#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3du8 s LYS 36 N 0.00 4.54 -0.07 4.33 2.20 -1.26 -5.05 119.74 124.42 3du8 s LYS 36 Ca 0.00 1.77 -0.01 0.00 -0.36 0.00 0.00 55.97 57.38 3du8 s LYS 36 Cb 0.00 -3.07 0.03 0.00 -1.51 0.00 0.00 37.83 33.28 3du8 s LYS 36 CO 0.00 0.13 -0.03 0.08 -0.36 0.00 0.00 175.35 175.17 3du8 s VAL 37 N -1.24 0.56 -0.22 4.02 1.01 -1.26 -4.37 120.40 118.90 3du8 s VAL 37 Ca 0.47 -0.02 -0.09 0.00 0.00 0.00 0.00 61.98 62.34 3du8 s VAL 37 Cb -0.31 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 3du8 s VAL 37 CO 0.39 0.28 0.10 -0.89 0.00 0.00 0.00 175.10 174.98 3du8 s THR 38 N 1.68 4.90 -0.15 3.92 2.01 -0.58 -4.94 115.64 122.47 3du8 s THR 38 Ca 0.01 0.02 -0.01 0.00 0.31 0.00 0.00 61.69 62.02 3du8 s THR 38 Cb -0.13 -3.26 -0.01 0.00 0.01 0.00 0.00 72.50 69.11 3du8 s THR 38 CO -0.05 0.39 -0.11 -0.89 -0.69 0.00 0.00 174.62 173.27 3du8 s THR 39 N 0.91 3.16 0.32 -0.82 2.01 -1.26 -1.72 115.64 118.24 3du8 s THR 39 Ca 0.05 -0.61 0.06 0.00 0.31 0.00 0.00 61.69 61.50 3du8 s THR 39 Cb -0.13 -2.35 -0.06 0.00 0.01 0.00 0.00 72.50 69.96 3du8 s THR 39 CO 0.03 0.50 -0.01 0.68 -0.69 0.00 0.00 174.62 175.13 3du8 s VAL 40 N 0.59 1.61 -0.21 3.82 -7.23 -0.35 -4.97 120.40 113.65 3du8 s VAL 40 Ca -0.07 -2.07 -0.03 0.00 -1.81 0.00 0.00 61.98 58.01 3du8 s VAL 40 Cb -0.15 -2.67 -0.00 0.00 0.56 0.00 0.00 36.38 34.11 3du8 s VAL 40 CO 0.03 -0.14 -0.08 -0.69 -0.31 0.00 0.00 175.10 173.91 3du8 s VAL 41 N -3.02 3.06 -0.03 1.32 1.01 -1.26 -1.20 120.40 120.28 3du8 s VAL 41 Ca 0.33 -0.62 0.06 0.00 0.00 0.00 0.00 61.98 61.75 3du8 s VAL 41 Cb 0.06 -2.38 -0.01 0.00 0.00 0.00 0.00 36.38 34.05 3du8 s VAL 41 CO 0.14 0.44 -0.20 0.00 0.00 0.00 0.00 175.10 175.48 3du8 s ALA 42 N 1.43 1.74 0.10 5.51 0.00 0.13 -4.80 121.76 125.86 3du8 s ALA 42 Ca 0.05 -0.87 -0.30 0.00 0.00 0.00 0.00 51.96 50.84 3du8 s ALA 42 Cb -0.14 -0.49 -0.06 0.00 0.00 0.00 0.00 23.12 22.43 3du8 s ALA 42 CO -0.06 0.39 1.10 0.99 0.00 0.00 0.00 175.76 178.19 3du8 s THR 43 N -0.32 4.15 0.54 0.00 2.01 -0.44 -0.89 115.64 120.69 3du8 s THR 43 Ca 0.04 1.67 -0.22 0.00 0.31 0.00 0.00 61.69 63.49 3du8 s THR 43 Cb -0.10 -4.07 -0.05 0.00 0.01 0.00 0.00 72.50 68.29 3du8 s THR 43 CO 0.01 0.20 1.37 -2.84 -0.69 0.00 0.00 174.62 172.67 3du8 s PRO 44 N 0.40 3.17 0.19 4.92 0.02 -1.26 -0.74 135.00 141.70 3du8 s PRO 44 Ca 0.53 2.27 -0.13 0.00 0.02 0.00 0.00 61.00 63.69 3du8 s PRO 44 Cb -0.27 -2.29 0.19 0.00 0.02 0.00 0.00 34.50 32.14 3du8 s PRO 44 CO 0.31 -1.17 1.71 0.78 -0.33 0.00 0.00 177.00 178.30 3du8 h GLY 45 N 1.52 0.58 -2.70 0.52 0.00 0.56 -3.44 103.07 100.12 3du8 h GLY 45 Ca -0.51 -0.01 -0.54 0.00 0.00 0.00 0.00 47.33 46.27 3du8 h GLY 45 CO 0.57 -0.08 -0.76 -0.86 0.00 0.00 0.00 176.54 175.41 3du8 s GLN 46 N -6.14 1.44 0.37 4.80 0.00 -1.26 -4.56 119.66 114.32 3du8 s GLN 46 Ca -0.13 -1.59 0.00 0.00 -0.00 0.00 0.00 55.36 53.63 3du8 s GLN 46 Cb 0.15 -1.45 0.00 0.00 0.00 0.00 0.00 33.01 31.71 3du8 s GLN 46 CO 0.73 0.27 0.00 0.41 0.00 0.00 0.00 175.29 176.70 3du8 n GLY 47 N -0.22 -1.80 3.80 2.60 0.00 -1.26 -4.97 105.19 103.35 3du8 n GLY 47 Ca -0.09 -1.85 -0.31 0.00 0.00 0.00 0.00 46.02 43.77 3du8 n GLY 47 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3du8 s PRO 48 N 0.00 2.64 -1.00 1.61 0.04 -1.26 -4.94 135.00 132.09 3du8 s PRO 48 Ca 0.00 0.96 -0.23 0.00 0.04 0.00 0.00 61.00 61.76 3du8 s PRO 48 Cb 0.00 -1.96 0.03 0.00 0.04 0.00 0.00 34.50 32.61 3du8 s PRO 48 CO 0.00 -1.31 1.57 0.34 0.04 0.00 0.00 177.00 177.64 3du8 s ASP 49 N -3.72 6.19 -0.39 6.66 -1.08 -1.26 -4.80 116.67 118.27 3du8 s ASP 49 Ca 0.59 -1.29 0.04 0.00 -0.52 0.00 0.00 52.55 51.36 3du8 s ASP 49 Cb -0.15 -2.57 0.11 0.00 -1.46 0.00 0.00 42.92 38.85 3du8 s ASP 49 CO 0.55 -1.79 0.11 -0.13 0.52 0.00 0.00 175.17 174.43 3du8 s ARG 50 N 5.43 1.63 0.50 4.34 1.81 -1.26 -5.07 118.95 126.33 3du8 s ARG 50 Ca 0.52 -2.07 -0.23 0.00 -1.72 0.00 0.00 55.73 52.23 3du8 s ARG 50 Cb -0.01 -3.25 -0.06 0.00 -0.45 0.00 0.00 34.95 31.17 3du8 s ARG 50 CO -0.07 -0.99 1.37 -2.14 -0.68 0.00 0.00 175.30 172.79 3du8 s PRO 51 N 0.60 3.42 0.23 3.54 0.02 -1.26 -4.52 135.00 137.04 3du8 s PRO 51 Ca 0.12 2.27 0.00 0.00 0.02 0.00 0.00 61.00 63.42 3du8 s PRO 51 Cb -0.21 -2.44 -0.05 0.00 0.02 0.00 0.00 34.50 31.82 3du8 s PRO 51 CO -0.06 -0.98 0.10 1.14 -0.33 0.00 0.00 177.00 176.88 3du8 s GLN 52 N -2.69 1.30 -0.24 5.54 -2.07 -0.07 -4.93 119.66 116.51 3du8 s GLN 52 Ca 0.66 -1.69 -0.06 0.00 -1.82 0.00 0.00 55.36 52.45 3du8 s GLN 52 Cb -0.41 -0.05 -0.02 0.00 -1.09 0.00 0.00 33.01 31.43 3du8 s GLN 52 CO 0.50 -0.32 0.04 -2.00 -1.32 0.00 0.00 175.29 172.19 3du8 s GLU 53 N -4.07 3.60 -0.10 9.60 2.12 -1.26 0.18 118.70 128.76 3du8 s GLU 