2.01 -1.05 -4.92 115.64 108.97 3d4g s THR 209 Ca 0.37 0.33 0.00 0.00 0.31 0.00 0.00 61.69 62.70 3d4g s THR 209 Cb 0.21 -3.21 0.00 0.00 0.01 0.00 0.00 72.50 69.51 3d4g s THR 209 CO 0.42 -0.01 0.01 -0.90 -0.69 0.00 0.00 174.62 173.44 3d4g n ASP 210 N 6.12 2.29 0.01 3.53 5.68 -1.26 -1.82 116.55 131.10 3d4g n ASP 210 Ca 0.17 -1.55 -0.11 0.00 -0.50 0.00 0.00 54.79 52.81 3d4g n ASP 210 Cb 0.40 0.08 -0.05 0.00 -1.14 0.00 0.00 41.12 40.41 3d4g n ASP 210 CO 0.00 0.00 0.00 0.22 -1.33 0.00 0.00 177.20 176.09 3d4g h TYR 211 N 1.03 -0.05 -0.45 2.11 5.03 -1.92 -1.04 116.97 121.67 3d4g h TYR 211 Ca -0.10 0.01 -0.13 0.00 2.58 0.00 0.00 58.73 61.09 3d4g h TYR 211 Cb 0.32 0.03 -0.01 0.00 1.55 0.00 0.00 36.73 38.62 3d4g h TYR 211 CO 0.00 -0.04 -0.21 0.66 -1.32 0.00 0.00 178.16 177.25 3d4g h SER 212 N -0.01 0.97 -0.11 -2.11 4.64 -1.98 -0.72 113.55 114.24 3d4g h SER 212 Ca 0.04 -0.40 -0.01 0.00 -0.47 0.00 0.00 61.79 60.95 3d4g h SER 212 Cb 0.07 -0.27 -0.00 0.00 -0.31 0.00 0.00 62.40 61.88 3d4g h SER 212 CO -0.08 1.16 0.04 0.40 -0.87 0.00 0.00 176.83 177.48 3d4g h ILE 213 N 0.79 1.15 -0.56 0.95 2.04 -1.93 -0.36 117.51 119.58 3d4g h ILE 213 Ca 0.10 -0.43 -0.00 0.00 1.00 0.00 0.00 64.86 65.52 3d4g h ILE 213 Cb 0.79 1.24 -0.03 0.00 -0.74 0.00 0.00 36.82 38.08 3d4g h ILE 213 CO 0.07 0.13 0.34 0.00 0.00 0.00 0.00 178.15 178.68 3d4g h ALA 214 N 0.89 0.71 -0.08 1.87 0.00 -1.15 -1.62 119.26 119.88 3d4g h ALA 214 Ca 0.04 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3d4g h ALA 214 Cb 0.17 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 3d4g h ALA 214 CO -0.00 0.19 0.04 1.49 0.00 0.00 0.00 179.25 180.96 3d4g h GLU 215 N 0.75 0.11 -0.99 0.00 4.81 -1.00 -2.13 114.58 116.12 3d4g h GLU 215 Ca 0.20 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.44 3d4g h GLU 215 Cb -0.02 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.29 3d4g h GLU 215 CO -0.04 0.21 0.65 0.00 -0.73 0.00 0.00 179.01 179.10 3d4g h ALA 216 N 0.90 1.30 -0.21 2.92 0.00 -0.99 -0.70 119.26 122.49 3d4g h ALA 216 Ca 0.03 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3d4g h ALA 216 Cb 0.14 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3d4g h ALA 216 CO -0.00 0.56 0.04 0.00 0.00 0.00 0.00 179.25 179.85 3d4g h ALA 217 N 1.40 0.28 -0.25 0.00 0.00 -1.08 -1.32 119.26 118.28 3d4g h ALA 217 Ca 0.39 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 55.01 3d4g h ALA 217 Cb -0.03 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 3d4g h ALA 217 CO -0.12 -0.06 -0.31 0.35 0.00 0.00 0.00 179.25 179.12 3d4g h PHE 218 N 0.14 0.80 0.00 0.00 3.57 -1.28 0.32 116.94 120.48 3d4g h PHE 218 Ca 0.06 -0.25 -0.02 0.00 3.53 0.00 0.00 57.97 61.29 3d4g h PHE 218 Cb 0.31 -0.16 -0.00 0.00 2.79 0.00 0.00 35.95 38.88 3d4g h PHE 218 CO 0.02 1.00 -0.09 -0.91 -2.23 0.00 0.00 178.31 176.09 3d4g h ASN 219 N 0.37 0.00 0.29 0.41 4.21 -1.11 -1.87 115.58 117.87 3d4g h ASN 219 Ca 0.03 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.54 3d4g h ASN 219 Cb 0.89 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.09 3d4g h ASN 219 CO 0.07 0.09 -0.28 0.29 -1.29 0.00 0.00 177.43 176.32 3d4g n LYS 220 N -3.23 0.71 -1.06 0.81 5.02 -0.50 -4.79 118.16 115.12 3d4g n LYS 220 Ca 0.00 -0.40 0.00 0.00 -2.02 0.00 0.00 58.31 55.89 3d4g n LYS 220 Cb 0.36 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.87 3d4g n LYS 220 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3d4g n GLY 221 N 1.36 0.40 0.13 0.72 0.00 -0.70 -4.95 105.19 102.14 3d4g n GLY 221 Ca 0.11 -1.05 0.03 0.00 0.00 0.00 0.00 46.02 45.12 3d4g n GLY 221 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3d4g h GLU 222 N 0.00 0.00 -5.68 1.61 5.08 -0.59 -3.46 114.58 111.54 3d4g h GLU 222 Ca 0.00 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.84 3d4g h GLU 222 Cb 0.09 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 29.08 3d4g h GLU 222 CO 0.00 0.31 -0.82 -0.08 -1.00 0.00 0.00 179.01 177.42 3d4g s THR 223 N -3.02 1.38 -0.12 1.13 -1.32 -1.09 -2.42 115.64 110.18 3d4g s THR 223 Ca 0.01 -1.02 0.19 0.00 -1.21 0.00 0.00 61.69 59.66 3d4g s THR 223 Cb 0.08 -1.20 0.15 0.00 -1.51 0.00 0.00 72.50 70.02 3d4g s THR 223 CO 0.77 0.17 1.58 0.00 -2.21 0.00 0.00 174.62 174.93 3d4g h ALA 224 N 5.08 0.82 -2.56 11.08 0.00 -1.00 -3.42 119.26 129.27 3d4g h ALA 224 Ca -0.39 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.08 3d4g h ALA 224 Cb 1.17 -0.06 -0.17 0.00 0.00 0.00 0.00 17.79 18.73 3d4g h ALA 224 CO 0.45 0.43 -0.48 -1.64 0.00 0.00 0.00 179.25 178.01 3d4g s MET 225 N -3.19 0.64 0.24 0.00 -1.94 0.11 -0.43 119.30 114.73 3d4g s MET 225 Ca 0.03 -0.77 -0.04 0.00 -1.71 0.00 0.00 55.69 53.20 3d4g s MET 225 Cb 0.08 0.25 -0.02 0.00 2.01 0.00 0.00 34.83 37.15 3d4g s MET 225 CO 0.70 -0.17 0.28 -0.08 -0.01 0.00 0.00 175.02 175.75 3d4g s THR 226 N -2.79 0.00 -0.12 2.05 -1.32 0.46 -1.64 115.64 112.28 3d4g s THR 226 Ca -0.03 -1.77 0.01 0.00 -1.21 0.00 0.00 61.69 58.68 3d4g s THR 226 Cb -0.00 -2.42 0.02 0.00 -1.51 0.00 0.00 72.50 68.59 3d4g s THR 226 CO -0.05 0.00 -0.13 -0.63 -2.21 0.00 0.00 174.62 171.59 3d4g s ILE 227 N -3.97 1.43 0.30 5.08 1.01 -1.26 -0.73 121.20 123.06 3d4g s ILE 227 Ca 0.33 -0.57 -0.19 0.00 0.00 0.00 0.00 60.65 60.22 3d4g s ILE 227 Cb 0.04 -1.34 0.06 0.00 0.01 0.00 0.00 42.46 41.23 3d4g s ILE 227 CO 0.13 0.43 0.88 0.21 0.00 0.00 0.00 174.94 176.59 3d4g s ASN 228 N 1.30 -0.02 0.51 3.58 3.84 -1.03 -4.63 114.94 118.49 3d4g s ASN 228 Ca -0.00 -0.92 0.07 0.00 0.21 0.00 0.00 52.86 52.22 3d4g s ASN 228 Cb -0.14 0.71 0.03 0.00 -0.55 0.00 0.00 41.25 41.30 3d4g s ASN 228 CO -0.06 -1.39 0.46 -0.83 -2.79 0.00 0.00 177.10 172.48 3d4g s GLY 229 N -3.17 2.19 0.27 1.21 0.00 -1.26 -1.35 107.32 105.21 3d4g s GLY 229 Ca 0.17 -1.62 0.01 0.00 0.00 0.00 0.00 44.72 43.27 3d4g s GLY 229 CO 0.09 -1.82 1.70 -2.55 0.00 0.00 0.00 173.10 170.51 3d4g h PRO 230 N 0.75 0.37 -1.16 2.90 0.11 -1.81 -0.35 132.00 132.81 3d4g h PRO 230 Ca -0.37 -0.02 0.33 0.00 0.11 0.00 0.00 66.00 66.04 3d4g h PRO 230 Cb 1.29 -0.08 -0.08 0.00 0.11 0.00 0.00 31.00 32.23 3d4g h PRO 230 CO 0.55 0.25 0.78 0.11 -0.21 0.00 0.00 178.00 179.47 3d4g h TRP 231 N 0.38 0.41 0.00 0.65 0.09 -1.65 -1.52 115.95 114.31 3d4g h TRP 231 Ca 0.50 0.02 -0.02 0.00 0.09 0.00 0.00 58.89 59.48 3d4g h TRP 231 Cb 0.91 -0.12 -0.00 0.00 0.08 0.00 0.00 29.16 30.03 3d4g h TRP 231 CO -0.17 -0.01 -0.09 0.00 0.09 0.00 0.00 178.44 178.26 3d4g h ALA 232 N 1.53 1.07 -0.07 0.11 0.00 -1.36 -3.32 119.26 117.22 3d4g h ALA 232 Ca 0.63 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.39 3d4g h ALA 232 Cb 1.99 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.75 3d4g h ALA 232 CO -0.22 0.11 -0.27 -1.49 0.00 0.00 0.00 179.25 177.38 3d4g h TRP 233 N 0.00 0.14 -0.60 0.00 6.55 -1.42 -3.12 115.95 117.50 3d4g h TRP 233 Ca -0.00 -0.02 0.01 0.00 0.95 0.00 0.00 58.89 59.82 3d4g h TRP 233 Cb 0.48 -0.04 -0.03 0.00 -0.86 0.00 0.00 29.16 28.71 3d4g h TRP 233 CO 0.00 0.39 0.39 1.03 -1.05 0.00 0.00 178.44 179.21 3d4g h SER 234 N 0.12 0.69 0.33 -3.49 0.87 -1.77 -0.17 113.55 110.13 3d4g h SER 234 Ca 0.02 -0.02 -0.12 0.00 -1.23 0.00 0.00 61.79 60.44 3d4g h SER 234 Cb 0.55 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.32 3d4g h SER 234 CO 0.04 0.50 -0.49 0.78 -0.53 0.00 0.00 176.83 177.13 3d4g h ASN 235 N 0.81 0.20 -0.23 6.23 2.35 -1.80 -2.52 115.58 120.63 3d4g h ASN 235 Ca 0.22 -0.10 -0.19 0.00 -0.55 0.00 0.00 56.30 55.68 3d4g h ASN 235 Cb -0.09 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.22 3d4g h ASN 235 CO -0.05 0.67 -0.60 0.40 -1.65 0.00 0.00 177.43 176.20 3d4g h ILE 236 N 0.15 1.28 -0.33 2.81 2.04 -1.47 -2.24 117.51 119.75 3d4g h ILE 236 Ca 0.01 -1.79 0.06 0.00 1.00 0.00 0.00 64.86 64.14 3d4g h ILE 236 Cb 0.93 1.71 -0.06 0.00 -0.74 0.00 0.00 36.82 38.66 3d4g h ILE 236 CO 0.07 0.58 -0.04 0.44 0.00 0.00 0.00 178.15 179.20 3d4g h ASP 237 N 0.63 -0.22 -0.27 1.72 3.32 -0.94 -2.49 116.42 118.16 3d4g h ASP 237 Ca -0.00 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.12 3d4g h ASP 237 Cb 1.21 0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.91 3d4g h ASP 237 CO 0.13 -0.07 0.14 0.74 -1.72 0.00 0.00 179.24 178.46 3d4g h THR 238 N 0.05 1.12 0.00 0.35 2.02 -1.32 -2.28 112.91 112.84 3d4g h THR 238 Ca 0.16 -0.34 0.00 0.00 0.77 0.00 0.00 66.41 67.00 3d4g h THR 238 Cb 0.23 0.73 0.00 0.00 -1.74 0.00 0.00 68.15 67.37 3d4g h THR 238 CO -0.30 0.14 0.00 -1.54 0.37 0.00 0.00 175.52 174.18 3d4g n SER 239 N -4.42 0.54 -1.94 4.18 3.41 -0.85 -4.91 113.62 109.63 3d4g n SER 239 Ca 0.02 0.59 -0.19 0.00 -0.26 0.00 0.00 58.87 59.03 3d4g n SER 239 Cb 0.12 -0.72 -0.04 0.00 -0.26 0.00 0.00 64.21 63.31 3d4g n SER 239 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3d4g n LYS 240 N -2.05 -1.47 -2.55 4.33 4.01 -0.86 -4.98 118.16 114.59 3d4g n LYS 240 Ca 0.04 1.03 -0.41 0.00 -0.51 0.00 0.00 58.31 58.46 3d4g n LYS 240 Cb 0.30 -5.51 -0.04 0.00 -0.51 0.00 0.00 35.03 29.27 3d4g n LYS 240 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 3d4g s VAL 241 N -2.87 3.93 -0.74 -0.18 1.01 -1.24 -4.98 120.40 115.32 3d4g s VAL 241 Ca 0.00 1.68 -0.26 0.00 0.00 0.00 0.00 61.98 63.40 3d4g s VAL 241 Cb 0.00 -4.07 0.04 