53 Ca 0.37 -0.51 0.02 0.00 0.36 0.00 0.00 54.97 55.22 3du8 s GLU 53 Cb 0.07 -3.23 0.01 0.00 0.26 0.00 0.00 34.13 31.25 3du8 s GLU 53 CO 0.12 -0.15 -0.17 0.08 -0.54 0.00 0.00 175.26 174.60 3du8 s VAL 54 N 1.47 1.63 -0.08 3.70 1.01 -0.34 -4.97 120.40 122.82 3du8 s VAL 54 Ca 0.06 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.34 3du8 s VAL 54 Cb -0.15 -1.46 -0.01 0.00 0.00 0.00 0.00 36.38 34.76 3du8 s VAL 54 CO 0.02 0.47 -0.21 -0.44 0.00 0.00 0.00 175.10 174.93 3du8 s SER 55 N 0.79 3.38 0.06 3.32 0.01 -1.26 -1.22 113.70 118.79 3du8 s SER 55 Ca -0.10 -0.45 -0.08 0.00 1.31 0.00 0.00 55.95 56.63 3du8 s SER 55 Cb -0.16 -1.14 -0.00 0.00 0.21 0.00 0.00 66.02 64.92 3du8 s SER 55 CO 0.01 0.22 0.16 -0.72 0.41 0.00 0.00 173.24 173.32 3du8 s TYR 56 N 0.00 0.16 0.07 2.43 -0.85 -0.70 -0.96 117.35 117.50 3du8 s TYR 56 Ca -0.07 -0.52 0.01 0.00 -0.52 0.00 0.00 57.07 55.97 3du8 s TYR 56 Cb -0.15 -0.09 -0.00 0.00 0.38 0.00 0.00 41.96 42.10 3du8 s TYR 56 CO 0.05 -0.47 0.04 -2.37 -1.52 0.00 0.00 175.55 171.28 3du8 n THR 57 N 0.32 0.00 -4.02 -3.49 5.66 0.30 -1.53 114.28 111.52 3du8 n THR 57 Ca -0.17 -0.46 -0.33 0.00 -3.05 0.00 0.00 64.05 60.05 3du8 n THR 57 Cb 0.61 0.19 -0.04 0.00 -1.55 0.00 0.00 70.33 69.54 3du8 n THR 57 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 3du8 n ASP 58 N -2.23 -2.74 -4.76 1.09 8.00 -1.26 -1.82 116.55 112.83 3du8 n ASP 58 Ca -0.00 -0.84 -0.40 0.00 0.71 0.00 0.00 54.79 54.27 3du8 n ASP 58 Cb 0.12 -2.30 0.02 0.00 -0.02 0.00 0.00 41.12 38.94 3du8 n ASP 58 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3du8 s THR 59 N -3.09 2.12 -0.21 -3.53 2.01 -1.26 -4.49 115.64 107.19 3du8 s THR 59 Ca 0.65 0.10 -0.27 0.00 0.31 0.00 0.00 61.69 62.48 3du8 s THR 59 Cb -0.36 -3.06 0.09 0.00 0.01 0.00 0.00 72.50 69.18 3du8 s THR 59 CO 0.80 0.01 0.81 -1.59 -0.69 0.00 0.00 174.62 173.96 3du8 s LYS 60 N -2.51 0.79 0.22 4.92 -2.85 0.03 -4.98 119.74 115.37 3du8 s LYS 60 Ca 0.62 0.66 -0.30 0.00 -1.00 0.00 0.00 55.97 55.96 3du8 s LYS 60 Cb -0.43 0.38 -0.09 0.00 -2.06 0.00 0.00 37.83 35.63 3du8 s LYS 60 CO 0.54 -0.15 1.33 0.08 0.10 0.00 0.00 175.35 177.26 3du8 s VAL 61 N -0.15 3.05 0.00 1.79 1.01 -1.26 0.50 120.40 125.35 3du8 s VAL 61 Ca -0.02 0.89 0.00 0.00 0.00 0.00 0.00 61.98 62.85 3du8 s VAL 61 Cb -0.03 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.78 3du8 s VAL 61 CO 0.01 0.14 0.08 2.30 0.00 0.00 0.00 175.10 177.63 3du8 n ILE 62 N 2.38 0.00 -3.59 2.22 -5.35 0.14 -4.79 119.36 110.37 3du8 n ILE 62 Ca 0.06 -0.40 -0.12 0.00 -0.27 0.00 0.00 62.75 62.02 3du8 n ILE 62 Cb 0.42 1.04 -0.06 0.00 -1.74 0.00 0.00 39.64 39.30 3du8 n ILE 62 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3du8 s GLY 63 N -0.64 -0.30 0.00 3.28 0.00 -0.96 -4.97 107.32 103.73 3du8 s GLY 63 Ca 0.00 2.11 0.00 0.00 0.00 0.00 0.00 44.72 46.83 3du8 s GLY 63 CO 0.00 1.31 0.38 -2.01 0.00 0.00 0.00 173.10 172.79 3du8 n ASN 64 N 1.35 0.00 -3.93 1.64 2.85 -1.26 -0.80 115.26 115.11 3du8 n ASN 64 Ca -0.13 -1.00 0.00 0.00 -0.11 0.00 0.00 54.58 53.34 3du8 n ASN 64 Cb 0.57 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.59 3du8 n ASN 64 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3du8 n GLY 65 N 0.00 -2.98 0.27 8.20 0.00 -1.23 -4.75 105.19 104.71 3du8 n GLY 65 Ca 0.00 -1.11 -0.09 0.00 0.00 0.00 0.00 46.02 44.83 3du8 n GLY 65 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3du8 h SER 66 N 0.00 -0.75 -0.98 1.61 0.02 -2.04 -3.09 113.55 108.33 3du8 h SER 66 Ca 0.00 0.13 0.18 0.00 -0.84 0.00 0.00 61.79 61.26 3du8 h SER 66 Cb 0.00 0.35 -0.10 0.00 0.14 0.00 0.00 62.40 62.78 3du8 h SER 66 CO 0.00 -0.28 0.58 2.19 -1.14 0.00 0.00 176.83 178.19 3du8 h PHE 67 N -0.26 1.02 0.00 3.45 -5.15 -1.97 -3.49 116.94 110.55 3du8 h PHE 67 Ca 0.13 0.03 0.00 0.00 -0.20 0.00 0.00 57.97 57.93 3du8 h PHE 67 Cb 0.45 -0.30 0.00 0.00 0.22 0.00 0.00 35.95 36.31 3du8 h PHE 67 CO -0.37 0.24 0.00 0.41 -2.00 0.00 0.00 178.31 176.58 3du8 n GLY 68 N -1.33 0.22 3.39 6.09 0.00 -1.17 -4.44 105.19 107.95 3du8 n GLY 68 Ca 0.22 -1.09 -0.31 0.00 0.00 0.00 0.00 46.02 44.84 3du8 n GLY 68 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3du8 s VAL 69 N -4.00 2.41 -0.26 1.61 1.01 -0.78 -3.49 120.40 116.90 3du8 s VAL 69 Ca 0.00 -1.27 -0.05 0.00 0.00 0.00 0.00 61.98 60.66 3du8 s VAL 69 Cb 0.00 -1.96 0.01 0.00 0.00 0.00 0.00 36.38 34.43 3du8 s VAL 69 CO 0.00 0.38 0.01 -0.69 0.00 0.00 0.00 175.10 174.80 3du8 s VAL 70 N -0.83 3.53 0.16 2.92 1.01 0.02 -0.01 120.40 127.20 3du8 s VAL 70 Ca 0.13 -0.69 -0.01 0.00 0.00 0.00 0.00 61.98 61.41 3du8 s VAL 70 Cb -0.10 -2.75 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 3du8 s VAL 70 CO 0.03 0.23 0.34 -0.31 0.00 0.00 0.00 175.10 175.39 3du8 s TYR 71 N 1.46 3.49 -0.07 5.22 1.51 -0.03 0.25 117.35 129.18 3du8 s TYR 71 Ca 0.03 0.34 -0.07 0.00 -1.01 0.00 0.00 57.07 56.37 3du8 s TYR 71 Cb -0.16 -1.84 -0.04 0.00 -0.11 0.00 0.00 41.96 39.80 3du8 s TYR 71 CO -0.01 0.45 0.19 -1.14 -1.11 0.00 0.00 175.55 173.92 3du8 s GLN 72 N -3.03 3.49 0.04 -0.62 0.74 0.18 -0.82 119.66 119.65 3du8 s GLN 72 Ca 0.38 -0.12 0.00 0.00 0.05 0.00 0.00 55.36 55.67 3du8 s GLN 72 Cb -0.12 -3.16 -0.03 0.00 1.10 0.00 0.00 33.01 30.81 3du8 s GLN 72 CO 0.28 0.73 -0.04 0.00 -0.55 0.00 0.00 175.29 175.71 3du8 s ALA 73 N -1.13 0.40 -0.26 1.58 0.00 -0.89 -0.79 121.76 120.68 3du8 s ALA 73 Ca 0.20 -0.88 -0.08 0.00 0.00 0.00 0.00 51.96 51.20 3du8 s ALA 73 Cb -0.13 0.17 -0.03 0.00 0.00 0.00 0.00 23.12 23.13 3du8 s ALA 73 CO 0.09 -0.20 0.09 0.21 0.00 0.00 0.00 175.76 175.95 3du8 s LYS 74 N -2.44 3.69 0.11 0.00 2.20 -0.76 -1.03 119.74 121.52 3du8 s LYS 74 Ca -0.05 -0.46 -0.31 0.00 -0.36 0.00 0.00 55.97 54.79 3du8 s LYS 74 Cb -0.03 -3.38 -0.09 0.00 -1.51 0.00 0.00 37.83 32.82 3du8 s LYS 74 CO -0.04 -0.19 1.58 -0.51 -0.36 0.00 0.00 175.35 175.83 3du8 s LEU 75 N 1.64 4.37 0.24 5.43 1.43 -0.09 -0.54 118.68 131.16 3du8 s LEU 75 Ca 0.06 2.51 -0.05 0.00 -1.03 0.00 0.00 54.13 55.63 3du8 s LEU 75 Cb -0.15 -3.58 0.38 0.00 0.03 0.00 0.00 46.19 42.87 3du8 s LEU 75 CO 0.05 -0.83 1.81 0.00 0.23 0.00 0.00 176.35 177.60 3du8 h ASP 77 N 0.76 -0.12 0.87 0.00 3.32 -1.92 -3.35 116.42 115.99 3du8 h ASP 77 Ca 0.39 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.44 3du8 h ASP 77 Cb 0.35 0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.94 3du8 h ASP 77 CO -0.25 0.16 -0.08 -1.54 -1.72 0.00 0.00 179.24 175.81 3du8 n SER 78 N -3.75 0.09 0.00 6.45 3.41 -1.25 -4.89 113.62 113.68 3du8 n SER 78 Ca -0.02 0.30 0.00 0.00 -0.26 0.00 0.00 58.87 58.90 3du8 n SER 78 Cb 0.06 -0.35 0.00 0.00 -0.26 0.00 0.00 64.21 63.65 3du8 n SER 78 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3du8 n GLY 79 N 1.48 0.19 3.73 5.00 0.00 -0.19 -4.99 105.19 110.41 3du8 n GLY 79 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 3du8 n GLY 79 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3du8 s GLU 80 N -1.23 4.36 0.14 1.61 2.02 -1.24 -4.57 118.70 119.79 3du8 s GLU 80 Ca 0.00 2.08 -0.30 0.00 0.02 0.00 0.00 54.97 56.77 3du8 s GLU 80 Cb 0.00 -3.19 -0.07 0.00 0.10 0.00 0.00 34.13 30.97 3du8 s GLU 80 CO 0.00 -0.30 1.07 -0.51 0.02 0.00 0.00 175.26 175.54 3du8 s LEU 81 N 0.05 4.47 0.23 1.80 1.43 -1.26 -0.91 118.68 124.50 3du8 s LEU 81 Ca 0.58 1.98 0.05 0.00 -1.03 0.00 0.00 54.13 55.71 3du8 s LEU 81 Cb -0.37 -3.60 -0.05 0.00 0.03 0.00 0.00 46.19 42.20 3du8 s LEU 81 CO 0.37 -0.21 -0.04 0.68 0.23 0.00 0.00 176.35 177.39 3du8 s VAL 82 N 0.01 1.28 -0.04 -1.59 -7.23 -0.19 -3.02 120.40 109.61 3du8 s VAL 82 Ca 0.50 -2.07 0.03 0.00 -1.81 0.00 0.00 61.98 58.62 3du8 s VAL 82 Cb -0.27 -2.30 -0.03 0.00 0.56 0.00 0.00 36.38 34.34 3du8 s VAL 82 CO 0.33 -0.39 -0.12 0.00 -0.31 0.00 0.00 175.10 174.61 3du8 s ALA 83 N -3.26 2.79 -0.26 1.32 0.00 -0.06 -2.09 121.76 120.20 3du8 s ALA 83 Ca 0.27 -0.98 0.02 0.00 0.00 0.00 0.00 51.96 51.27 3du8 s ALA 83 Cb 0.04 -1.04 0.06 0.00 0.00 0.00 0.00 23.12 22.19 3du8 s ALA 83 CO 0.08 0.57 -0.07 0.42 0.00 0.00 0.00 175.76 176.76 3du8 s ILE 84 N -0.81 1.93 -0.45 0.00 1.01 0.00 -0.49 121.20 122.39 3du8 s ILE 84 Ca 0.13 -1.56 -0.27 0.00 0.00 0.00 0.00 60.65 58.96 3du8 s ILE 84 Cb -0.11 -2.14 0.03 0.00 0.01 0.00 0.00 42.46 40.25 3du8 s ILE 84 CO 0.02 -0.12 0.99 -0.75 0.00 0.00 0.00 174.94 175.08 3du8 s LYS 85 N 1.20 3.63 -0.26 2.79 2.20 -0.13 -0.85 119.74 128.32 3du8 s LYS 85 Ca -0.06 0.33 -0.10 0.00 -0.36 0.00 0.00 55.97 55.79 3du8 s LYS 85 Cb -0.19 -3.91 -0.04 0.00 -1.51 0.00 0.00 37.83 32.18 3du8 s LYS 85 CO -0.06 -1.23 0.14 0.21 -0.36 0.00 0.00 175.35 174.05 3du8 s LYS 86 N 3.92 3.89 0.07 4.03 2.20 0.99 -0.53 119.74 134.31 3du8 s LYS 86 Ca 0.40 -0.36 0.03 0.00 -0.36 0.00 0.00 55.97 55.69 3du8 s LYS 86 Cb -0.09 -3.52 -0.03 0.00 -1.51 0.00 0.00 37.83 32.67 3du8 s LYS 86 CO 0.27 -0.12 -0.10 0.08 -0.36 0.00 0.00 175.35 175.12 3du8 s VAL 87 N 1.54 0.81 0.05 4.02 1.01 -0.04 -1.87 120.40 125.93 3du8 s VAL 87 Ca 0.07 -1.40 -0.30 0.00 0.00 0.00 0.00 61.98 60.34 3du8 s VAL 87 Cb -0.15 -1.07 -0.05 0.00 0.00 0.00 0.00 36.38 35.12 3du8 s VAL 87 CO 0.07 -0.46 1.08 -0.22 0.00 0.00 0.00 175.10 175.58 3du8 s LEU 88 N -2.05 4.39 -0.26 3.92 2.96 -1.26 -0.10 118.68 126.27 3du8 s LEU 88 Ca -0.01 1.85 -0.16 0.00 -0.22 0.00 0.00 54.13 55.59 3du8 s LEU 88 Cb -0.06 -3.58 -0.03 0.00 0.50 0.00 0.00 46.19 43.02 3du8 s LEU 88 CO 0.00 -0.33 0.44 -1.58 -1.32 0.00 0.00 176.35 173.57 3du8 s GLN 89 N 0.84 4.04 0.32 