0.00 0.00 0.00 0.00 36.38 32.35 3d4g s VAL 241 CO 0.00 0.30 1.25 0.21 0.00 0.00 0.00 175.10 176.85 3d4g s ASN 242 N -0.18 6.18 0.12 3.32 2.47 -1.26 -4.88 114.94 120.71 3d4g s ASN 242 Ca 0.48 -0.58 0.07 0.00 0.42 0.00 0.00 52.86 53.26 3d4g s ASN 242 Cb -0.29 -2.54 -0.04 0.00 -1.45 0.00 0.00 41.25 36.94 3d4g s ASN 242 CO 0.34 -1.77 -0.18 -0.72 -3.72 0.00 0.00 177.10 171.06 3d4g s TYR 243 N 5.47 1.65 0.09 0.43 1.13 -1.26 -0.17 117.35 124.69 3d4g s TYR 243 Ca 0.34 -0.46 0.10 0.00 -1.41 0.00 0.00 57.07 55.64 3d4g s TYR 243 Cb -0.09 -0.88 -0.03 0.00 -1.10 0.00 0.00 41.96 39.86 3d4g s TYR 243 CO 0.13 0.21 -0.26 0.20 -2.51 0.00 0.00 175.55 173.32 3d4g s GLY 244 N -2.19 1.45 -0.27 5.49 0.00 -0.20 -4.89 107.32 106.72 3d4g s GLY 244 Ca 0.08 -1.35 -0.07 0.00 0.00 0.00 0.00 44.72 43.39 3d4g s GLY 244 CO 0.04 -1.29 0.06 0.14 0.00 0.00 0.00 173.10 172.06 3d4g s VAL 245 N -0.96 4.06 0.35 1.40 1.01 -1.26 -1.29 120.40 123.71 3d4g s VAL 245 Ca 0.12 -0.44 0.05 0.00 0.00 0.00 0.00 61.98 61.71 3d4g s VAL 245 Cb -0.10 -2.98 -0.03 0.00 0.00 0.00 0.00 36.38 33.27 3d4g s VAL 245 CO 0.04 0.23 0.18 0.28 0.00 0.00 0.00 175.10 175.84 3d4g s THR 246 N 1.55 0.34 0.42 3.92 -1.32 0.58 -4.69 115.64 116.44 3d4g s THR 246 Ca 0.05 -2.00 -0.26 0.00 -1.21 0.00 0.00 61.69 58.27 3d4g s THR 246 Cb -0.16 -2.44 -0.09 0.00 -1.51 0.00 0.00 72.50 68.30 3d4g s THR 246 CO 0.02 0.00 1.35 0.54 -2.21 0.00 0.00 174.62 174.32 3d4g s VAL 247 N -3.41 2.40 0.59 5.08 0.11 -1.26 -1.79 120.40 122.12 3d4g s VAL 247 Ca 0.32 0.36 -0.19 0.00 -2.93 0.00 0.00 61.98 59.55 3d4g s VAL 247 Cb 0.03 -3.21 -0.04 0.00 -1.53 0.00 0.00 36.38 31.63 3d4g s VAL 247 CO 0.19 0.05 1.18 -0.76 -3.33 0.00 0.00 175.10 172.43 3d4g s LEU 248 N -2.55 3.66 0.56 2.54 1.43 -1.26 -4.48 118.68 118.58 3d4g s LEU 248 Ca 0.59 2.31 -0.19 0.00 -1.03 0.00 0.00 54.13 55.80 3d4g s LEU 248 Cb -0.40 -4.59 -0.05 0.00 0.03 0.00 0.00 46.19 41.18 3d4g s LEU 248 CO 0.52 -1.52 1.17 -2.84 0.23 0.00 0.00 176.35 173.91 3d4g s PRO 249 N -3.38 3.22 0.62 1.29 0.02 -1.26 -4.61 135.00 130.90 3d4g s PRO 249 Ca 0.75 1.72 -0.13 0.00 0.02 0.00 0.00 61.00 63.36 3d4g s PRO 249 Cb -0.28 -2.00 -0.03 0.00 0.02 0.00 0.00 34.50 32.21 3d4g s PRO 249 CO 0.32 -0.98 1.04 0.95 -0.33 0.00 0.00 177.00 178.00 3d4g s THR 250 N -1.67 4.11 -0.09 0.99 -4.23 0.62 -3.57 115.64 111.80 3d4g s THR 250 Ca 0.74 0.85 0.00 0.00 -1.18 0.00 0.00 61.69 62.10 3d4g s THR 250 Cb -0.27 -3.50 0.02 0.00 1.34 0.00 0.00 72.50 70.09 3d4g s THR 250 CO 0.30 -0.74 -0.09 0.12 -0.54 0.00 0.00 174.62 173.67 3d4g s PHE 251 N -2.78 1.41 -1.57 3.99 5.36 0.17 -0.11 117.98 124.44 3d4g s PHE 251 Ca 0.60 -0.64 -0.12 0.00 -0.96 0.00 0.00 56.93 55.81 3d4g s PHE 251 Cb -0.14 -1.14 0.10 0.00 -0.34 0.00 0.00 43.02 41.50 3d4g s PHE 251 CO 0.45 -0.42 0.76 1.63 -1.46 0.00 0.00 175.22 176.17 3d4g n LYS 252 N 4.57 -3.94 -0.37 10.12 5.02 -1.26 -1.69 118.16 130.61 3d4g n LYS 252 Ca -0.16 0.45 0.00 0.00 -2.02 0.00 0.00 58.31 56.58 3d4g n LYS 252 Cb 0.51 -5.09 0.00 0.00 -0.02 0.00 0.00 35.03 30.43 3d4g n LYS 252 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3d4g n GLY 253 N -1.62 2.03 3.84 0.72 0.00 -1.26 -5.01 105.19 103.89 3d4g n GLY 253 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.68 3d4g n GLY 253 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d4g s GLN 254 N -0.04 3.12 0.50 1.61 -0.21 -0.68 -5.03 119.66 118.94 3d4g s GLN 254 Ca 0.00 -0.57 -0.20 0.00 0.02 0.00 0.00 55.36 54.60 3d4g s GLN 254 Cb 0.00 -2.87 -0.07 0.00 1.00 0.00 0.00 33.01 31.07 3d4g s GLN 254 CO 0.00 0.59 1.08 -1.25 -2.12 0.00 0.00 175.29 173.59 3d4g s PRO 255 N -2.39 3.65 0.39 2.91 0.04 -1.26 0.42 135.00 138.76 3d4g s PRO 255 Ca 0.31 1.49 -0.27 0.00 0.04 0.00 0.00 61.00 62.57 3d4g s PRO 255 Cb -0.13 -2.11 -0.10 0.00 0.04 0.00 0.00 34.50 32.21 3d4g s PRO 255 CO 0.24 -0.58 1.39 -1.12 0.04 0.00 0.00 177.00 176.97 3d4g s SER 256 N -1.83 6.34 -0.71 6.66 0.01 -1.23 -4.47 113.70 118.46 3d4g s SER 256 Ca 0.69 2.84 0.02 0.00 1.31 0.00 0.00 55.95 60.81 3d4g s SER 256 Cb -0.20 -2.65 0.17 0.00 0.21 0.00 0.00 66.02 63.55 3d4g s SER 256 CO 0.24 -0.85 0.52 -0.54 0.41 0.00 0.00 173.24 173.02 3d4g s LYS 257 N -2.13 2.60 0.30 12.44 1.02 -0.66 -4.46 119.74 128.85 3d4g s LYS 257 Ca 0.54 -3.10 -0.29 0.00 0.02 0.00 0.00 55.97 53.15 3d4g s LYS 257 Cb -0.42 -3.58 -0.10 0.00 -0.52 0.00 0.00 37.83 33.21 3d4g s LYS 257 CO 0.56 -1.23 1.13 -1.25 -0.92 0.00 0.00 175.35 173.64 3d4g s PRO 258 N -1.05 4.53 0.04 -1.68 0.04 -1.26 -4.04 135.00 131.58 3d4g s PRO 258 Ca 0.23 1.85 -0.30 0.00 0.04 0.00 0.00 61.00 62.82 3d4g s PRO 258 Cb -0.11 -3.10 -0.07 0.00 0.04 0.00 0.00 34.50 31.26 3d4g s PRO 258 CO -0.11 0.10 1.62 -0.06 0.04 0.00 0.00 177.00 178.59 3d4g s PHE 259 N -1.20 2.38 -0.05 0.56 0.08 -1.26 -2.40 117.98 116.10 3d4g s PHE 259 Ca 0.47 0.35 -0.30 0.00 0.12 0.00 0.00 56.93 57.57 3d4g s PHE 259 Cb -0.33 -3.92 -0.03 0.00 -0.57 0.00 0.00 43.02 38.18 3d4g s PHE 259 CO 0.42 -3.70 1.07 0.08 -0.10 0.00 0.00 175.22 172.99 3d4g s VAL 260 N 2.88 4.59 0.04 -0.44 1.01 0.14 -4.74 120.40 123.88 3d4g s VAL 260 Ca 0.73 1.87 0.05 0.00 0.00 0.00 0.00 61.98 64.62 3d4g s VAL 260 Cb -0.38 -4.20 -0.04 0.00 0.00 0.00 0.00 36.38 31.77 3d4g s VAL 260 CO 0.31 0.06 -0.08 -0.83 0.00 0.00 0.00 175.10 174.55 3d4g s GLY 261 N 1.16 1.75 -0.30 4.51 0.00 -0.78 -2.06 107.32 111.60 3d4g s GLY 261 Ca 0.52 -1.10 -0.00 0.00 0.00 0.00 0.00 44.72 44.14 3d4g s GLY 261 CO 0.23 -0.99 -0.01 0.14 0.00 0.00 0.00 173.10 172.46 3d4g s VAL 262 N -1.05 2.79 0.13 1.40 1.01 -1.26 0.44 120.40 123.86 3d4g s VAL 262 Ca 0.18 -1.52 -0.33 0.00 0.00 0.00 0.00 61.98 60.31 3d4g s VAL 262 Cb -0.11 -2.65 -0.12 0.00 0.00 0.00 0.00 36.38 33.50 3d4g s VAL 262 CO 0.09 -0.15 1.72 -0.11 0.00 0.00 0.00 175.10 176.66 3d4g n LEU 263 N 4.56 3.62 -4.16 3.92 7.94 0.24 -0.48 117.00 132.64 3d4g n LEU 263 Ca -0.12 1.04 -0.14 0.00 -1.11 0.00 0.00 56.01 55.67 3d4g n LEU 263 Cb 0.43 -1.49 -0.11 0.00 0.53 0.00 0.00 43.42 42.78 3d4g n LEU 263 CO 0.25 -0.02 -0.42 -0.44 -1.11 0.00 0.00 177.39 175.66 3d4g s SER 264 N 1.88 1.39 -0.23 1.96 0.01 0.18 0.27 113.70 119.16 3d4g s SER 264 Ca 0.81 -0.79 0.01 0.00 1.31 0.00 0.00 55.95 57.29 3d4g s SER 264 Cb -0.58 0.01 0.05 0.00 0.21 0.00 0.00 66.02 65.71 3d4g s SER 264 CO 0.38 -0.26 -0.09 0.00 0.41 0.00 0.00 173.24 173.68 3d4g s ALA 265 N -2.34 2.18 0.12 1.44 0.00 0.65 -1.55 121.76 122.25 3d4g s ALA 265 Ca 0.04 -1.44 0.02 0.00 0.00 0.00 0.00 51.96 50.58 3d4g s ALA 265 Cb -0.03 -1.43 -0.04 0.00 0.00 0.00 0.00 23.12 21.62 3d4g s ALA 265 CO -0.00 -1.06 0.24 0.20 0.00 0.00 0.00 175.76 175.14 3d4g s GLY 266 N 1.30 1.88 -0.22 0.00 0.00 -0.33 -0.57 107.32 109.38 3d4g s GLY 266 Ca -0.05 -0.98 -0.09 0.00 0.00 0.00 0.00 44.72 43.59 3d4g s GLY 266 CO -0.07 -0.98 0.12 -0.42 0.00 0.00 0.00 173.10 171.76 3d4g s ILE 267 N -1.65 5.12 0.13 0.90 1.01 -1.26 -1.37 121.20 124.08 3d4g s ILE 267 Ca 0.34 0.09 -0.33 0.00 0.00 0.00 0.00 60.65 60.76 3d4g s ILE 267 Cb -0.12 -3.35 -0.12 0.00 0.01 0.00 0.00 42.46 38.88 3d4g s ILE 267 CO 0.28 0.40 1.73 -3.20 0.00 0.00 0.00 174.94 174.14 3d4g n ASN 268 N 3.97 3.65 0.15 3.58 2.85 -0.09 -0.22 115.26 129.16 3d4g n ASN 268 Ca -0.16 1.04 0.11 0.00 -0.11 0.00 0.00 54.58 55.46 3d4g n ASN 268 Cb 0.52 -1.49 0.63 0.00 1.24 0.00 0.00 39.78 40.67 3d4g n ASN 268 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3d4g h ALA 269 N 7.32 2.10 -0.01 5.20 0.00 -1.09 -1.56 119.26 131.23 3d4g h ALA 269 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3d4g h ALA 269 Cb 1.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3d4g h ALA 269 CO 0.93 -0.15 -0.13 0.00 0.00 0.00 0.00 179.25 179.90 3d4g n ALA 270 N -2.56 2.82 -1.93 0.00 0.00 -1.26 -4.85 120.51 112.72 3d4g n ALA 270 Ca 0.01 -0.31 -0.42 0.00 0.00 0.00 0.00 53.44 52.73 3d4g n ALA 270 Cb 0.23 -1.28 -0.03 0.00 0.00 0.00 0.00 19.45 18.37 3d4g n ALA 270 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3d4g s SER 271 N -2.42 6.63 0.00 0.00 0.15 -0.59 -4.90 113.70 112.56 3d4g s SER 271 Ca 0.29 2.62 0.15 0.00 0.70 0.00 0.00 55.95 59.71 3d4g s SER 271 Cb 0.20 -2.61 0.56 0.00 -1.71 0.00 0.00 66.02 62.47 3d4g s SER 271 CO 0.47 -0.77 1.41 -0.81 1.20 0.00 0.00 173.24 174.75 3d4g n PRO 272 N 3.31 1.61 -1.98 5.44 -0.04 -1.26 -4.28 135.00 137.80 3d4g n PRO 272 Ca 0.11 -0.93 -0.20 0.00 -0.04 0.00 0.00 63.50 62.44 3d4g n PRO 272 Cb 0.39 -1.30 0.04 0.00 -0.04 0.00 0.00 33.50 32.59 3d4g n PRO 272 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3d4g n ASN 273 N 0.19 4.43 0.18 3.54 3.02 -1.26 -4.85 115.26 120.52 3d4g n ASN 273 Ca 0.13 -3.62 0.03 0.00 -0.03 0.00 0.00 54.58 51.09 3d4g n ASN 273 Cb 0.26 -0.36 0.35 0.00 -0.61 0.00 0.00 39.78 39.42 3d4g n ASN 273 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 3d4g h LYS 274 N 2.13 0.00 -0.01 3.52 1.57 -1.94 -0.12 116.57 121.72 3d4g h LYS 274 Ca 0.30 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.07 3d4g h LYS 274 Cb 1.49 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.80 3d4g h LYS 274 CO 0.66 0.39 -0.06 0.93 -0.57 0.00 0.00 179.45 180.81 3d4g h GLU 275 N 0.00 0.05 -0.91 3.15 3.07 -1.96 -2.45 114.58 115.54 3d4g h GLU 275 Ca -0.00 -0.04 0.09 0.00 -0.50 0.00 0.00 59.36 58.90 3d4g h GLU 275 Cb 0.74 0.01 -0.06 0.00 -0.84 0.00 0.00 28.75 28.60 3d4g h GLU 275 CO 0.05 0.76 0.59 -0.07 -1.40 0.00 0.00 179.01 178.93 3d4g h LEU 276 N -0.64 0.86 -0.14 1.33 3.38 -1.90 -0.64 115.31 117.54 3d4g h LEU 276 Ca -0.01 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 3d4g h LEU 276 Cb 0.77 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 3d4g h LEU 276 CO 0.01 0.52 0.06 0.00 0.09 0.00 0.00 178.44 179.12 3d4g h ALA 277 N 1.53 0.19 -0.52 1.53 0.00 -1.05 -1.18 119.26 119.77 3d4g h ALA 277 Ca 0.41 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.24 3d4g h ALA 277 Cb 0.33 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 3d4g h ALA 277 CO -0.17 -0.22 0.32 -0.22 0.00 0.00 0.00 179.25 178.95 3d4g h LYS 278 N 0.07 0.61 0.02 0.00 3.64 -0.96 -0.73 116.57 119.23 3d4g h LYS 278 Ca 0.05 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.41 3d4g h LYS 278 Cb 0.18 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 3d4g h LYS 278 CO -0.00 0.41 -0.12 0.93 -2.27 0.00 0.00 179.45 178.39 3d4g h GLU 279 N 0.63 -0.20 -0.43 1.90 4.39 -1.04 -0.51 114.58 119.32 3d4g h GLU 279 Ca 0.20 0.01 0.03 0.00 0.34 0.00 0.00 59.36 59.95 3d4g h GLU 279 Cb -0.00 0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 28.66 3d4g h GLU 279 CO -0.08 -0.13 0.23 0.35 -1.16 0.00 0.00 179.01 178.21 3d4g h PHE 280 N -0.21 0.42 -0.04 4.33 3.57 -0.97 0.33 116.94 124.37 3d4g h PHE 280 Ca 0.04 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.52 3d4g h PHE 280 Cb 0.26 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 38.87 3d4g h PHE 280 CO -0.17 0.22 -0.12 -0.07 -2.23 0.00 0.00 178.31 175.94 3d4g h LEU 281 N 0.45 0.17 0.00 0.59 3.38 -1.01 0.11 115.31 119.01 3d4g h LEU 281 Ca 0.18 -0.62 -0.00 0.00 0.09 0.00 0.00 57.88 57.53 3d4g h LEU 281 Cb 0.08 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.77 3d4g h LEU 281 CO -0.12 0.76 -0.00 -0.33 0.09 0.00 0.00 178.44 178.84 3d4g h GLU 282 N -0.41 -0.00 -0.00 1.13 5.08 -1.10 0.51 114.58 119.79 3d4g h GLU 282 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3d4g h GLU 282 Cb 0.75 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.00 3d4g h GLU 282 CO 0.03 0.67 -0.77 0.09 -1.00 0.00 0.00 179.01 178.03 3d4g n ASN 283 N -4.77 0.97 0.04 1.42 3.02 0.10 -4.14 115.26 111.90 3d4g n ASN 283 Ca -0.09 -0.84 0.00 0.00 -0.03 0.00 0.00 54.58 53.62 3d4g n ASN 283 Cb 0.33 0.69 0.00 0.00 -0.61 0.00 0.00 39.78 40.19 3d4g n ASN 283 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3d4g n TYR 284 N -1.30 -0.06 0.16 3.10 4.02 -0.90 -4.87 117.16 117.31 3d4g n TYR 284 Ca 0.05 0.01 -0.11 0.00 -0.01 0.00 0.00 57.90 57.85 3d4g n TYR 284 Cb 0.35 0.02 -0.06 0.00 -0.02 0.00 0.00 39.34 39.62 3d4g n TYR 284 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 3d4g h LEU 285 N 0.00 -0.40 -4.95 7.72 5.85 -0.84 -3.30 115.31 119.39 3d4g h LEU 285 Ca 0.00 -0.13 -0.57 0.00 0.84 0.00 0.00 57.88 58.02 3d4g h LEU 285 Cb 0.33 0.10 0.02 0.00 0.37 0.00 0.00 40.66 41.48 3d4g h LEU 285 CO 0.00 0.06 3.21 0.18 -0.34 0.00 0.00 178.44 181.55 3d4g n LEU 286 N -5.10 7.80 -4.29 2.25 4.77 0.17 -2.29 117.00 120.30 3d4g n LEU 286 Ca -0.08 -4.00 -0.15 0.00 -0.03 0.00 0.00 56.01 51.74 3d4g n LEU 286 Cb 0.26 -1.47 -0.10 0.00 -2.33 0.00 0.00 43.42 39.78 3d4g n LEU 286 CO 0.23 1.81 -0.27 0.42 -1.33 0.00 0.00 177.39 178.25 3d4g s THR 287 N 2.23 0.53 0.20 -5.08 -4.23 -1.26 -4.80 115.64 103.23 3d4g s THR 287 Ca 0.65 -1.99 -0.10 0.00 -1.18 0.00 0.00 61.69 59.06 3d4g s THR 287 Cb 0.18 -2.51 0.12 0.00 1.34 0.00 0.00 72.50 71.64 3d4g s THR 287 CO -0.05 -0.11 1.81 0.44 -0.54 0.00 0.00 174.62 176.17 3d4g h ASP 288 N 2.48 0.53 -0.36 3.99 3.32 -1.92 -1.21 116.42 123.25 3d4g h ASP 288 Ca -0.38 0.02 -0.16 0.00 0.02 0.00 0.00 57.03 56.54 3d4g h ASP 288 Cb 1.24 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.70 3d4g h ASP 288 CO 0.61 0.35 -0.41 -0.33 -1.72 0.00 0.00 179.24 177.74 3d4g h GLU 289 N 0.66 0.92 0.01 3.56 3.07 -1.90 -1.55 114.58 119.35 3d4g h GLU 289 Ca 0.27 -0.49 -0.00 0.00 -0.50 0.00 0.00 59.36 58.64 3d4g h GLU 289 Cb 0.14 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 3d4g h GLU 289 CO -0.16 1.15 -0.00 0.78 -1.40 0.00 0.00 179.01 179.37 3d4g h GLY 290 N 0.78 -0.01 1.86 -3.84 0.00 -1.59 -2.61 103.07 97.66 3d4g h GLY 290 Ca 0.06 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.33 3d4g h GLY 290 CO 0.10 -0.00 -0.22 1.41 0.00 0.00 0.00 176.54 177.82 3d4g h LEU 291 N -0.44 0.17 -0.55 3.11 3.38 -0.79 -2.78 115.31 117.41 3d4g h LEU 291 Ca -0.00 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 3d4g h LEU 291 Cb 0.43 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 3d4g h LEU 291 CO 0.00 0.40 0.18 -0.08 0.09 0.00 0.00 178.44 179.03 3d4g h GLU 292 N 0.16 0.85 -0.61 1.13 4.81 -1.26 0.12 114.58 119.78 3d4g h GLU 292 Ca 0.03 -0.18 -0.00 0.00 -0.13 0.00 0.00 59.36 59.08 3d4g h GLU 292 Cb 0.48 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.71 3d4g h GLU 292 CO 0.03 0.76 0.37 0.00 -0.73 0.00 0.00 179.01 179.44 3d4g h ALA 293 N 1.04 0.78 -0.13 2.92 0.00 -1.19 0.89 119.26 123.57 3d4g h ALA 293 Ca 0.18 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.84 3d4g h ALA 293 Cb 0.26 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.81 3d4g h ALA 293 CO -0.01 0.25 -0.61 0.28 0.00 0.00 0.00 179.25 179.17 3d4g h VAL 294 N 0.82 1.33 -0.60 0.00 2.07 -1.42 -3.11 116.25 115.34 3d4g h VAL 294 Ca 0.22 -1.88 -0.07 0.00 0.82 0.00 0.00 66.70 65.79 3d4g h VAL 294 Cb -0.02 2.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.82 3d4g h VAL 294 CO -0.04 0.58 0.09 -1.13 0.02 0.00 0.00 177.57 177.09 3d4g h ASN 295 N 0.30 0.91 -0.59 0.57 -1.24 -0.64 -1.56 115.58 113.33 3d4g h ASN 295 Ca -0.04 -0.20 0.02 0.00 0.71 0.00 0.00 56.30 56.79 3d4g h ASN 295 Cb 1.25 -0.24 -0.03 0.00 0.73 0.00 0.00 38.32 40.03 3d4g h ASN 295 CO 0.13 0.92 0.39 0.11 -1.29 0.00 0.00 177.43 177.69 3d4g h LYS 296 N 0.91 0.72 0.21 6.67 1.57 -0.88 -2.76 116.57 123.01 3d4g h LYS 296 Ca 0.18 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.91 3d4g h LYS 296 Cb 0.40 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.55 3d4g h LYS 296 CO 0.01 0.48 -0.10 0.22 -0.57 0.00 0.00 179.45 179.49 3d4g h ASP 297 N 0.75 -0.24 -3.39 0.86 3.58 -1.38 -3.46 116.42 113.14 3d4g h ASP 297 Ca 0.23 0.01 -0.39 0.00 0.42 0.00 0.00 57.03 57.29 3d4g h ASP 297 Cb -0.01 0.06 -0.36 0.00 1.72 0.00 0.00 39.33 40.74 3d4g h ASP 297 CO -0.06 -0.04 -0.76 -0.54 -2.88 0.00 0.00 179.24 174.97 3d4g s LYS 298 N -2.63 0.48 0.20 0.28 -0.14 -0.63 -4.81 119.74 112.49 3d4g s LYS 298 Ca -0.04 0.08 -0.32 0.00 -1.36 0.00 0.00 55.97 54.32 3d4g s LYS 298 Cb 0.00 -0.72 -0.14 0.00 -1.68 0.00 0.00 37.83 35.30 3d4g s LYS 298 CO 0.12 -0.20 1.44 -2.30 -0.76 0.00 0.00 175.35 173.65 3d4g n PRO 299 N 4.56 1.96 0.16 -1.68 -0.02 -1.04 -3.99 135.00 134.94 3d4g n PRO 299 Ca -0.18 0.70 0.12 0.00 -2.02 0.00 0.00 63.50 62.12 3d4g n PRO 299 Cb 0.50 -2.38 0.10 0.00 -0.02 0.00 0.00 33.50 31.71 3d4g n PRO 299 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3d4g h LEU 300 N 4.66 0.00 0.00 2.45 3.38 -1.87 -1.90 115.31 122.03 3d4g h LEU 300 Ca -0.45 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.51 3d4g h LEU 300 Cb 1.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.03 3d4g h LEU 300 CO 0.79 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.94 3d4g n GLY 301 N 1.16 0.95 3.36 0.83 0.00 -1.26 -4.46 105.19 105.76 3d4g n GLY 301 Ca 0.02 -1.44 -0.45 0.00 0.00 0.00 0.00 46.02 44.15 3d4g n GLY 301 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d4g s ALA 302 N -2.00 3.54 0.54 4.61 0.00 -0.78 -4.92 121.76 122.74 3d4g s ALA 302 Ca 0.00 -2.45 -0.22 0.00 0.00 0.00 0.00 51.96 49.30 3d4g s ALA 302 Cb 0.00 -3.49 -0.05 0.00 0.00 0.00 0.00 23.12 19.57 3d4g s ALA 302 CO 0.00 -2.30 1.31 0.14 0.00 0.00 0.00 175.76 174.91 3d4g s VAL 303 N 2.17 2.32 0.36 0.00 -7.23 -1.26 0.41 120.40 117.17 3d4g s VAL 303 Ca 0.11 0.23 0.09 0.00 -1.81 0.00 0.00 61.98 60.61 3d4g s VAL 303 Cb -0.23 -3.12 0.11 0.00 0.56 0.00 0.00 36.38 33.70 3d4g s VAL 303 CO 0.03 -0.01 1.83 0.00 -0.31 0.00 0.00 175.10 176.64 3d4g h ALA 304 N 1.49 1.36 -2.07 1.32 0.00 -1.01 -3.42 119.26 116.93 3d4g h ALA 304 Ca -0.51 -0.29 -0.56 0.00 0.00 0.00 0.00 54.91 53.55 3d4g h ALA 304 Cb 1.29 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 3d4g h ALA 304 CO 0.57 0.45 1.12 -1.17 0.00 0.00 0.00 179.25 180.22 3d4g s LEU 305 N -8.49 3.96 0.24 0.00 2.96 -1.26 -1.98 118.68 114.10 3d4g s LEU 305 Ca -0.05 1.72 -0.05 0.00 -0.22 0.00 0.00 54.13 55.54 3d4g s LEU 305 Cb 0.15 -3.53 0.42 0.00 0.50 0.00 0.00 46.19 43.72 3d4g s LEU 305 CO 0.74 -1.21 1.76 0.11 -1.32 0.00 0.00 176.35 176.44 3d4g h LYS 306 N 10.57 0.57 -0.31 1.98 1.57 -1.35 -1.58 116.57 128.01 3d4g h LYS 306 Ca -0.34 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.39 3d4g h LYS 306 Cb 1.16 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.33 3d4g h LYS 306 CO 0.99 0.37 0.14 0.66 -0.57 0.00 0.00 179.45 181.05 3d4g h SER 307 N 0.58 0.41 0.99 0.86 4.64 -1.91 -2.16 113.55 116.96 3d4g h SER 307 Ca 0.40 -0.13 -0.21 0.00 -0.47 0.00 0.00 61.79 61.37 3d4g h