1.98 2.00 -0.63 -4.79 119.66 123.43 3du8 s GLN 89 Ca 0.54 0.18 -0.29 0.00 -2.00 0.00 0.00 55.36 53.79 3du8 s GLN 89 Cb -0.25 -3.65 -0.12 0.00 0.80 0.00 0.00 33.01 29.79 3du8 s GLN 89 CO 0.29 -0.31 1.51 -3.47 -0.50 0.00 0.00 175.29 172.81 3du8 n ASP 90 N 5.42 3.62 0.09 6.67 -0.08 -1.26 -4.87 116.55 126.13 3du8 n ASP 90 Ca -0.06 1.18 -0.16 0.00 -1.51 0.00 0.00 54.79 54.24 3du8 n ASP 90 Cb 0.50 -1.58 -0.09 0.00 2.34 0.00 0.00 41.12 42.29 3du8 n ASP 90 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 3du8 h LYS 91 N 3.87 0.40 0.18 -0.67 1.79 -1.97 -3.36 116.57 116.81 3du8 h LYS 91 Ca -0.48 -0.52 -0.01 0.00 -2.18 0.00 0.00 60.65 57.46 3du8 h LYS 91 Cb 1.24 0.17 0.00 0.00 -1.58 0.00 0.00 32.23 32.06 3du8 h LYS 91 CO 0.72 1.20 -0.08 0.00 -1.08 0.00 0.00 179.45 180.20 3du8 h ARG 92 N 0.18 -0.23 -6.39 3.15 2.47 -2.05 -3.47 114.38 108.05 3du8 h ARG 92 Ca -0.12 0.02 -0.62 0.00 -1.26 0.00 0.00 59.98 58.00 3du8 h ARG 92 Cb 1.78 0.05 -0.12 0.00 -1.65 0.00 0.00 29.97 30.03 3du8 h ARG 92 CO 0.19 0.14 -0.68 -0.06 0.56 0.00 0.00 179.97 180.12 3du8 s PHE 93 N -4.39 2.80 0.42 3.04 0.40 -1.26 -5.12 117.98 113.86 3du8 s PHE 93 Ca -0.14 -0.15 -0.25 0.00 -0.60 0.00 0.00 56.93 55.79 3du8 s PHE 93 Cb 0.02 -1.37 -0.08 0.00 0.51 0.00 0.00 43.02 42.09 3du8 s PHE 93 CO 0.57 0.50 1.20 0.21 0.70 0.00 0.00 175.22 178.41 3du8 s LYS 94 N -2.79 3.94 -0.28 0.44 2.47 -1.26 -4.58 119.74 117.68 3du8 s LYS 94 Ca 0.26 1.91 -0.29 0.00 -1.56 0.00 0.00 55.97 56.29 3du8 s LYS 94 Cb -0.10 -2.62 -0.02 0.00 -1.46 0.00 0.00 37.83 33.63 3du8 s LYS 94 CO 0.17 -0.43 1.64 1.21 0.16 0.00 0.00 175.35 178.10 3du8 s ASN 95 N -1.09 6.23 0.37 1.43 3.84 -1.26 -4.91 114.94 119.54 3du8 s ASN 95 Ca 0.59 1.40 0.08 0.00 0.21 0.00 0.00 52.86 55.14 3du8 s ASN 95 Cb -0.32 -2.53 0.81 0.00 -0.55 0.00 0.00 41.25 38.66 3du8 s ASN 95 CO 0.40 -1.42 1.91 -0.09 -2.79 0.00 0.00 177.10 175.11 3du8 h ARG 96 N 11.36 0.67 -0.01 0.43 2.43 -1.97 -2.24 114.38 125.04 3du8 h ARG 96 Ca -0.33 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 58.79 3du8 h ARG 96 Cb 1.15 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.55 3du8 h ARG 96 CO 1.02 0.44 -0.03 1.49 -1.51 0.00 0.00 179.97 181.39 3du8 h GLU 97 N 0.69 0.04 -0.40 0.20 4.81 -1.90 -1.37 114.58 116.66 3du8 h GLU 97 Ca 0.38 -0.03 0.08 0.00 -0.13 0.00 0.00 59.36 59.67 3du8 h GLU 97 Cb 0.55 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 29.84 3du8 h GLU 97 CO -0.15 0.61 -0.31 1.25 -0.73 0.00 0.00 179.01 179.67 3du8 h LEU 98 N -0.51 -1.03 -1.24 1.64 5.85 -1.89 -0.77 115.31 117.36 3du8 h LEU 98 Ca 0.00 0.19 -0.07 0.00 0.84 0.00 0.00 57.88 58.84 3du8 h LEU 98 Cb 0.61 0.49 -0.01 0.00 0.37 0.00 0.00 40.66 42.11 3du8 h LEU 98 CO 0.01 -0.31 -0.22 1.56 -0.34 0.00 0.00 178.44 179.13 3du8 h GLN 99 N -0.24 0.25 -0.15 1.25 1.08 -1.29 -0.39 115.11 115.62 3du8 h GLN 99 Ca 0.18 -0.08 -0.11 0.00 -1.45 0.00 0.00 58.65 57.19 3du8 h GLN 99 Cb 0.53 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.93 3du8 h GLN 99 CO -0.53 0.46 -0.35 0.82 -0.95 0.00 0.00 178.83 178.28 3du8 h ILE 100 N 0.23 1.36 0.00 2.54 2.04 -1.08 -3.31 117.51 119.28 3du8 h ILE 100 Ca 0.04 -1.62 -0.06 0.00 1.00 0.00 0.00 64.86 64.22 3du8 h ILE 100 Cb 0.52 2.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.59 3du8 h ILE 100 CO 0.04 0.49 -0.30 0.24 0.00 0.00 0.00 178.15 178.61 3du8 h MET 101 N 0.13 0.00 0.00 2.37 2.86 -0.31 -2.02 114.93 117.96 3du8 h MET 101 Ca -0.00 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 3du8 h MET 101 Cb 0.95 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.61 3du8 h MET 101 CO 0.08 0.30 -0.14 0.00 1.06 0.00 0.00 176.91 178.21 3du8 h ARG 102 N 0.00 0.00 -0.00 1.72 3.08 -1.19 -3.02 114.38 114.96 3du8 h ARG 102 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3du8 h ARG 102 Cb 0.82 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.87 3du8 h ARG 102 CO 0.04 0.14 -0.09 1.63 -1.07 0.00 0.00 179.97 180.62 3du8 n LYS 103 N -3.48 0.51 -4.70 0.04 5.02 -0.76 -4.74 118.16 110.05 3du8 n LYS 103 Ca -0.01 -0.13 -0.33 0.00 -2.02 0.00 0.00 58.31 55.82 3du8 n LYS 103 Cb 0.30 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 33.69 3du8 n LYS 103 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3du8 s LEU 104 N -2.58 2.95 -0.28 -0.35 1.43 -1.14 -5.06 118.68 113.65 3du8 s LEU 104 Ca 0.26 -0.16 -0.00 0.00 -1.03 0.00 0.00 54.13 53.20 3du8 s LEU 104 Cb 0.20 -1.65 0.14 0.00 0.03 0.00 0.00 46.19 44.92 3du8 s LEU 104 CO 0.49 0.28 0.36 -0.62 0.23 0.00 0.00 176.35 177.09 3du8 s ASP 105 N -0.33 0.83 -0.13 2.29 3.68 -1.26 -4.90 116.67 116.83 3du8 s ASP 105 Ca 0.04 -0.37 -0.25 0.00 2.13 0.00 0.00 52.55 54.10 3du8 s ASP 105 Cb -0.13 