SER 307 Cb 0.50 -0.11 -0.03 0.00 -0.31 0.00 0.00 62.40 62.46 3d4g h SER 307 CO -0.32 0.43 -1.01 0.22 -0.87 0.00 0.00 176.83 175.28 3d4g h TYR 308 N 0.36 0.01 -0.66 4.77 3.20 -1.92 -3.17 116.97 119.56 3d4g h TYR 308 Ca 0.11 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.94 3d4g h TYR 308 Cb 0.13 -0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.37 3d4g h TYR 308 CO -0.02 1.01 0.30 1.49 -1.64 0.00 0.00 178.16 179.30 3d4g h GLU 309 N 0.00 0.96 -0.58 1.82 4.22 -1.19 -2.35 114.58 117.46 3d4g h GLU 309 Ca -0.02 -0.15 -0.03 0.00 0.08 0.00 0.00 59.36 59.24 3d4g h GLU 309 Cb 1.78 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 30.83 3d4g h GLU 309 CO 0.13 0.78 0.25 0.93 -2.18 0.00 0.00 179.01 178.91 3d4g h GLU 310 N 0.92 0.83 -0.12 1.92 5.08 -1.45 -0.90 114.58 120.87 3d4g h GLU 310 Ca 0.22 -0.12 -0.07 0.00 -1.00 0.00 0.00 59.36 58.40 3d4g h GLU 310 Cb 0.15 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 3d4g h GLU 310 CO -0.03 0.67 -0.22 1.49 -1.00 0.00 0.00 179.01 179.92 3d4g h GLU 311 N 0.83 0.20 -0.01 2.33 4.81 -1.44 -3.21 114.58 118.09 3d4g h GLU 311 Ca 0.20 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 3d4g h GLU 311 Cb 0.14 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.50 3d4g h GLU 311 CO -0.02 0.42 -0.79 1.28 -0.73 0.00 0.00 179.01 179.16 3d4g n LEU 312 N -4.20 1.38 0.22 1.64 4.32 -0.92 -4.54 117.00 114.89 3d4g n LEU 312 Ca -0.01 -0.60 0.15 0.00 -0.02 0.00 0.00 56.01 55.53 3d4g n LEU 312 Cb 0.33 0.00 0.66 0.00 -1.62 0.00 0.00 43.42 42.79 3d4g n LEU 312 CO 0.39 0.30 0.94 0.00 -1.22 0.00 0.00 177.39 177.80 3d4g h ALA 313 N 3.30 1.00 -0.25 -1.18 0.00 -1.17 -2.11 119.26 118.85 3d4g h ALA 313 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3d4g h ALA 313 Cb 0.59 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 3d4g h ALA 313 CO 0.00 0.00 -0.04 0.87 0.00 0.00 0.00 179.25 180.08 3d4g h LYS 314 N 0.00 0.39 -6.20 0.00 1.57 -1.80 -3.42 116.57 107.11 3d4g h LYS 314 Ca 0.00 -0.08 -0.67 0.00 -1.87 0.00 0.00 60.65 58.03 3d4g h LYS 314 Cb 0.35 -0.06 0.01 0.00 0.08 0.00 0.00 32.23 32.61 3d4g h LYS 314 CO 0.00 0.45 1.05 -3.47 -0.57 0.00 0.00 179.45 176.91 3d4g n ASP 315 N -4.30 2.93 0.27 0.86 -0.08 -0.79 -4.86 116.55 110.58 3d4g n ASP 315 Ca 0.01 0.97 0.16 0.00 -1.51 0.00 0.00 54.79 54.42 3d4g n ASP 315 Cb 0.24 -1.27 0.69 0.00 2.34 0.00 0.00 41.12 43.12 3d4g n ASP 315 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 3d4g h PRO 316 N 8.66 0.00 -0.21 -0.67 0.13 -1.89 -1.45 132.00 136.57 3d4g h PRO 316 Ca -0.46 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.61 3d4g h PRO 316 Cb 1.29 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.42 3d4g h PRO 316 CO 0.96 0.04 -0.11 0.00 -0.23 0.00 0.00 178.00 178.66 3d4g h ARG 317 N 0.00 0.45 -0.72 0.86 3.08 -1.89 -1.31 114.38 114.84 3d4g h ARG 317 Ca -0.00 -0.20 -0.07 0.00 0.07 0.00 0.00 59.98 59.78 3d4g h ARG 317 Cb 0.50 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.51 3d4g h ARG 317 CO 0.01 0.74 0.19 0.82 -1.07 0.00 0.00 179.97 180.66 3d4g h ILE 318 N 0.15 1.26 -0.87 2.04 1.08 -1.81 -1.06 117.51 118.30 3d4g h ILE 318 Ca 0.05 -0.96 0.02 0.00 -0.39 0.00 0.00 64.86 63.57 3d4g h ILE 318 Cb 0.61 0.50 -0.05 0.00 -3.07 0.00 0.00 36.82 34.82 3d4g h ILE 318 CO 0.03 0.37 0.57 0.00 -0.69 0.00 0.00 178.15 178.44 3d4g h ALA 319 N 1.10 1.40 -0.28 1.87 0.00 -1.17 -1.11 119.26 121.08 3d4g h ALA 319 Ca 0.23 -0.05 -0.18 0.00 0.00 0.00 0.00 54.91 54.90 3d4g h ALA 319 Cb 0.36 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3d4g h ALA 319 CO -0.00 0.54 -0.54 0.00 0.00 0.00 0.00 179.25 179.25 3d4g h ALA 320 N 1.47 0.45 -0.40 0.00 0.00 -0.95 -1.29 119.26 118.54 3d4g h ALA 320 Ca 0.33 -0.51 0.07 0.00 0.00 0.00 0.00 54.91 54.80 3d4g h ALA 320 Cb -0.09 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.57 3d4g h ALA 320 CO -0.08 0.66 0.01 1.15 0.00 0.00 0.00 179.25 180.99 3d4g h THR 321 N 0.65 0.71 0.00 0.00 2.02 -0.71 -0.68 112.91 114.90 3d4g h THR 321 Ca 0.01 -0.04 -0.11 0.00 0.77 0.00 0.00 66.41 67.04 3d4g h THR 321 Cb 1.15 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 68.12 3d4g h THR 321 CO 0.12 0.02 -0.54 0.24 0.37 0.00 0.00 175.52 175.74 3d4g h MET 322 N 0.12 0.00 -0.40 6.66 2.86 -1.17 0.25 114.93 123.25 3d4g h MET 322 Ca 0.20 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.78 3d4g h MET 322 Cb 0.27 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.92 3d4g h MET 322 CO -0.32 0.54 0.03 1.49 1.06 0.00 0.00 176.91 179.71 3d4g h GLU 323 N 0.00 0.69 -0.36 1.72 4.81 -0.72 -0.15 114.58 120.57 3d4g h GLU 323 Ca -0.01 -0.20 -0.14 0.00 -0.13 0.00 0.00 59.36 58.88 3d4g h GLU 323 Cb 0.98 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.29 3d4g h GLU 323 CO 0.07 0.76 -0.32 -0.91 -0.73 0.00 0.00 179.01 177.88 3d4g h ASN 324 N 0.53 0.91 -0.85 1.04 2.35 -0.96 -2.83 115.58 115.77 3d4g h ASN 324 Ca 0.12 -0.46 0.07 0.00 -0.55 0.00 0.00 56.30 55.48 3d4g h ASN 324 Cb 0.42 -0.25 -0.06 0.00 0.05 0.00 0.00 38.32 38.48 3d4g h ASN 324 CO 0.01 1.17 0.51 0.00 -1.65 0.00 0.00 177.43 177.48 3d4g h ALA 325 N 0.76 1.17 -0.31 -0.83 0.00 -0.41 -1.52 119.26 118.12 3d4g h ALA 325 Ca 0.06 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.00 3d4g h ALA 325 Cb 0.90 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 3d4g h ALA 325 CO 0.08 0.23 0.15 0.37 0.00 0.00 0.00 179.25 180.08 3d4g h GLN 326 N 0.92 0.31 0.00 0.00 5.75 -0.98 -2.91 115.11 118.20 3d4g h GLN 326 Ca 0.38 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.86 3d4g h GLN 326 Cb 0.22 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 28.70 3d4g h GLN 326 CO -0.19 0.20 0.00 0.87 -2.65 0.00 0.00 178.83 177.06 3d4g h LYS 327 N 0.32 0.00 0.00 1.69 1.57 -1.15 -3.45 116.57 115.55 3d4g h LYS 327 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 3d4g h LYS 327 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 3d4g h LYS 327 CO -0.09 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.20 3d4g n GLY 328 N 0.57 1.18 3.20 3.86 0.00 -0.63 -4.57 105.19 108.79 3d4g n GLY 328 Ca 0.03 -1.94 -0.24 0.00 0.00 0.00 0.00 46.02 43.86 3d4g n GLY 328 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3d4g s GLU 329 N 1.40 1.31 0.26 1.61 2.56 -1.01 -4.92 118.70 119.93 3d4g s GLU 329 Ca 0.00 -0.78 -0.29 0.00 0.00 0.00 0.00 54.97 53.90 3d4g s GLU 329 Cb 0.00 -1.34 -0.09 0.00 2.00 0.00 0.00 34.13 34.69 3d4g s GLU 329 CO 0.00 0.35 1.18 -1.50 -0.56 0.00 0.00 175.26 174.74 3d4g s ILE 330 N -0.65 3.30 0.33 -3.70 2.07 -1.26 0.27 121.20 121.56 3d4g s ILE 330 Ca 0.06 1.24 -0.29 0.00 -1.41 0.00 0.00 60.65 60.25 3d4g s ILE 330 Cb -0.08 -3.79 -0.10 0.00 0.13 0.00 0.00 42.46 38.62 3d4g s ILE 330 CO 0.01 0.27 1.39 -0.04 -1.91 0.00 0.00 174.94 174.65 3d4g s MET 331 N -1.16 4.26 0.78 3.50 -1.94 -0.87 -4.81 119.30 119.06 3d4g s MET 331 Ca 0.48 2.34 -0.13 0.00 -1.71 0.00 0.00 55.69 56.68 3d4g s MET 331 Cb -0.34 -3.05 0.07 0.00 2.01 0.00 0.00 34.83 33.52 3d4g s MET 331 CO 0.43 -0.34 1.16 -2.14 -0.01 0.00 0.00 175.02 174.13 3d4g s PRO 332 N -1.62 1.88 -0.06 2.03 0.02 -1.26 -4.87 135.00 131.11 3d4g s PRO 332 Ca 0.52 1.59 0.13 0.00 0.02 0.00 0.00 61.00 63.26 3d4g s PRO 332 Cb -0.42 -1.82 0.40 0.00 0.02 0.00 0.00 34.50 32.68 3d4g s PRO 332 CO 0.54 -2.00 1.33 0.27 -0.33 0.00 0.00 177.00 176.81 3d4g n ASN 333 N -3.25 3.33 -4.75 2.53 6.94 -1.26 -4.41 115.26 114.38 3d4g n ASN 333 Ca 0.12 -2.36 -0.36 0.00 -0.02 0.00 0.00 54.58 51.96 3d4g n ASN 333 Cb 0.51 -0.35 0.03 0.00 -2.36 0.00 0.00 39.78 37.62 3d4g n ASN 333 CO 0.00 0.00 0.00 0.27 -1.03 0.00 0.00 177.26 176.50 3d4g s ILE 334 N -1.64 2.59 0.57 1.53 -4.36 -1.26 -2.38 121.20 116.25 3d4g s ILE 334 Ca 0.31 0.37 0.28 0.00 -0.26 0.00 0.00 60.65 61.35 3d4g s ILE 334 Cb 0.20 -3.15 0.38 0.00 1.25 0.00 0.00 42.46 41.14 3d4g s ILE 334 CO 0.14 -0.08 1.97 -0.65 0.24 0.00 0.00 174.94 176.57 3d4g h PRO 335 N 0.92 0.00 0.00 0.37 0.11 -1.89 -1.97 132.00 129.54 3d4g h PRO 335 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3d4g h PRO 335 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 3d4g h PRO 335 CO 0.55 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.38 3d4g n GLN 336 N -3.90 0.65 -0.10 1.05 3.00 -1.26 -3.75 117.38 113.07 3d4g n GLN 336 Ca 0.07 0.02 -0.06 0.00 -0.01 0.00 0.00 57.00 57.03 3d4g n GLN 336 Cb 0.57 -1.50 0.13 0.00 0.00 0.00 0.00 30.24 29.45 3d4g n GLN 336 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.06 177.58 3d4g h MET 337 N 0.00 0.79 -0.72 -1.09 2.86 -1.68 -1.33 114.93 113.76 3d4g h MET 337 Ca 0.00 -0.25 -0.04 0.00 -2.06 0.00 0.00 59.70 57.36 3d4g h MET 337 Cb 0.08 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 3d4g h MET 337 CO 0.00 0.84 0.30 0.66 1.06 0.00 0.00 176.91 179.77 3d4g h SER 338 N 0.72 0.97 -0.54 1.22 4.64 -1.82 0.13 113.55 118.87 3d4g h SER 338 Ca 0.13 -0.13 -0.04 0.00 -0.47 0.00 0.00 61.79 61.27 3d4g h SER 338 Cb 0.55 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.37 3d4g h SER 338 CO 0.03 0.85 0.17 0.00 -0.87 0.00 0.00 176.83 177.01 3d4g h ALA 339 N 1.29 0.70 -0.33 5.18 0.00 -1.70 0.22 119.26 124.63 3d4g h ALA 339 Ca 0.24 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 55.00 3d4g h ALA 339 Cb 0.18 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 3d4g h ALA 339 CO -0.02 0.36 0.11 0.35 0.00 0.00 0.00 179.25 180.04 3d4g h PHE 340 N 0.74 0.19 -0.37 0.00 3.57 -0.83 -1.43 116.94 118.81 3d4g h PHE 340 Ca 0.17 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.64 3d4g h PHE 340 Cb 0.27 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.96 3d4g h PHE 340 CO 0.02 0.07 0.04 -1.49 -2.23 0.00 0.00 178.31 174.72 3d4g h TRP 341 N 0.24 0.67 -0.47 0.41 -0.00 -0.38 -1.46 115.95 114.96 3d4g h TRP 341 Ca 0.15 -0.10 0.06 0.00 -0.00 0.00 0.00 58.89 59.00 3d4g h TRP 341 Cb 0.13 -0.18 -0.05 0.00 -0.00 0.00 0.00 29.16 29.06 3d4g h TRP 341 CO -0.15 0.69 0.18 -0.92 -0.00 0.00 0.00 178.44 178.24 3d4g h TYR 342 N 0.46 0.32 -0.21 0.49 3.20 -0.91 -0.14 116.97 120.18 3d4g h TYR 342 Ca 0.11 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.01 3d4g h TYR 342 Cb 0.39 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 3d4g h TYR 342 CO 0.03 0.12 0.12 0.00 -1.64 0.00 0.00 178.16 176.79 3d4g h ALA 343 N 1.31 0.26 -0.22 1.82 0.00 -0.91 -1.51 119.26 120.01 3d4g h ALA 343 Ca 0.22 -0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.94 3d4g h ALA 343 Cb 0.21 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3d4g h ALA 343 CO -0.22 -0.28 -0.60 0.28 0.00 0.00 0.00 179.25 178.43 3d4g h VAL 344 N 0.25 1.29 -0.28 0.00 2.07 -1.12 -1.75 116.25 116.71 3d4g h VAL 344 Ca 0.08 -1.80 0.06 0.00 0.82 0.00 0.00 66.70 65.86 3d4g h VAL 344 Cb -0.00 1.83 -0.06 0.00 -1.52 0.00 0.00 31.29 31.54 3d4g h VAL 344 CO -0.04 0.57 -0.11 -0.09 0.02 0.00 0.00 177.57 177.92 3d4g h ARG 345 N 0.53 -0.06 -0.35 1.57 2.43 -0.93 -0.88 114.38 116.69 3d4g h ARG 345 Ca -0.01 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 3d4g h ARG 345 Cb 1.22 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.77 3d4g h ARG 345 CO 0.13 -0.04 0.08 1.15 -1.51 0.00 0.00 179.97 179.78 3d4g h THR 346 N -0.06 1.23 -0.16 0.20 2.02 -1.23 -2.45 112.91 112.46 3d4g h THR 346 Ca 0.14 -0.78 0.01 0.00 0.77 0.00 0.00 66.41 66.56 3d4g h THR 346 Cb 0.28 1.06 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 3d4g h THR 346 CO -0.32 0.26 0.06 0.00 0.37 0.00 0.00 175.52 175.89 3d4g h ALA 347 N 0.92 0.18 -0.46 6.16 0.00 -1.06 -1.26 119.26 123.75 3d4g h ALA 347 Ca 0.11 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3d4g h ALA 347 Cb 0.32 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3d4g h ALA 347 CO 0.00 -0.38 0.15 0.28 0.00 0.00 0.00 179.25 179.30 3d4g h VAL 348 N 0.14 1.22 -0.34 0.00 2.07 -1.13 -0.26 116.25 117.96 3d4g h VAL 348 Ca 0.07 -0.73 -0.00 0.00 0.82 0.00 0.00 66.70 66.86 3d4g h VAL 348 Cb 0.04 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 3d4g h VAL 348 CO -0.07 0.26 0.19 0.40 0.02 0.00 0.00 177.57 178.38 3d4g h ILE 349 N 0.60 1.12 -0.31 4.57 2.04 -1.29 0.20 117.51 124.43 3d4g h ILE 349 Ca 0.15 -0.31 -0.15 0.00 1.00 0.00 0.00 64.86 65.55 3d4g h ILE 349 Cb 0.26 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 3d4g h ILE 349 CO -0.01 0.12 -0.41 0.78 0.00 0.00 0.00 178.15 178.64 3d4g h ASN 350 N 0.43 0.81 -0.08 1.72 2.35 -1.09 -1.56 115.58 118.15 3d4g h ASN 350 Ca 0.12 -0.37 -0.01 0.00 -0.55 0.00 0.00 56.30 55.48 3d4g h ASN 350 Cb 0.03 -0.23 -0.00 0.00 0.05 0.00 0.00 38.32 38.17 3d4g h ASN 350 CO -0.02 1.11 -0.00 0.00 -1.65 0.00 0.00 177.43 176.87 3d4g h ALA 351 N 0.92 0.11 0.00 -0.83 0.00 -0.97 -1.17 119.26 117.32 3d4g h ALA 351 Ca 0.05 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 3d4g h ALA 351 Cb 0.96 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 3d4g h ALA 351 CO 0.09 -0.20 -0.10 0.00 0.00 0.00 0.00 179.25 179.04 3d4g h ALA 352 N 0.71 1.82 0.00 0.00 0.00 -0.55 -1.24 119.26 120.00 3d4g h ALA 352 Ca 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3d4g h ALA 352 Cb 0.36 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3d4g h ALA 352 CO 0.00 0.13 -0.13 -1.13 0.00 0.00 0.00 179.25 178.12 3d4g n SER 353 N -4.40 0.33 -0.16 0.00 3.41 -0.59 -4.77 113.62 107.43 3d4g n SER 353 Ca -0.03 0.37 -0.02 0.00 -0.26 0.00 0.00 58.87 58.94 3d4g n SER 353 Cb 0.18 -0.40 -0.01 0.00 -0.26 0.00 0.00 64.21 63.72 3d4g n SER 353 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d4g n GLY 354 N 1.44 0.54 0.15 5.00 0.00 -0.47 -4.89 105.19 106.95 3d4g n GLY 354 Ca 0.06 -0.31 0.03 0.00 0.00 0.00 0.00 46.02 45.80 3d4g n GLY 354 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3d4g h ARG 355 N 0.46 0.00 -3.90 1.61 2.43 -1.46 -3.45 114.38 110.06 3d4g h ARG 355 Ca -0.04 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.00 3d4g h ARG 355 Cb 0.30 0.00 -0.17 0.00 -0.42 0.00 0.00 29.97 29.68 3d4g h ARG 355 CO 0.06 0.49 -0.55 -1.14 -1.51 0.00 0.00 179.97 177.32 3d4g s GLN 356 N -3.07 0.60 0.74 0.20 2.00 -0.82 -5.01 119.66 114.30 3d4g s GLN 356 Ca 0.03 -0.85 -0.11 0.00 -2.00 0.00 0.00 55.36 52.43 3d4g s GLN 356 Cb 0.08 0.23 0.04 0.00 0.80 0.00 0.00 33.01 34.16 3d4g s GLN 356 CO 0.73 -0.14 1.08 0.95 -0.50 0.00 0.00 175.29 177.41 3d4g s THR 357 N -2.90 3.61 0.22 -0.34 -4.23 -1.26 -4.04 115.64 106.69 3d4g s THR 357 Ca -0.03 0.52 -0.07 0.00 -1.18 0.00 0.00 61.69 60.93 3d4g s THR 357 Cb 0.01 -3.24 0.15 0.00 1.34 0.00 0.00 72.50 70.75 3d4g s THR 357 CO -0.06 -0.68 1.76 0.58 -0.54 0.00 0.00 174.62 175.68 3d4g h VAL 358 N -0.90 1.26 -0.20 2.29 2.07 -1.96 -0.95 116.25 117.86 3d4g h VAL 358 Ca -0.45 -0.88 -0.04 0.00 0.82 0.00 0.00 66.70 66.16 3d4g h VAL 358 Cb 1.23 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 3d4g h VAL 358 CO 0.57 0.35 -0.02 -0.78 0.02 0.00 0.00 177.57 177.72 3d4g h ASP 359 N 1.11 0.36 0.09 0.57 1.82 -1.95 -2.49 116.42 115.94 3d4g h ASP 359 Ca 0.25 -0.33 -0.15 0.00 -0.39 0.00 0.00 57.03 56.40 3d4g h ASP 359 Cb 0.27 -0.10 -0.01 0.00 0.68 0.00 0.00 39.33 40.18 3d4g h ASP 359 CO -0.01 0.61 -0.54 0.00 -1.61 0.00 0.00 179.24 177.68 3d4g h ALA 360 N 0.77 0.75 -0.25 -0.78 0.00 -1.93 -2.14 119.26 115.68 3d4g h ALA 360 Ca 0.06 -0.51 -0.05 0.00 0.00 0.00 0.00 54.91 54.40 3d4g h ALA 360 Cb 0.43 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3d4g h ALA 360 CO 0.01 0.69 -0.06 0.00 0.00 0.00 0.00 179.25 179.89 3d4g h ALA 361 N 1.04 0.34 -0.03 0.00 0.00 -1.17 -2.35 119.26 117.08 3d4g h ALA 361 Ca 0.01 -0.27 -0.19 0.00 0.00 0.00 0.00 54.91 54.46 3d4g h ALA 361 Cb 1.07 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 3d4g h ALA 361 CO 0.10 0.14 -0.81 -0.07 0.00 0.00 0.00 179.25 178.61 3d4g h LEU 362 N 0.22 0.41 -0.72 0.00 3.38 -1.48 -1.35 115.31 115.77 3d4g h LEU 362 Ca 0.06 -0.30 0.01 0.00 0.09 0.00 0.00 57.88 57.75 3d4g h LEU 362 Cb 0.52 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.11 3d4g h LEU 362 CO 0.02 1.06 0.47 0.00 0.09 0.00 0.00 178.44 180.09 3d4g h ALA 363 N 0.92 0.92 -0.04 1.53 0.00 -1.42 -1.33 119.26 119.85 3d4g h ALA 363 Ca -0.04 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 3d4g h ALA 363 Cb 1.41 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 3d4g h ALA 363 CO 0.13 0.31 -0.52 0.00 0.00 0.00 0.00 179.25 179.17 3d4g h ALA 364 N 1.28 1.05 -0.75 0.00 0.00 -1.33 -3.03 119.26 116.47 3d4g h ALA 364 Ca 0.27 -0.48 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 3d4g h ALA 364 Cb -0.08 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 3d4g h ALA 364 CO -0.07 0.67 0.32 0.00 0.00 0.00 0.00 179.25 180.16 3d4g h ALA 365 N 1.37 0.97 -0.18 0.00 0.00 -0.76 -0.17 119.26 120.49 3d4g h ALA 365 Ca -0.00 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.78 3d4g h ALA 365 Cb 0.96 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.41 3d4g h ALA 365 CO 0.07 0.57 -0.13 0.37 0.00 0.00 0.00 179.25 180.14 3d4g h GLN 366 N 1.07 -0.12 -0.08 0.00 5.75 -1.16 0.42 115.11 121.00 3d4g h GLN 366 Ca 0.25 0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.75 3d4g h GLN 366 Cb 0.19 0.03 -0.00 0.00 1.07 0.00 0.00 27.48 28.76 3d4g h GLN 366 CO -0.02 -0.08 0.02 1.15 -2.65 0.00 0.00 178.83 177.25 3d4g h THR 367 N -0.13 1.17 -0.28 2.39 2.02 -1.39 -0.93 112.91 115.77 3d4g h THR 367 Ca 0.11 -0.53 0.06 0.00 0.77 0.00 0.00 66.41 66.82 3d4g h THR 367 Cb 0.29 1.39 -0.06 0.00 -1.74 0.00 0.00 68.15 68.03 3d4g h THR 367 CO -0.26 0.15 -0.08 0.78 0.37 0.00 0.00 175.52 176.48 3d4g h ASN 368 N -0.07 -0.30 -0.65 4.18 2.35 -0.92 0.38 115.58 120.55 3d4g h ASN 368 Ca 0.02 0.09 -0.06 0.00 -0.55 0.00 0.00 56.30 55.80 3d4g h ASN 368 Cb 0.22 0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.75 3d4g h ASN 368 CO -0.00 -0.11 0.17 0.00 -1.65 0.00 0.00 177.43 175.84 3d4g h ALA 369 N 1.26 1.04 0.15 -0.83 0.00 -0.82 -0.34 119.26 119.73 3d4g h ALA 369 Ca 0.14 -0.23 -0.29 0.00 0.00 0.00 0.00 54.91 54.52 3d4g h ALA 369 Cb 0.23 -0.26 0.02 0.00 0.00 0.00 0.00 17.79 17.78 3d4g h ALA 369 CO -0.30 0.63 -1.28 0.00 0.00 0.00 0.00 179.25 178.30 3d4g h ALA 370 N 1.18 0.03 0.00 0.00 0.00 -0.84 -3.41 119.26 116.21 3d4g h ALA 370 Ca 0.21 -0.83 0.00 0.00 0.00 0.00 0.00 54.91 54.29 3d4g h ALA 370 Cb 0.34 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3d4g h ALA 370 CO -0.00 0.80 -0.06 0.00 0.00 0.00 0.00 179.25 179.99 3d4g n ALA 371 N -2.62 1.33 -2.38 0.00 0.00 0.13 -4.82 120.51 112.15 3d4g n ALA 371 Ca -0.12 