0.88 0.06 0.00 -1.45 0.00 0.00 42.92 42.28 3du8 s ASP 105 CO 0.02 -0.35 0.62 -2.28 0.13 0.00 0.00 175.17 173.31 3du8 s HIS 106 N 2.47 -0.62 -0.45 -5.34 2.46 -1.26 -5.05 115.29 107.49 3du8 s HIS 106 Ca 0.10 1.30 0.26 0.00 0.47 0.00 0.00 55.06 57.19 3du8 s HIS 106 Cb -0.14 0.30 0.93 0.00 -0.13 0.00 0.00 32.58 33.54 3du8 s HIS 106 CO -0.27 -0.46 1.77 0.00 -2.47 0.00 0.00 174.74 173.30 3du8 n ASN 108 N -2.47 4.81 -4.04 0.00 3.02 -1.26 -4.78 115.26 110.53 3du8 n ASN 108 Ca 0.03 -3.10 -0.23 0.00 -0.03 0.00 0.00 54.58 51.25 3du8 n ASN 108 Cb 0.33 -0.67 -0.16 0.00 -0.61 0.00 0.00 39.78 38.67 3du8 n ASN 108 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3du8 s ILE 109 N -2.89 1.04 0.32 2.41 1.01 -1.05 -0.42 121.20 121.62 3du8 s ILE 109 Ca 0.51 -0.48 -0.29 0.00 0.00 0.00 0.00 60.65 60.39 3du8 s ILE 109 Cb 0.41 -0.92 -0.12 0.00 0.01 0.00 0.00 42.46 41.83 3du8 s ILE 109 CO 0.12 0.32 1.36 1.33 0.00 0.00 0.00 174.94 178.07 3du8 n VAL 110 N 3.37 1.68 -3.01 2.92 0.24 -0.64 -4.70 118.33 118.19 3du8 n VAL 110 Ca -0.19 -0.42 -0.40 0.00 -2.04 0.00 0.00 64.34 61.28 3du8 n VAL 110 Cb 0.53 -1.63 -0.05 0.00 -1.47 0.00 0.00 33.84 31.23 3du8 n VAL 110 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3du8 s ARG 111 N -1.45 4.35 -0.58 7.34 3.52 -1.26 -4.95 118.95 125.93 3du8 s ARG 111 Ca 0.59 0.88 -0.27 0.00 -0.13 0.00 0.00 55.73 56.79 3du8 s ARG 111 Cb -0.57 -3.51 0.00 0.00 -1.56 0.00 0.00 34.95 29.32 3du8 s ARG 111 CO 0.58 -0.11 1.54 -1.17 -0.81 0.00 0.00 175.30 175.33 3du8 s LEU 112 N 1.41 3.35 -0.04 -0.88 2.96 -1.26 -2.27 118.68 121.94 3du8 s LEU 112 Ca 0.36 0.29 -0.17 0.00 -0.22 0.00 0.00 54.13 54.39 3du8 s LEU 112 Cb -0.17 -2.90 -0.11 0.00 0.50 0.00 0.00 46.19 43.51 3du8 s LEU 112 CO 0.15 -1.89 0.70 0.03 -1.32 0.00 0.00 176.35 174.02 3du8 h ARG 113 N 12.02 -0.40 -4.10 1.98 3.08 -0.19 -3.31 114.38 123.47 3du8 h ARG 113 Ca -0.27 0.03 -0.11 0.00 0.07 0.00 0.00 59.98 59.69 3du8 h ARG 113 Cb 1.11 0.09 -0.15 0.00 0.08 0.00 0.00 29.97 31.10 3du8 h ARG 113 CO 1.19 -0.14 -0.59 0.71 -1.07 0.00 0.00 179.97 180.06 3du8 s TYR 114 N -3.32 0.40 0.07 3.04 1.51 -1.07 0.10 117.35 118.08 3du8 s TYR 114 Ca -0.09 -0.90 0.01 0.00 -1.01 0.00 0.00 57.07 55.09 3du8 s TYR 114 Cb 0.01 -0.29 -0.03 0.00 -0.11 0.00 0.00 41.96 41.54 3du8 s TYR 114 CO 0.31 -0.41 -0.06 -0.59 -1.11 0.00 0.00 175.55 173.69 3du8 s PHE 115 N -3.74 0.73 0.15 2.71 -0.12 0.08 -0.42 117.98 117.36 3du8 s PHE 115 Ca 0.05 -0.76 -0.22 0.00 -0.05 0.00 0.00 56.93 55.95 3du8 s PHE 115 Cb 0.06 -0.44 0.07 0.00 -0.63 0.00 0.00 43.02 42.08 3du8 s PHE 115 CO -0.10 -0.15 0.58 -0.59 -0.05 0.00 0.00 175.22 174.91 3du8 s PHE 116 N -2.70 -0.50 0.14 3.49 -0.12 -0.77 -1.32 117.98 116.19 3du8 s PHE 116 Ca 0.02 0.30 -0.02 0.00 -0.05 0.00 0.00 56.93 57.18 3du8 s PHE 116 Cb -0.01 0.51 -0.05 0.00 -0.63 0.00 0.00 43.02 42.85 3du8 s PHE 116 CO -0.03 -0.82 0.33 0.71 -0.05 0.00 0.00 175.22 175.36 3du8 s TYR 117 N -3.65 3.49 0.30 3.49 1.51 -1.26 -0.80 117.35 120.42 3du8 s TYR 117 Ca 0.01 0.40 -0.11 0.00 -1.01 0.00 0.00 57.07 56.36 3du8 s TYR 117 Cb -0.01 -1.88 0.01 0.00 -0.11 0.00 0.00 41.96 39.97 3du8 s TYR 117 CO -0.12 0.46 0.54 -1.54 -1.11 0.00 0.00 175.55 173.79 3du8 s SER 118 N -2.68 0.20 -0.07 2.29 1.04 -0.72 -4.98 113.70 108.78 3du8 s SER 118 Ca 0.38 -1.11 0.03 0.00 0.48 0.00 0.00 55.95 55.74 3du8 s SER 118 Cb -0.12 0.66 -0.02 0.00 0.10 0.00 0.00 66.02 66.64 3du8 s SER 118 CO 0.27 -1.29 -0.18 -0.44 0.98 0.00 0.00 173.24 172.58 3du8 s SER 119 N -3.08 3.70 -0.22 7.02 0.01 -1.26 0.27 113.70 120.14 3du8 s SER 119 Ca 0.23 -0.34 -0.19 0.00 1.31 0.00 0.00 55.95 56.96 3du8 s SER 119 Cb -0.02 -1.05 -0.03 0.00 0.21 0.00 0.00 66.02 65.14 3du8 s SER 119 CO 0.13 0.26 0.53 -0.69 0.41 0.00 0.00 173.24 173.88 3du8 s VAL 126 N -0.25 5.08 0.05 3.43 1.01 -1.26 -5.14 120.40 123.33 3du8 s VAL 126 Ca 0.00 0.97 0.07 0.00 0.00 0.00 0.00 61.98 63.03 3du8 s VAL 126 Cb -0.13 -3.85 -0.03 0.00 0.00 0.00 0.00 36.38 32.36 3du8 s VAL 126 CO 0.03 0.14 -0.19 -0.31 0.00 0.00 0.00 175.10 174.77 3du8 s TYR 127 N 1.87 2.53 -0.14 5.22 1.51 0.14 -1.61 117.35 126.88 3du8 s TYR 127 Ca 0.24 -0.27 -0.15 0.00 -1.01 0.00 0.00 57.07 55.88 3du8 s TYR 127 Cb -0.15 -1.44 -0.05 0.00 -0.11 0.00 0.00 41.96 40.21 3du8 s TYR 127 CO 0.09 0.26 0.34 -1.17 -1.11 0.00 0.00 175.55 173.97 3du8 s LEU 128 N -1.50 4.27 -0.28 -1.29 2.96 0.85 -1.76 118.68 121.93 3du8 s LEU 128 Ca 0.15 0.62 0.01 0.00 -0.22 0.00 0.00 54.13 54.68 3du8 s LEU 128 Cb -0.10 -2.46 0.06 0.00 0.50 0.00 0.00 46.19 44.18 3du8 s LEU 128 CO 0.05 0.10 -0.05 0.20 -1.32 0.00 0.00 176.35 175.33 3du8 s ASN 129 N 0.36 4.66 -0.25 3.68 -0.87 0.02 -0.86 114.94 121.68 3du8 s ASN 129 Ca 0.19 -1.37 -0.19 0.00 -1.57 0.00 0.00 52.86 49.92 3du8 s ASN 129 Cb -0.14 -1.63 -0.03 0.00 -0.02 0.00 0.00 41.25 39.44 3du8 s ASN 129 CO 0.06 -0.23 0.54 -0.76 -2.57 0.00 0.00 177.10 174.15 3du8 s LEU 130 N 1.16 4.07 -0.33 0.60 1.43 0.30 -1.85 118.68 124.06 3du8 s LEU 130 Ca -0.07 0.59 -0.13 0.00 -1.03 0.00 0.00 54.13 53.49 3du8 s LEU 130 Cb -0.20 -2.72 -0.02 0.00 0.03 0.00 0.00 46.19 43.28 3du8 s LEU 130 CO -0.03 -0.29 0.27 -0.69 0.23 0.00 0.00 176.35 175.84 3du8 s VAL 131 N 2.25 5.25 0.22 -1.59 1.01 0.44 -0.95 120.40 127.04 3du8 s VAL 131 Ca 0.23 -0.03 0.10 0.00 0.00 0.00 0.00 61.98 62.28 3du8 s VAL 131 Cb -0.16 -3.71 -0.05 0.00 0.00 0.00 0.00 36.38 32.47 3du8 s VAL 131 CO 0.09 0.02 -0.19 -0.76 0.00 0.00 0.00 175.10 174.26 3du8 s LEU 132 N 1.83 2.52 0.22 3.92 1.43 0.36 0.59 118.68 129.55 3du8 s LEU 132 Ca 0.08 -0.96 -0.31 0.00 -1.03 0.00 0.00 54.13 51.91 3du8 s LEU 132 Cb -0.17 -0.96 -0.10 0.00 0.03 0.00 0.00 46.19 44.99 3du8 s LEU 132 CO 0.11 -0.01 1.49 -1.81 0.23 0.00 0.00 176.35 176.36 3du8 s ASP 133 N -3.14 6.62 0.01 2.29 1.01 -0.96 -0.89 116.67 121.61 3du8 s ASP 133 Ca 0.24 2.65 -0.30 0.00 0.71 0.00 0.00 52.55 55.85 3du8 s ASP 133 Cb -0.05 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.23 3du8 s ASP 133 CO 0.10 -0.75 1.09 -0.47 0.21 0.00 0.00 175.17 175.35 3du8 s TYR 134 N 0.41 3.52 -0.08 4.23 5.04 -1.17 -4.48 117.35 124.82 3du8 s TYR 134 Ca 0.63 1.49 0.04 0.00 -2.44 0.00 0.00 57.07 56.80 3du8 s TYR 134 Cb -0.43 -3.27 -0.01 0.00 0.35 0.00 0.00 41.96 38.60 3du8 s TYR 134 CO 0.39 -0.63 -0.21 0.08 -1.34 0.00 0.00 175.55 173.84 3du8 s VAL 135 N 1.21 2.39 0.23 3.14 1.01 -1.26 -4.91 120.40 122.21 3du8 s VAL 135 Ca 0.55 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.61 3du8 s VAL 135 Cb -0.24 -1.92 -0.02 0.00 0.00 0.00 0.00 36.38 34.20 3du8 s VAL 135 CO 0.27 0.56 1.58 1.55 0.00 0.00 0.00 175.10 179.06 3du8 h PRO 136 N 6.21 0.41 -5.36 2.72 0.13 -1.98 -3.46 132.00 130.68 3du8 h PRO 136 Ca -0.30 -0.24 -0.63 0.00 -0.87 0.00 0.00 66.00 63.96 3du8 h PRO 136 Cb 1.19 0.02 -0.13 0.00 0.13 0.00 0.00 31.00 32.21 3du8 h PRO 136 CO 0.49 0.82 -0.56 -1.21 -0.23 0.00 0.00 178.00 177.31 3du8 s GLU 137 N -4.03 2.03 0.06 0.86 0.41 -0.30 -4.98 118.70 112.75 3du8 s GLU 137 Ca -0.06 -2.22 0.02 0.00 -0.41 0.00 0.00 54.97 52.29 3du8 s GLU 137 Cb 0.12 -1.41 -0.03 0.00 -1.78 0.00 0.00 34.13 31.03 3du8 s GLU 137 CO 0.81 -0.24 -0.07 0.95 -0.49 0.00 0.00 175.26 176.23 3du8 s THR 138 N -2.89 0.55 0.30 3.63 -4.23 -1.26 -0.28 115.64 111.45 3du8 s THR 138 Ca 0.22 -1.47 0.00 0.00 -1.18 0.00 0.00 61.69 59.26 3du8 s THR 138 Cb 0.06 -1.09 0.28 0.00 1.34 0.00 0.00 72.50 73.08 3du8 s THR 138 CO 0.11 -0.64 1.91 0.58 -0.54 0.00 0.00 174.62 176.04 3du8 h VAL 139 N 3.78 1.08 -0.06 2.29 2.07 -0.41 -2.05 116.25 122.95 3du8 h VAL 139 Ca -0.35 -0.36 0.03 0.00 0.82 0.00 0.00 66.70 66.84 3du8 h VAL 139 Cb 1.18 -0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.85 3du8 h VAL 139 CO 0.52 0.19 -0.13 0.22 0.02 0.00 0.00 177.57 178.40 3du8 h TYR 140 N 1.06 -0.33 -0.40 1.57 3.20 -1.70 0.12 116.97 120.49 3du8 h TYR 140 Ca 0.39 0.02 -0.10 0.00 3.14 0.00 0.00 58.73 62.18 3du8 h TYR 140 Cb 0.18 0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 3du8 h TYR 140 CO -0.00 -0.20 -0.14 0.00 -1.64 0.00 0.00 178.16 176.18 3du8 h ARG 141 N -0.19 0.73 0.40 1.82 3.08 -1.83 -1.42 114.38 116.96 3du8 h ARG 141 Ca 0.07 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 59.84 3du8 h ARG 141 Cb 0.28 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.28 3du8 h ARG 141 CO -0.17 0.84 -0.19 0.28 -1.07 0.00 0.00 179.97 179.66 3du8 h VAL 142 N 0.66 0.57 -0.99 2.04 2.07 -1.19 -1.93 116.25 117.47 3du8 h VAL 142 Ca 0.11 -0.45 0.07 0.00 0.82 0.00 0.00 66.70 67.24 3du8 h VAL 142 Cb 0.61 0.77 -0.07 0.00 -1.52 0.00 0.00 31.29 31.09 3du8 h VAL 142 CO 0.04 0.08 0.64 0.00 0.02 0.00 0.00 177.57 178.35 3du8 h ALA 143 N -0.35 1.38 -0.55 1.67 0.00 -0.71 -2.44 119.26 118.26 3du8 h ALA 143 Ca -0.05 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 3du8 h ALA 143 Cb 0.54 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3du8 h ALA 143 CO 0.09 0.41 0.23 -0.09 0.00 0.00 0.00 179.25 179.88 3du8 h ARG 144 N 1.14 0.82 -0.20 0.00 2.43 -1.25 -0.68 114.38 116.64 3du8 h ARG 144 Ca 0.43 -0.15 0.04 0.00 -0.81 0.00 0.00 59.98 59.50 3du8 h ARG 144 Cb 0.19 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 29.57 3du8 h ARG 144 CO -0.18 0.71 -0.05 1.25 -1.51 0.00 0.00 179.97 180.19 3du8 h HIS 145 N 0.75 -0.10 -0.55 2.20 2.76 -0.90 -1.64 115.15 117.67 3du8 h HIS 145 Ca 0.18 0.02 -0.12 0.00 -2.20 0.00 0.00 60.37 58.25 3du8 h HIS 145 Cb 0.19 0.08 -0.02 0.00 1.55 0.00 0.00 27.41 