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.03 3d4g n ALA 371 Cb 1.02 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 20.32 3d4g n ALA 371 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3d4g s VAL 372 N -0.73 1.93 -0.10 0.00 1.01 -0.14 0.09 120.40 122.45 3d4g s VAL 372 Ca 0.00 -1.21 -0.00 0.00 0.00 0.00 0.00 61.98 60.76 3d4g s VAL 372 Cb 0.00 -1.64 0.02 0.00 0.00 0.00 0.00 36.38 34.77 3d4g s VAL 372 CO 0.00 0.38 -0.07 -0.75 0.00 0.00 0.00 175.10 174.67 3d4g s LYS 373 N -0.98 1.39 -0.17 2.72 2.20 0.02 -4.62 119.74 120.31 3d4g s LYS 373 Ca 0.10 -0.21 -0.05 0.00 -0.36 0.00 0.00 55.97 55.45 3d4g s LYS 373 Cb -0.09 -1.49 -0.03 0.00 -1.51 0.00 0.00 37.83 34.71 3d4g s LYS 373 CO 0.01 -0.26 0.01 0.08 -0.36 0.00 0.00 175.35 174.82 3d4g s VAL 374 N 1.70 4.28 -0.13 4.02 1.01 -1.26 -0.87 120.40 129.15 3d4g s VAL 374 Ca 0.04 -0.22 0.00 0.00 0.00 0.00 0.00 61.98 61.80 3d4g s VAL 374 Cb -0.13 -2.90 0.02 0.00 0.00 0.00 0.00 36.38 33.38 3d4g s VAL 374 CO -0.07 0.48 -0.12 -0.70 0.00 0.00 0.00 175.10 174.69 3d4g s GLU 375 N 0.34 1.98 -0.27 2.72 2.12 0.47 -5.01 118.70 121.06 3d4g s GLU 375 Ca -0.01 -0.44 -0.11 0.00 0.36 0.00 0.00 54.97 54.78 3d4g s GLU 375 Cb -0.13 -1.88 -0.05 0.00 0.26 0.00 0.00 34.13 32.33 3d4g s GLU 375 CO 0.02 -0.24 0.18 0.00 -0.54 0.00 0.00 175.26 174.68 3d4g n LEU 377 N 4.95 0.00 0.00 0.00 4.77 0.12 -5.01 117.00 121.83 3d4g n LEU 377 Ca -0.14 -2.62 0.00 0.00 -0.03 0.00 0.00 56.01 53.21 3d4g n LEU 377 Cb 0.52 0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.78 3d4g n LEU 377 CO 0.33 -0.45 0.33 -0.62 -1.33 0.00 0.00 177.39 175.65 3d4g n GLU 378 N -1.29 0.00 -0.31 3.23 1.02 -1.26 -2.98 120.64 119.05 3d4g n GLU 378 Ca -0.12 0.59 0.07 0.00 -0.02 0.00 0.00 57.16 57.68 3d4g n GLU 378 Cb 0.55 -1.16 0.21 0.00 -0.02 0.00 0.00 31.44 31.02 3d4g n GLU 378 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3d4g n ALA 379 N -1.53 2.56 -2.48 0.62 0.00 -1.26 -5.02 120.51 113.41 3d4g n ALA 379 Ca 0.00 -1.64 -0.17 0.00 0.00 0.00 0.00 53.44 51.64 3d4g n ALA 379 Cb 0.00 -0.58 -0.11 0.00 0.00 0.00 0.00 19.45 18.76 3d4g n ALA 379 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3d4g s GLU 380 N -1.78 0.99 -0.03 0.00 2.12 -1.16 -1.16 118.70 117.68 3d4g s GLU 380 Ca 0.33 -1.23 0.02 0.00 0.36 0.00 0.00 54.97 54.44 3d4g s GLU 380 Cb 0.22 -0.80 0.01 0.00 0.26 0.00 0.00 34.13 33.82 3d4g s GLU 380 CO 0.14 0.15 -0.06 -1.17 -0.54 0.00 0.00 175.26 173.77 3d4g s LEU 381 N -2.50 1.66 -0.15 2.70 2.96 -0.04 0.16 118.68 123.48 3d4g s LEU 381 Ca 0.09 -0.13 0.02 0.00 -0.22 0.00 0.00 54.13 53.88 3d4g s LEU 381 Cb -0.04 -0.42 0.01 0.00 0.50 0.00 0.00 46.19 46.24 3d4g s LEU 381 CO 0.02 0.02 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.17 3d4g s VAL 382 N 0.38 2.10 -0.19 1.68 1.01 0.34 -0.73 120.40 125.00 3d4g s VAL 382 Ca -0.05 -0.96 -0.00 0.00 0.00 0.00 0.00 61.98 60.97 3d4g s VAL 382 Cb -0.09 -1.85 0.01 0.00 0.00 0.00 0.00 36.38 34.45 3d4g s VAL 382 CO 0.00 0.55 -0.15 -0.69 0.00 0.00 0.00 175.10 174.81 3d4g s VAL 383 N 0.91 2.53 -0.21 2.92 1.01 -0.26 -0.40 120.40 126.90 3d4g s VAL 383 Ca -0.04 -0.79 -0.04 0.00 0.00 0.00 0.00 61.98 61.11 3d4g s VAL 383 Cb -0.15 -2.09 -0.01 0.00 0.00 0.00 0.00 36.38 34.12 3d4g s VAL 383 CO -0.04 0.50 -0.04 -0.89 0.00 0.00 0.00 175.10 174.64 3d4g s THR 384 N 1.25 3.49 -0.12 3.92 2.01 -0.05 0.03 115.64 126.18 3d4g s THR 384 Ca 0.03 -0.46 -0.00 0.00 0.31 0.00 0.00 61.69 61.57 3d4g s THR 384 Cb -0.14 -2.58 -0.02 0.00 0.01 0.00 0.00 72.50 69.77 3d4g s THR 384 CO -0.08 0.42 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.47 3d4g s VAL 385 N 1.36 3.25 -0.01 3.82 1.01 0.98 -0.79 120.40 130.01 3d4g s VAL 385 Ca 0.04 -0.61 -0.30 0.00 0.00 0.00 0.00 61.98 61.12 3d4g s VAL 385 Cb -0.14 -2.36 -0.05 0.00 0.00 0.00 0.00 36.38 33.83 3d4g s VAL 385 CO -0.02 0.54 1.34 -0.55 0.00 0.00 0.00 175.10 176.41 3d4g s SER 386 N 0.08 6.91 0.35 3.32 0.15 0.11 -0.54 113.70 124.09 3d4g s SER 386 Ca -0.04 2.03 0.10 0.00 0.70 0.00 0.00 55.95 58.73 3d4g s SER 386 Cb -0.14 -2.56 0.63 0.00 -1.71 0.00 0.00 66.02 62.24 3d4g s SER 386 CO 0.04 -0.67 1.79 0.03 1.20 0.00 0.00 173.24 175.63 3d4g h ARG 387 N 7.68 0.10 -4.14 5.44 3.08 -1.24 -3.09 114.38 122.22 3d4g h ARG 387 Ca -0.37 -0.04 -0.70 0.00 0.07 0.00 0.00 59.98 58.94 3d4g h ARG 387 Cb 1.17 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.19 3d4g h ARG 387 CO 0.89 0.46 3.00 -3.47 -1.07 0.00 0.00 179.97 179.78 3d4g n ASP 388 N -4.08 3.77 0.01 7.04 2.03 -1.26 -0.72 116.55 123.33 3d4g n ASP 388 Ca -0.02 -2.83 -0.08 0.00 0.52 0.00 0.00 54.79 52.39 3d4g n ASP 388 Cb 0.42 -1.60 0.09 0.00 -0.72 0.00 0.00 41.12 39.31 3d4g n ASP 388 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 3d4g h LEU 389 N 10.57 0.55 0.00 -2.67 5.85 -1.75 -3.26 115.31 124.60 3d4g h LEU 389 Ca 0.55 -0.27 -0.08 0.00 0.84 0.00 0.00 57.88 58.92 3d4g h LEU 389 Cb 0.65 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 3d4g h LEU 389 CO 1.88 0.95 -1.99 0.49 -0.34 0.00 0.00 178.44 179.42 3d4g n PHE 390 N -3.98 0.09 0.00 1.25 3.72 -1.26 -4.85 117.46 112.43 3d4g n PHE 390 Ca -0.02 0.03 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 3d4g n PHE 390 Cb 0.57 -0.65 0.00 0.00 -0.94 0.00 0.00 39.48 38.46 3d4g n PHE 390 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3d4g n GLY 391 N 1.36 0.39 0.23 1.37 0.00 -1.23 -4.98 105.19 102.32 3d4g n GLY 391 Ca -0.10 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.02 3d4g n GLY 391 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3d4g h THR 392 N 0.00 0.70 0.00 2.61 2.02 -1.94 -3.46 112.91 112.84 3d4g h THR 392 Ca 0.00 -0.89 0.00 0.00 0.77 0.00 0.00 66.41 66.29 3d4g h THR 392 Cb 0.00 1.56 0.00 0.00 -1.74 0.00 0.00 68.15 67.97 3d4g h THR 392 CO 0.00 0.20 0.00 0.61 0.37 0.00 0.00 175.52 176.70 3d4g n GLY 393 N -0.35 0.95 3.65 2.16 0.00 -1.26 -5.04 105.19 105.30 3d4g n GLY 393 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 3d4g n GLY 393 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3d4g s LYS 394 N -0.82 4.22 -0.01 1.61 2.20 -1.26 -4.97 119.74 120.70 3d4g s LYS 394 Ca 0.00 1.16 -0.25 0.00 -0.36 0.00 0.00 55.97 56.53 3d4g s LYS 394 Cb 0.00 -3.64 -0.04 0.00 -1.51 0.00 0.00 37.83 32.63 3d4g s LYS 394 CO 0.00 -0.59 0.76 -0.51 -0.36 0.00 0.00 175.35 174.65 3d4g s LEU 395 N 3.05 4.38 0.61 5.43 1.43 -1.26 -4.44 118.68 127.88 3d4g s LEU 395 Ca 0.40 1.35 -0.16 0.00 -1.03 0.00 0.00 54.13 54.69 3d4g s LEU 395 Cb -0.15 -3.20 -0.02 0.00 0.03 0.00 0.00 46.19 42.84 3d4g s LEU 395 CO 0.07 -0.07 1.09 0.68 0.23 0.00 0.00 176.35 178.34 3d4g s VAL 396 N 0.45 3.46 -0.01 -1.59 -7.23 0.10 -4.98 120.40 110.59 3d4g s VAL 396 Ca 0.40 0.72 -0.10 0.00 -1.81 0.00 0.00 61.98 61.18 3d4g s VAL 396 Cb -0.19 -3.24 -0.05 0.00 0.56 0.00 0.00 36.38 33.45 3d4g s VAL 396 CO 0.21 -0.38 0.32 -1.10 -0.31 0.00 0.00 175.10 173.85 3d4g s GLN 397 N -3.94 3.71 0.42 4.82 -0.21 -1.26 -4.92 119.66 118.28 3d4g s GLN 397 Ca 0.67 0.14 0.10 0.00 0.02 0.00 0.00 55.36 56.28 3d4g s GLN 397 Cb -0.19 -3.14 0.92 0.00 1.00 0.00 0.00 33.01 31.60 3d4g s GLN 397 CO 0.37 0.67 2.03 -1.00 -2.12 0.00 0.00 175.29 175.24 3d4g h PRO 398 N 4.39 0.34 0.00 2.91 0.13 -1.96 -2.06 132.00 135.76 3d4g h PRO 398 Ca -0.51 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 3d4g h PRO 398 Cb 1.21 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.27 3d4g h PRO 398 CO 0.63 0.29 0.00 0.78 -0.23 0.00 0.00 178.00 179.47 3d4g h GLY 399 N 0.49 0.00 0.72 1.56 0.00 -2.01 -1.83 103.07 102.00 3d4g h GLY 399 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.42 3d4g h GLY 399 CO -0.01 0.00 -0.23 1.22 0.00 0.00 0.00 176.54 177.53 3d4g n ASP 400 N -3.08 0.67 -4.65 0.19 8.00 -0.77 -4.84 116.55 112.07 3d4g n ASP 400 Ca -0.01 -0.58 -0.35 0.00 0.71 0.00 0.00 54.79 54.56 3d4g n ASP 400 Cb 0.19 0.04 -0.10 0.00 -0.02 0.00 0.00 41.12 41.22 3d4g n ASP 400 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3d4g s LEU 401 N -2.61 3.71 -0.02 0.64 1.43 -0.69 -0.87 118.68 120.27 3d4g s LEU 401 Ca 0.23 0.10 0.01 0.00 -1.03 0.00 0.00 54.13 53.44 3d4g s LEU 401 Cb 0.19 -1.90 0.02 0.00 0.03 0.00 0.00 46.19 44.53 3d4g s LEU 401 CO 0.53 0.25 -0.01 -0.89 0.23 0.00 0.00 176.35 176.46 3d4g s THR 402 N -0.09 0.21 -0.22 5.49 2.01 -0.19 -4.99 115.64 117.86 3d4g s THR 402 Ca 0.06 0.03 -0.07 0.00 0.31 0.00 0.00 61.69 62.01 3d4g s THR 402 Cb -0.12 -0.28 -0.04 0.00 0.01 0.00 0.00 72.50 72.07 3d4g s THR 402 CO 0.01 0.13 0.07 -0.22 -0.69 0.00 0.00 174.62 173.93 3d4g s LEU 403 N 0.80 3.65 0.00 4.42 2.96 -1.26 -0.70 118.68 128.54 3d4g s LEU 403 Ca -0.08 -0.06 0.00 0.00 -0.22 0.00 0.00 54.13 53.77 3d4g s LEU 403 Cb -0.11 -1.95 0.00 0.00 0.50 0.00 0.00 46.19 44.62 3d4g s LEU 403 CO -0.01 0.07 0.00 0.61 -1.32 0.00 0.00 176.35 175.70 3d4g n GLY 404 N 4.23 0.55 0.86 7.98 0.00 0.75 -4.74 105.19 114.82 3d4g n GLY 404 Ca -0.16 -0.90 -0.05 0.00 0.00 0.00 0.00 46.02 44.90 3d4g n GLY 404 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3d4g n SER 405 N -2.49 0.22 0.16 1.61 3.41 -1.26 -4.93 113.62 110.34 3d4g n SER 405 Ca 0.00 -1.21 0.04 0.00 -0.26 0.00 0.00 58.87 57.44 3d4g n SER 405 Cb 0.00 -0.17 0.46 0.00 -0.26 0.00 0.00 64.21 64.25 3d4g n SER 405 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3d4g h GLU 406 N 0.00 0.15 0.00 4.33 3.07 -1.96 -1.60 114.58 118.57 3d4g h GLU 406 Ca -0.08 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.75 3d4g h GLU 406 Cb 0.27 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.15 3d4g h GLU 406 CO 0.08 0.26 0.00 0.78 -1.40 0.00 0.00 179.01 178.73 3d4g h GLY 407 N 0.56 0.00 -6.79 -3.84 0.00 -1.94 -3.41 103.07 87.65 3d4g h GLY 407 Ca 0.03 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.80 3d4g h GLY 407 CO 0.02 0.00 0.96 0.00 0.00 0.00 0.00 176.54 177.51 3d4g n GLN 409 N 8.04 2.22 -1.58 0.00 6.02 -1.26 -4.84 117.38 125.97 3d4g n GLN 409 Ca 0.12 -4.47 -0.30 0.00 -0.01 0.00 0.00 57.00 52.33 3d4g n GLN 409 Cb 0.49 -2.14 0.07 0.00 1.02 0.00 0.00 30.24 29.68 3d4g n GLN 409 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 3d4g s PRO 410 N -2.18 2.57 0.01 -1.09 0.04 -1.26 -4.94 135.00 128.14 3d4g s PRO 410 Ca 0.37 0.79 -0.30 0.00 0.04 0.00 0.00 61.00 61.90 3d4g s PRO 410 Cb 0.13 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.67 3d4g s PRO 410 CO -0.04 -1.32 1.05 0.50 0.04 0.00 0.00 177.00 177.23 3d4g s ARG 411 N -5.11 4.51 -0.17 4.56 3.52 -0.39 -4.90 118.95 120.97 3d4g s ARG 411 Ca 0.59 1.52 0.00 0.00 -0.13 0.00 0.00 55.73 57.72 3d4g s ARG 411 Cb -0.14 -3.44 0.01 0.00 -1.56 0.00 0.00 34.95 29.82 3d4g s ARG 411 CO 0.54 -0.14 -0.16 0.08 -0.81 0.00 0.00 175.30 174.81 3d4g s VAL 412 N 1.14 2.48 0.01 7.11 1.01 -1.26 -0.65 120.40 130.24 3d4g s VAL 412 Ca 0.54 -0.82 0.08 0.00 0.00 0.00 0.00 61.98 61.77 3d4g s VAL 412 Cb -0.23 -2.05 -0.02 0.00 0.00 0.00 0.00 36.38 34.08 3d4g s VAL 412 CO 0.27 0.52 -0.24 -0.44 0.00 0.00 0.00 175.10 175.21 3d4g s SER 413 N 1.01 2.81 -0.07 3.32 0.01 -0.16 -4.98 113.70 115.63 3d4g s SER 413 Ca -0.02 -0.48 0.03 0.00 1.31 0.00 0.00 55.95 56.79 3d4g s SER 413 Cb -0.15 -0.29 0.01 0.00 0.21 0.00 0.00 66.02 65.80 3d4g s SER 413 CO -0.04 0.26 -0.16 -0.69 0.41 0.00 0.00 173.24 173.03 3d4g s VAL 414 N -0.65 1.41 0.48 3.43 1.01 -1.26 -0.15 120.40 124.68 3d4g s VAL 414 Ca 0.09 -0.64 0.04 0.00 0.00 0.00 0.00 61.98 61.47 3d4g s VAL 414 Cb -0.09 -1.25 0.04 0.00 0.00 0.00 0.00 36.38 35.08 3d4g s VAL 414 CO 0.00 0.41 0.35 0.47 0.00 0.00 0.00 175.10 176.34 3d4g n ASP 415 N 3.68 2.58 -0.10 3.32 8.00 0.26 -5.02 116.55 129.27 3d4g n ASP 415 Ca -0.22 -2.68 0.00 0.00 0.71 0.00 0.00 54.79 52.61 3d4g n ASP 415 Cb 0.52 -0.03 0.29 0.00 -0.02 0.00 0.00 41.12 41.88 3d4g n ASP 415 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 3d4g h THR 416 N 0.67 1.18 0.00 -3.53 1.35 -2.03 -3.33 112.91 107.22 3d4g h THR 416 Ca -0.31 -0.50 0.00 0.00 -0.55 0.00 0.00 66.41 65.05 3d4g h THR 416 Cb 1.13 0.48 0.00 0.00 -1.73 0.00 0.00 68.15 68.03 3d4g h THR 416 CO 0.49 0.21 -0.88 -0.90 -0.25 0.00 0.00 175.52 174.18 3d4g n ASP 417 N -4.37 2.03 -4.05 5.36 5.75 -1.26 -4.92 116.55 115.09 3d4g n ASP 417 Ca 0.05 -0.29 -0.11 0.00 -0.01 0.00 0.00 54.79 54.43 3d4g n ASP 417 Cb 0.12 1.18 -0.11 0.00 -1.03 0.00 0.00 41.12 41.28 3d4g n ASP 417 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 3d4g s VAL 418 N -2.12 0.36 -0.14 2.12 -7.23 -1.25 -0.67 120.40 111.46 3d4g s VAL 418 Ca -0.00 -1.19 -0.03 0.00 -1.81 0.00 0.00 61.98 58.94 3d4g s VAL 418 Cb 0.05 -0.70 -0.03 0.00 0.56 0.00 0.00 36.38 36.26 3d4g s VAL 418 CO 0.29 -0.55 -0.03 -0.69 -0.31 0.00 0.00 175.10 173.81 3d4g s VAL 419 N -1.94 4.00 -0.15 1.32 1.01 0.30 -0.57 120.40 124.37 3d4g s VAL 419 Ca -0.08 -0.33 0.02 0.00 0.00 0.00 0.00 61.98 61.59 3d4g s VAL 419 Cb -0.06 -2.74 0.00 0.00 0.00 0.00 0.00 36.38 33.58 3d4g s VAL 419 CO -0.02 0.51 -0.19 -0.60 0.00 0.00 0.00 175.10 174.80 3d4g s ARG 420 N 0.10 3.10 -0.25 2.72 3.52 0.79 -0.02 118.95 128.92 3d4g s ARG 420 Ca -0.00 -0.81 -0.08 0.00 -0.13 0.00 0.00 55.73 54.71 3d4g s ARG 420 Cb -0.13 -2.52 -0.03 0.00 -1.56 0.00 0.00 34.95 30.71 3d4g s ARG 420 CO 0.02 -0.00 0.08 -0.06 -0.81 0.00 0.00 175.30 174.54 3d4g s PHE 421 N 0.81 3.10 -0.43 5.12 0.40 0.10 -0.99 117.98 126.10 3d4g s PHE 421 Ca -0.06 -0.35 -0.10 0.00 -0.60 0.00 0.00 56.93 55.82 3d4g s PHE 421 Cb -0.15 -2.25 0.08 0.00 0.51 0.00 0.00 43.02 41.21 3d4g s PHE 421 CO -0.01 -0.33 0.29 -0.80 0.70 0.00 0.00 175.22 175.07 3d4g s ASN 422 N 1.62 5.72 0.04 1.36 -0.87 0.18 -1.11 114.94 121.88 3d4g s ASN 422 Ca 0.06 -1.54 0.08 0.00 -1.57 0.00 0.00 52.86 49.89 3d4g s ASN 422 Cb -0.15 -2.02 -0.03 0.00 -0.02 0.00 0.00 41.25 39.03 3d4g s ASN 422 CO 0.05 -0.58 -0.23 0.00 -2.57 0.00 0.00 177.10 173.77 3d4g s ALA 423 N 1.45 2.42 -0.05 0.60 0.00 0.09 -1.26 121.76 125.00 3d4g s ALA 423 Ca 0.04 -1.24 -0.26 0.00 0.00 0.00 0.00 51.96 50.49 3d4g s ALA 423 Cb -0.24 -0.60 -0.03 0.00 0.00 0.00 0.00 23.12 22.25 3d4g s ALA 423 CO 0.02 0.55 0.83 -0.65 0.00 0.00 0.00 175.76 176.52 3d4g s GLN 424 N -1.35 4.48 0.22 0.00 -1.52 -1.26 -0.86 119.66 119.37 3d4g s GLN 424 Ca 0.13 1.12 -0.09 0.00 -1.95 0.00 0.00 55.36 54.57 3d4g s GLN 424 Cb -0.10 -3.46 0.17 0.00 -0.22 0.00 0.00 33.01 29.40 3d4g s GLN 424 CO 0.04 -0.02 1.86 1.25 -0.25 0.00 0.00 175.29 178.17 3d4g h LEU 425 N 6.91 0.96 -0.21 2.90 5.85 -1.46 -2.28 115.31 127.98 3d4g h LEU 425 Ca -0.40 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.26 3d4g h LEU 425 Cb 1.20 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.98 3d4g h LEU 425 CO 0.76 0.74 0.12 -0.74 -0.34 0.00 0.00 178.44 178.98 3d4g h HIS 426 N 1.11 0.29 0.00 1.25 2.76 -1.94 -0.87 115.15 117.74 3d4g h HIS 426 Ca 0.29 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.46 3d4g h HIS 426 Cb -0.05 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 28.81 3d4g h HIS 426 CO -0.01 0.24 -0.10 1.05 -1.30 0.00 0.00 177.93 177.81 3d4g h GLU 427 N 0.25 0.00 -0.01 5.26 4.11 -1.88 -3.31 114.58 119.01 3d4g h GLU 427 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.51 3d4g h GLU 427 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 3d4g h GLU 427 CO -0.01 0.00 -0.55 0.00 0.07 0.00 0.00 179.01 178.52 3d4g s SER 429 N -2.29 6.40 0.19 0.00 0.01 -0.35 -4.63 113.70 113.03 3d4g s SER 429 Ca 0.11 0.85 0.07 0.00 1.31 0.00 0.00 55.95 58.30 3d4g s SER 429 Cb 0.14 -2.54 0.06 0.00 0.21 0.00 0.00 66.02 63.89 3d4g s SER 429 CO 0.55 -1.38 1.44 0.28 0.41 0.00 0.00 173.24 174.54 3d4g h SER 430 N 10.43 0.06 -3.85 2.44 0.02 -1.35 -3.46 113.55 117.84 3d4g h SER 430 Ca -0.27 -0.05 -0.19 0.00 -0.84 0.00 0.00 61.79 60.44 3d4g h SER 430 Cb 1.10 -0.02 -0.26 0.00 0.14 0.00 0.00 62.40 63.36 3d4g h SER 430 CO 1.08 0.85 -0.55 -0.60 -1.14 0.00 0.00 176.83 176.47 3d4g s ARG 431 N -3.19 0.18 0.02 3.45 3.52 -0.60 -5.02 118.95 117.31 3d4g s ARG 431 Ca -0.01 0.16 0.04 0.00 -0.13 0.00 0.00 55.73 55.79 3d4g s ARG 431 Cb 0.11 0.09 -0.02 0.00 -1.56 0.00 0.00 34.95 33.57 3d4g s ARG 431 CO 0.80 -0.02 -0.13 0.14 -0.81 0.00 0.00 175.30 175.28 3d4g s VAL 432 N -0.01 1.00 0.24 7.11 -7.23 -1.26 -0.60 120.40 119.65 3d4g s VAL 432 Ca -0.01 -0.79 -0.18 0.00 -1.81 0.00 0.00 61.98 59.19 3d4g s VAL 432 Cb -0.01 -0.89 0.02 0.00 0.56 0.00 0.00 36.38 36.06 3d4g s VAL 432 CO 0.00 0.09 0.58 0.00 -0.31 0.00 0.00 175.10 175.47 3d4g s GLN 433 N -0.79 1.56 -0.10 4.82 -2.07 -0.55 -5.00 119.66 117.52 3d4g s GLN 433 Ca 0.02 -0.99 0.03 0.00 -1.82 0.00 0.00 55.36 52.61 3d4g s GLN 433 Cb -0.07 0.54 0.00 0.00 -1.09 0.00 0.00 33.01 32.40 3d4g s GLN 433 CO 0.00 -0.68 -0.21 -1.64 -1.32 0.00 0.00 175.29 171.44 3d4g s MET 434 N -3.92 2.80 0.67 9.60 -1.94 -1.26 -0.20 119.30 125.04 3d4g s MET 434 Ca 0.13 -0.79 0.01 0.00 -1.71 0.00 0.00 55.69 53.33 3d4g s MET 434 Cb -0.03 -2.17 0.13 0.00 2.01 0.00 0.00 34.83 34.77 3d4g s MET 434 CO 0.03 0.11 0.92 0.25 -0.01 0.00 0.00 175.02 176.32 3d4g n THR 435 N 3.70 0.00 -0.23 2.05 -2.24 -0.59 -4.99 114.28 111.98 3d4g n THR 435 Ca -0.20 -1.53 -0.01 0.00 -2.27 0.00 0.00 64.05 60.04 3d4g n THR 435 Cb 0.52 -0.87 0.10 0.00 -2.10 0.00 0.00 70.33 67.99 3d4g n THR 435 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 3d4g h LYS 436 N 0.00 0.64 0.00 -0.78 3.64 -2.00 -3.26 116.57 114.81 3d4g h LYS 436 Ca -0.30 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.04 3d4g h LYS 436 Cb 1.15 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 3d4g h LYS 436 CO 0.34 0.43 -1.45 -0.25 -2.27 0.00 0.00 179.45 176.24 3d4g n ASP 437 N -4.80 0.48 -4.04 4.20 9.92 -1.26 -4.87 116.55 116.18 3d4g n ASP 437 Ca 0.09 -0.39 -0.08 0.00 -0.53 0.00 0.00 54.79 53.88 3d4g n ASP 437 Cb 0.19 1.40 -0.10 0.00 -0.64 0.00 0.00 41.12 41.97 3d4g n ASP 437 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3d4g s ALA 438 N -3.27 0.34 -0.22 2.24 0.00 -1.23 0.85 121.76 120.46 3d4g s ALA 438 Ca -0.00 -1.00 -0.08 0.00 0.00 0.00 0.00 51.96 50.88 3d4g s ALA 438 Cb 0.15 0.26 -0.04 0.00 0.00 0.00 0.00 23.12 23.49 3d4g s ALA 438 CO 0.87 -0.33 0.08 -0.51 0.00 0.00 0.00 175.76 175.86 3d4g s LEU 439 N -2.57 3.67 -0.16 0.00 1.43 0.61 -1.53 118.68 120.12 3d4g s LEU 439 Ca 0.02 -0.05 -0.02 0.00 -1.03 0.00 0.00 54.13 53.04 3d4g s LEU 439 Cb 0.04 -1.96 -0.02 0.00 0.03 0.00 0.00 46.19 44.28 3d4g s LEU 439 CO -0.08 0.07 -0.08 -0.69 0.23 0.00 0.00 176.35 175.80 3d4g s VAL 440 N 1.00 3.43 -0.18 -1.59 1.01 0.72 -0.89 120.40 123.89 3d4g s VAL 440 Ca 0.04 -0.51 -0.02 0.00 0.00 0.00 0.00 61.98 61.49 3d4g s VAL 440 Cb -0.14 -2.49 -0.01 0.00 0.00 0.00 0.00 36.38 33.74 3d4g s VAL 440 CO 0.03 0.49 -0.08 -0.31 0.00 0.00 0.00 175.10 175.23 3d4g s TYR 441 N 0.63 2.91 -0.01 5.22 1.51 0.58 -1.48 117.35 126.72 3d4g s TYR 441 Ca -0.04 -0.80 0.06 0.00 -1.01 0.00 0.00 57.07 55.27 3d4g s TYR 441 Cb -0.15 -1.99 -0.01 0.00 -0.11 0.00 0.00 41.96 39.69 3d4g s TYR 441 CO 0.03 -0.39 -0.18 -1.12 -1.11 0.00 0.00 175.55 172.78 3d4g s SER 442 N 0.96 2.07 0.00 2.29 0.01 0.24 -0.50 113.70 118.76 3d4g s SER 442 Ca -0.01 -0.34 0.00 0.00 1.31 0.00 0.00 55.95 56.91 3d4g s SER 442 Cb -0.15 -0.22 0.00 0.00 0.21 0.00 0.00 66.02 65.86 3d4g s SER 442 CO -0.00 0.20 0.00 1.07 0.41 0.00 0.00 173.24 174.92 3d4g n THR 443 N 2.54 0.00 -4.05 1.44 5.66 0.23 -0.87 114.28 119.24 3d4g n THR 443 Ca -0.15 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.73 3d4g n THR 443 Cb 0.54 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 69.20 3d4g n THR 443 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 3d4g s PHE 444 N -3.64 0.52 -0.17 1.09 -0.71 -1.26 -0.65 117.98 113.16 3d4g s PHE 444 Ca 0.00 -0.43 -0.04 0.00 -1.04 0.00 0.00 56.93 55.42 3d4g s PHE 444 Cb 0.00 -0.32 -0.02 0.00 -1.21 0.00 0.00 43.02 41.47 3d4g s PHE 444 CO 0.00 -0.09 -0.04 -1.17 -1.34 0.00 0.00 175.22 172.58 3d4g s LEU 445 N -1.29 3.17 -0.08 -1.99 2.96 -0.05 -0.18 118.68 121.22 3d4g s LEU 445 Ca -0.09 -0.18 0.04 0.00 -0.22 0.00 0.00 54.13 53.68 3d4g s LEU 445 Cb -0.09 -1.77 -0.01 0.00 0.50 0.00 0.00 46.19 44.82 3d4g s LEU 445 CO -0.00 0.13 -0.22 -0.22 -1.32 0.00 0.00 176.35 174.72 3d4g s LEU 446 N 0.58 2.21 -0.26 -0.68 2.96 0.12 -0.85 118.68 122.76 3d4g s LEU 446 Ca -0.03 -0.48 -0.07 0.00 -0.22 0.00 0.00 54.13 53.34 3d4g s LEU 446 Cb -0.14 -1.43 -0.01 0.00 0.50 0.00 0.00 46.19 45.10 3d4g s LEU 446 CO 0.03 0.22 0.06 -2.28 -1.32 0.00 0.00 176.35 173.05 3d4g s HIS 447 N 0.01 3.09 -0.32 5.38 5.65 0.99 -1.02 115.29 129.06 3d4g s HIS 447 Ca -0.08 -0.69 -0.01 0.00 0.25 0.00 0.00 55.06 54.53 3d4g s HIS 447 Cb -0.15 -2.23 0.13 0.00 -1.18 0.00 0.00 32.58 29.15 3d4g s HIS 447 CO 0.05 -0.46 0.24 0.34 -0.65 0.00 0.00 174.74 174.26 3d4g s ASP 448 N 1.56 2.40 0.00 9.88 2.15 -0.05 -1.87 116.67 130.73 3d4g s ASP 448 Ca 0.05 -1.41 -0.01 0.00 0.43 0.00 0.00 52.55 51.61 3d4g s ASP 448 Cb -0.16 0.07 -0.05 0.00 -0.30 0.00 0.00 42.92 42.48 3d4g s ASP 448 CO 0.02 -0.36 1.91 -0.81 -0.17 0.00 0.00 175.17 175.77 3d4g n PRO 449 N 4.78 0.98 -1.96 4.34 -0.04 -1.26 -4.78 135.00 137.07 3d4g n PRO 449 Ca 0.03 -0.19 -0.41 0.00 -0.04 0.00 0.00 63.50 62.89 3d4g n PRO 449 Cb 0.43 -1.30 -0.01 0.00 -0.04 0.00 0.00 33.50 32.58 3d4g n PRO 449 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3d4g s ARG 450 N 0.68 4.22 -0.44 0.54 1.81 -1.26 -1.49 118.95 123.01 3d4g s ARG 450 Ca 0.13 2.39 -0.24 0.00 -1.72 0.00 0.00 55.73 56.29 3d4g s ARG 450 Cb 0.06 -3.01 0.02 0.00 -0.45 0.00 0.00 34.95 31.58 3d4g s ARG 450 CO 0.00 -0.37 0.84 -1.25 -0.68 0.00 0.00 175.30 173.83 3d4g s PRO 451 N -1.96 3.52 0.12 3.54 0.04 -1.26 -5.05 135.00 133.94 3d4g s PRO 451 Ca 0.51 0.07 -0.31 0.00 0.04 0.00 0.00 61.00 61.31 3d4g s PRO 451 Cb -0.43 -3.91 -0.08 0.00 0.04 0.00 0.00 34.50 30.12 3d4g s PRO 451 CO 0.58 -1.10 1.42 0.54 0.04 0.00 0.00 177.00 178.47 3d4g s VAL 452 N 3.42 3.23 0.09 -0.36 0.11 -0.55 -4.94 120.40 121.39 3d4g s VAL 452 Ca 0.33 0.87 0.12 0.00 -2.93 0.00 0.00 61.98 60.37 3d4g s VAL 452 Cb -0.12 -3.56 -0.04 0.00 -1.53 0.00 0.00 36.38 31.13 3d4g s VAL 452 CO 0.23 0.06 1.47 0.28 -3.33 0.00 0.00 175.10 173.81 3d4g h SER 453 N 6.86 0.00 -1.88 3.54 0.02 -2.00 -3.48 113.55 116.61 3d4g h SER 453 Ca -0.42 0.00 -0.45 0.00 -0.84 0.00 0.00 61.79 60.08 3d4g h SER 453 Cb 1.21 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.74 3d4g h SER 453 CO 0.87 0.68 -0.37 -0.83 -1.14 0.00 0.00 176.83 176.04 3d4g s GLY 454 N -4.53 1.55 0.19 -3.77 0.00 -1.26 -5.08 107.32 94.41 3d4g s GLY 454 Ca 0.01 -1.45 -0.30 0.00 0.00 0.00 0.00 44.72 42.98 3d4g s GLY 454 CO 0.77 -1.38 1.31 -2.27 0.00 0.00 0.00 173.10 171.52 3d4g s LEU 455 N -4.11 4.41 -0.44 0.66 2.96 -1.26 -5.00 118.68 115.90 3d4g s LEU 455 Ca 0.42 2.37 -0.12 0.00 -0.22 0.00 0.00 54.13 56.58 3d4g s LEU 455 Cb -0.09 -3.61 0.07 0.00 0.50 0.00 0.00 46.19 43.06 3d4g s LEU 455 CO 0.30 -0.53 0.32 -0.44 -1.32 0.00 0.00 176.35 174.68 3d4g s SER 456 N 0.43 5.90 0.00 3.68 0.01 -1.26 -4.99 113.70 117.47 3d4g s SER 456 Ca 0.57 -1.34 0.00 0.00 1.31 0.00 0.00 55.95 56.49 3d4g s SER 456 Cb -0.36 -2.09 0.00 0.00 0.21 0.00 0.00 66.02 63.78 3d4g s SER 456 CO 0.37 -0.57 0.00 -0.38 0.41 0.00 0.00 173.24 173.07 3d4g n ILE 457 N 5.07 0.00 -0.02 1.44 -0.00 -1.26 -4.97 119.36 119.61 3d4g n ILE 457 Ca -0.11 0.00 -0.01 0.00 -0.00 0.00 0.00 62.75 62.63 3d4g n ILE 457 Cb 0.44 -0.65 -0.00 0.00 -0.00 0.00 0.00 39.64 39.43 3d4g n ILE 457 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.55 176.48 3d4g h LEU 458 N 0.00 0.00 -9.86 1.39 3.38 -2.06 -3.46 115.31 104.70 3d4g h LEU 458 Ca 0.00 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.41 3d4g h LEU 458 Cb 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 3d4g h LEU 458 CO 0.00 0.22 -0.14 -0.13 0.09 0.00 0.00 178.44 178.48 3d4g s ARG 459 N -1.32 3.87 0.17 1.13 0.52 -1.26 -5.08 118.95 116.98 3d4g s ARG 459 Ca -0.03 0.34 -0.30 0.00 -0.52 0.00 0.00 55.73 55.22 3d4g s ARG 459 Cb 0.00 -2.89 -0.07 0.00 0.52 0.00 0.00 34.95 32.51 3d4g s ARG 459 CO 0.04 0.47 0.98 -0.08 0.02 0.00 0.00 175.30 176.72 3d4g s THR 460 N -1.53 4.24 -0.76 0.02 -1.32 -1.26 -4.96 115.64 110.07 3d4g s THR 460 Ca 0.39 2.01 0.25 0.00 -1.21 0.00 0.00 61.69 63.12 3d4g s THR 460 Cb -0.14 -4.28 0.26 0.00 -1.51 0.00 0.00 72.50 66.83 3d4g s THR 460 CO 0.19 0.38 1.77 0.59 -2.21 0.00 0.00 174.62 175.34 3d4g n ASN 461 N 2.22 0.55 -4.63 8.08 3.02 -1.26 -4.72 115.26 118.51 3d4g n ASN 461 Ca 0.01 0.57 -0.43 0.00 -0.03 0.00 0.00 54.58 54.70 3d4g n ASN 461 Cb 0.48 -0.71 -0.02 0.00 -0.61 0.00 0.00 39.78 38.92 3d4g n ASN 461 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 3d4g s ARG 462 N -3.12 4.02 -0.02 3.52 3.52 -1.26 -4.58 118.95 121.04 3d4g s ARG 462 Ca 0.10 1.01 0.04 0.00 -0.13 0.00 0.00 55.73 56.75 3d4g s ARG 462 Cb 0.13 -3.76 -0.01 0.00 -1.56 0.00 0.00 34.95 29.75 3d4g s ARG 462 CO 0.51 -0.97 -0.14 0.08 -0.81 0.00 0.00 175.30 173.98 3d4g s VAL 463 N 3.77 1.11 -0.04 7.11 1.01 -0.78 -4.98 120.40 127.59 3d4g s VAL 463 Ca 0.46 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.86 3d4g s VAL 463 Cb -0.12 -0.93 0.02 0.00 0.00 0.00 0.00 36.38 35.35 3d4g s VAL 463 CO 0.18 0.32 -0.02 -0.70 0.00 0.00 0.00 175.10 174.87 3d4g s GLU 464 N -0.22 0.56 0.06 2.72 2.12 -1.26 -0.01 118.70 122.68 3d4g s GLU 464 Ca 0.03 -0.00 0.06 0.00 0.36 0.00 0.00 54.97 55.41 3d4g s GLU 464 Cb -0.07 -0.68 -0.03 0.00 0.26 0.00 0.00 34.13 33.62 3d4g s GLU 464 CO -0.00 -0.12 -0.16 0.14 -0.54 0.00 0.00 175.26 174.58 3d4g s VAL 465 N 1.04 1.24 -0.01 3.70 -7.23 -0.03 -4.82 120.40 114.29 3d4g s VAL 465 Ca -0.09 -1.22 -0.30 0.00 -1.81 0.00 0.00 61.98 58.55 3d4g s VAL 465 Cb -0.14 -1.14 -0.04 0.00 0.56 0.00 0.00 36.38 35.62 3d4g s VAL 465 CO -0.01 -0.09 1.09 -2.16 -0.31 0.00 0.00 175.10 173.62 3d4g s PRO 466 N -1.51 4.46 -0.23 4.82 0.04 -1.26 -0.87 135.00 140.44 3d4g s PRO 466 Ca 0.01 1.57 -0.03 0.00 0.04 0.00 0.00 61.00 62.59 3d4g s PRO 466 Cb -0.09 -3.46 0.01 0.00 0.04 0.00 0.00 34.50 31.00 3d4g s PRO 466 CO 0.02 -0.23 -0.06 0.42 0.04 0.00 0.00 177.00 177.19 3d4g s ILE 467 N 1.42 3.10 -0.06 0.56 -1.09 0.17 -4.91 121.20 120.39 3d4g s ILE 467 Ca 0.54 -0.73 -0.04 0.00 -2.23 0.00 0.00 60.65 58.19 3d4g s ILE 467 Cb -0.24 -2.47 0.03 0.00 -1.58 0.00 0.00 42.46 38.20 3d4g s ILE 467 CO 0.26 0.34 0.15 -0.70 -1.23 0.00 0.00 174.94 173.76 3d4g s GLU 468 N 1.41 0.14 -0.04 2.79 2.12 -1.26 0.75 118.70 124.61 3d4g s GLU 468 Ca 0.04 0.28 0.05 0.00 0.36 0.00 0.00 54.97 55.70 3d4g s GLU 468 Cb -0.15 -0.03 -0.01 0.00 0.26 0.00 0.00 34.13 34.20 3d4g s GLU 468 CO -0.04 -0.08 -0.20 0.00 -0.54 0.00 0.00 175.26 174.39 3d4g s ARG 470 N -0.11 2.69 -0.11 0.00 0.52 -1.26 -0.30 118.95 120.38 3d4g s ARG 470 Ca -0.02 -0.73 0.03 0.00 -0.52 0.00 0.00 55.73 54.49 3d4g s ARG 470 Cb -0.12 -2.25 -0.00 0.00 0.52 0.00 0.00 34.95 33.10 3d4g s ARG 470 CO 0.02 -0.09 -0.22 0.71 0.02 0.00 0.00 175.30 175.75 3d4g s TYR 471 N 1.02 2.62 0.15 -0.53 2.02 -0.07 -4.95 117.35 117.61 3d4g s TYR 471 Ca -0.04 -1.01 -0.34 0.00 -0.37 0.00 0.00 57.07 55.32 3d4g s TYR 471 Cb -0.15 -1.75 -0.15 0.00 -0.40 0.00 0.00 41.96 39.51 3d4g s TYR 471 CO -0.05 -0.40 1.31 -2.30 -1.57 0.00 0.00 175.55 172.55 3d4g n PRO 472 N 3.59 1.42 -2.32 -1.71 -0.02 -1.26 -0.29 135.00 134.42 3d4g n PRO 472 Ca -0.19 0.51 -0.31 0.00 -2.02 0.00 0.00 63.50 61.49 3d4g n PRO 472 Cb 0.53 -2.12 -0.01 0.00 -0.02 0.00 0.00 33.50 31.88 3d4g n PRO 472 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3d4g s ARG 473 N 0.08 3.72 0.00 -0.52 0.52 0.25 -4.71 118.95 118.29 3d4g s ARG 473 Ca 0.77 0.67 0.00 0.00 -0.52 0.00 0.00 55.73 56.65 3d4g s ARG 473 Cb -0.83 -2.20 0.00 0.00 0.52 0.00 0.00 34.95 32.44 3d4g s ARG 473 CO 0.48 -0.33 0.00 1.28 0.02 0.00 0.00 175.30 176.75