29.21 3du8 h HIS 145 CO 0.01 -0.08 -0.12 1.88 -1.30 0.00 0.00 177.93 178.32 3du8 h TYR 146 N 0.00 1.17 -0.27 5.26 -1.99 -1.31 -2.98 116.97 116.86 3du8 h TYR 146 Ca 0.10 -0.25 -0.01 0.00 2.00 0.00 0.00 58.73 60.57 3du8 h TYR 146 Cb 0.14 -0.29 -0.01 0.00 2.00 0.00 0.00 36.73 38.57 3du8 h TYR 146 CO -0.21 1.08 0.14 1.03 -0.00 0.00 0.00 178.16 180.19 3du8 h SER 147 N 0.93 0.34 1.17 3.88 0.87 -0.99 0.38 113.55 120.14 3du8 h SER 147 Ca 0.14 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 3du8 h SER 147 Cb 0.69 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 3du8 h SER 147 CO 0.05 0.35 -0.06 -2.11 -0.53 0.00 0.00 176.83 174.53 3du8 n ARG 148 N -4.82 0.13 -0.25 2.24 1.85 -0.63 -1.61 116.66 113.57 3du8 n ARG 148 Ca -0.02 0.10 0.05 0.00 -1.00 0.00 0.00 57.85 56.97 3du8 n ARG 148 Cb 0.09 -1.64 0.16 0.00 -1.05 0.00 0.00 32.46 30.02 3du8 n ARG 148 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3du8 n ALA 149 N -1.64 2.68 -3.76 2.89 0.00 -1.00 -4.92 120.51 114.76 3du8 n ALA 149 Ca 0.06 -0.68 -0.27 0.00 0.00 0.00 0.00 53.44 52.55 3du8 n ALA 149 Cb 0.38 -1.00 0.05 0.00 0.00 0.00 0.00 19.45 18.88 3du8 n ALA 149 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3du8 n LYS 150 N 0.42 -6.45 -4.63 0.00 4.76 -0.63 -5.01 118.16 106.62 3du8 n LYS 150 Ca 0.12 0.70 -0.29 0.00 -2.87 0.00 0.00 58.31 55.97 3du8 n LYS 150 Cb 0.42 -5.63 -0.11 0.00 -1.84 0.00 0.00 35.03 27.87 3du8 n LYS 150 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 3du8 s GLN 151 N -6.39 1.99 0.06 1.97 2.00 0.13 -5.02 119.66 114.41 3du8 s GLN 151 Ca 0.55 -2.14 0.06 0.00 -2.00 0.00 0.00 55.36 51.82 3du8 s GLN 151 Cb -0.26 -1.63 -0.03 0.00 0.80 0.00 0.00 33.01 31.89 3du8 s GLN 151 CO 0.79 -0.09 -0.16 0.95 -0.50 0.00 0.00 175.29 176.28 3du8 s THR 152 N -2.73 1.28 0.47 -0.34 -4.23 -1.26 -3.77 115.64 105.07 3du8 s THR 152 Ca 0.32 -1.21 -0.24 0.00 -1.18 0.00 0.00 61.69 59.38 3du8 s THR 152 Cb 0.09 -1.18 -0.08 0.00 1.34 0.00 0.00 72.50 72.68 3du8 s THR 152 CO 0.16 -0.05 1.32 -0.11 -0.54 0.00 0.00 174.62 175.40 3du8 n LEU 153 N 1.57 4.69 -4.63 4.79 7.94 -1.26 -4.93 117.00 125.17 3du8 n LEU 153 Ca -0.19 1.06 -0.42 0.00 -1.11 0.00 0.00 56.01 55.35 3du8 n LEU 153 Cb 0.54 -1.54 0.00 0.00 0.53 0.00 0.00 43.42 42.95 3du8 n LEU 153 CO 0.22 -0.56 0.66 -2.65 -1.11 0.00 0.00 177.39 173.95 3du8 n PRO 154 N -0.35 1.53 0.24 1.96 -0.02 -1.26 -4.84 135.00 132.27 3du8 n PRO 154 Ca 0.08 0.54 0.07 0.00 -2.02 0.00 0.00 63.50 62.17 3du8 n PRO 154 Cb 0.42 -2.08 0.58 0.00 -0.02 0.00 0.00 33.50 32.40 3du8 n PRO 154 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3du8 h VAL 155 N 1.83 1.03 -0.95 -1.45 2.07 -1.99 -1.02 116.25 115.77 3du8 h VAL 155 Ca -0.44 -0.34 0.05 0.00 0.82 0.00 0.00 66.70 66.79 3du8 h VAL 155 Cb 1.33 1.18 -0.06 0.00 -1.52 0.00 0.00 31.29 32.22 3du8 h VAL 155 CO 0.59 0.10 0.62 -0.29 0.02 0.00 0.00 177.57 178.60 3du8 h ILE 156 N 0.00 1.11 -0.66 4.57 6.09 -1.99 0.11 117.51 126.73 3du8 h ILE 156 Ca -0.00 -0.39 -0.08 0.00 -1.37 0.00 0.00 64.86 63.02 3du8 h ILE 156 Cb 0.18 -0.12 -0.03 0.00 0.47 0.00 0.00 36.82 37.32 3du8 h ILE 156 CO 0.01 0.21 0.09 1.88 -3.07 0.00 0.00 178.15 177.27 3du8 h TYR 157 N 1.13 1.18 -0.66 2.19 0.05 -1.54 -1.21 116.97 118.11 3du8 h TYR 157 Ca 0.39 -0.17 -0.01 0.00 0.05 0.00 0.00 58.73 58.99 3du8 h TYR 157 Cb 0.11 -0.32 -0.03 0.00 1.01 0.00 0.00 36.73 37.50 3du8 h TYR 157 CO -0.00 1.00 0.36 0.28 -1.05 0.00 0.00 178.16 178.75 3du8 h VAL 158 N 1.02 1.21 0.15 -2.88 2.07 -1.04 0.10 116.25 116.89 3du8 h VAL 158 Ca 0.20 -0.53 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 3du8 h VAL 158 Cb 0.46 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 3du8 h VAL 158 CO 0.02 0.23 -0.07 0.11 0.02 0.00 0.00 177.57 177.88 3du8 h LYS 159 N 0.91 -0.19 -0.52 1.57 1.57 -0.70 -1.69 116.57 117.52 3du8 h LYS 159 Ca 0.23 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 59.00 3du8 h LYS 159 Cb 0.05 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 3du8 h LYS 159 CO -0.04 -0.07 0.24 -0.07 -0.57 0.00 0.00 179.45 178.95 3du8 h LEU 160 N -0.27 0.69 0.19 2.94 3.38 -0.93 -1.47 115.31 119.84 3du8 h LEU 160 Ca -0.02 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 3du8 h LEU 160 Cb 0.21 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.79 3du8 h LEU 160 CO 0.03 0.64 -0.09 1.88 0.09 0.00 0.00 178.44 180.99 3du8 h TYR 161 N 0.70 -0.23 -0.48 1.13 0.05 -0.82 -2.45 116.97 114.87 3du8 h TYR 161 Ca 0.18 -0.01 -0.05 0.00 0.05 0.00 0.00 58.73 58.90 3du8 h TYR 161 Cb 0.14 0.08 -0.02 0.00 1.01 0.00 0.00 36.73 37.93 3du8 h TYR 161 CO -0.00 -0.03 0.10 0.52 -1.05 0.00 0.00 178.16 177.69 3du8 h MET 162 N -0.39 0.73 -0.18 4.88 2.86 -1.29 -1.61 114.93 119.93 3du8 h MET 162 Ca -0.03 -0.15 -0.04 0.00 -2.06 0.00 0.00 59.70 57.42 3du8 h MET 162 Cb 0.30 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.85 3du8 h MET 162 CO 0.04 0.68 -0.06 -0.92 1.06 0.00 0.00 176.91 177.71 3du8 h TYR 163 N 0.71 0.40 -0.18 -0.22 3.20 -1.26 0.02 116.97 119.65 3du8 h TYR 163 Ca 0.16 -0.09 -0.05 0.00 3.14 0.00 0.00 58.73 61.89 3du8 h TYR 163 Cb 0.29 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.46 3du8 h TYR 163 CO 0.01 0.63 -0.10 1.96 -1.64 0.00 0.00 178.16 179.03 3du8 h GLN 164 N 0.06 0.28 -0.15 1.82 4.20 -1.33 -0.55 115.11 119.44 3du8 h GLN 164 Ca 0.04 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.65 3du8 h GLN 164 Cb 0.51 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.25 3du8 h GLN 164 CO 0.02 0.39 -0.06 1.25 -0.67 0.00 0.00 178.83 179.77 3du8 h LEU 165 N 0.27 0.31 -1.21 1.46 5.85 -0.82 -1.91 115.31 119.26 3du8 h LEU 165 Ca 0.06 -0.40 0.12 0.00 0.84 0.00 0.00 57.88 58.50 3du8 h LEU 165 Cb 0.35 -0.09 -0.07 0.00 0.37 0.00 0.00 40.66 41.22 3du8 h LEU 165 CO 0.02 0.64 0.58 -0.26 -0.34 0.00 0.00 178.44 179.08 3du8 h PHE 166 N -0.02 0.93 0.04 1.25 0.04 -0.75 -1.55 116.94 116.89 3du8 h PHE 166 Ca 0.04 0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.83 3du8 h PHE 166 Cb 0.51 -0.30 0.00 0.00 2.20 0.00 0.00 35.95 38.37 3du8 h PHE 166 CO 0.06 0.39 -0.02 0.00 -0.60 0.00 0.00 178.31 178.14 3du8 h ARG 167 N 0.83 -0.05 -0.70 1.51 3.08 -0.90 0.21 114.38 118.36 3du8 h ARG 167 Ca 0.43 0.00 0.15 0.00 0.07 0.00 0.00 59.98 60.64 3du8 h ARG 167 Cb 0.53 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.55 3du8 h ARG 167 CO -0.20 0.15 0.48 0.66 -1.07 0.00 0.00 179.97 179.99 3du8 h SER 168 N -0.25 0.27 0.46 7.04 4.64 -0.89 -1.39 113.55 123.43 3du8 h SER 168 Ca -0.01 0.02 -0.30 0.00 -0.47 0.00 0.00 61.79 61.03 3du8 h SER 168 Cb 0.23 -0.04 0.01 0.00 -0.31 0.00 0.00 62.40 62.29 3du8 h SER 168 CO 0.01 0.14 -1.40 -0.07 -0.87 0.00 0.00 176.83 174.64 3du8 h LEU 169 N 0.29 0.57 -1.16 5.97 3.38 -1.07 -1.97 115.31 121.32 3du8 h LEU 169 Ca 0.34 -0.64 0.07 0.00 0.09 0.00 0.00 57.88 57.74 3du8 h LEU 169 Cb 0.93 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.43 3du8 h LEU 169 CO -0.08 1.51 0.58 0.00 0.09 0.00 0.00 178.44 180.54 3du8 h ALA 170 N 0.40 1.54 0.40 1.53 0.00 -0.30 -1.07 119.26 121.75 3du8 h ALA 170 Ca -0.20 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 3du8 h ALA 170 Cb 2.05 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.59 3du8 h ALA 170 CO 0.22 0.32 -0.19 -0.92 0.00 0.00 0.00 179.25 178.68 3du8 h TYR 171 N 1.00 -0.50 -0.69 0.00 5.03 -1.19 -2.76 116.97 117.86 3du8 h TYR 171 Ca 0.39 -0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.65 3du8 h TYR 171 Cb 0.24 0.17 -0.03 0.00 1.55 0.00 0.00 36.73 38.65 3du8 h TYR 171 CO -0.00 -0.18 0.28 -0.84 -1.32 0.00 0.00 178.16 176.10 3du8 h ILE 172 N -0.99 1.23 0.00 1.81 3.07 -1.34 -2.79 117.51 118.51 3du8 h ILE 172 Ca -0.06 -0.72 -0.02 0.00 1.55 0.00 0.00 64.86 65.62 3du8 h ILE 172 Cb 0.54 0.40 -0.00 0.00 -0.27 0.00 0.00 36.82 37.49 3du8 h ILE 172 CO 0.09 0.29 -0.10 0.45 -1.05 0.00 0.00 178.15 177.83 3du8 h HIS 173 N 0.99 0.00 0.00 0.16 3.86 -1.05 -1.31 115.15 117.79 3du8 h HIS 173 Ca 0.23 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.39 3du8 h HIS 173 Cb 0.17 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.63 3du8 h HIS 173 CO 0.01 0.10 -0.26 0.66 0.86 0.00 0.00 177.93 179.30 3du8 h SER 174 N 0.00 0.00 -0.09 2.45 4.64 -1.20 0.76 113.55 120.12 3du8 h SER 174 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3du8 h SER 174 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 3du8 h SER 174 CO 0.01 0.26 0.00 0.49 -0.87 0.00 0.00 176.83 176.73 3du8 n PHE 175 N -3.33 0.12 -0.94 4.77 3.01 -0.59 -4.91 117.46 115.59 3du8 n PHE 175 Ca 0.01 -0.06 0.00 0.00 1.01 0.00 0.00 57.45 58.41 3du8 n PHE 175 Cb 0.50 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.97 3du8 n PHE 175 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3du8 n GLY 176 N 0.89 0.31 3.72 1.37 0.00 0.26 -4.96 105.19 106.79 3du8 n GLY 176 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 3du8 n GLY 176 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3du8 s ILE 177 N -1.75 5.06 -0.13 -0.61 1.01 -0.65 -1.46 121.20 122.67 3du8 s ILE 177 Ca 0.00 1.37 -0.04 0.00 0.00 0.00 0.00 60.65 61.99 3du8 s ILE 177 Cb 0.00 -4.01 -0.03 0.00 0.01 0.00 0.00 42.46 38.43 3du8 s ILE 177 CO 0.00 0.27 -0.01 0.00 0.00 0.00 0.00 174.94 175.20 3du8 h HIS 179 N 6.11 0.73 0.00 0.00 2.76 -1.91 -1.59 115.15 121.25 3du8 h HIS 179 Ca -0.40 -0.26 0.00 0.00 -2.20 0.00 0.00 60.37 57.52 3du8 h HIS 179 Cb 1.19 -0.14 0.00 0.00 1.55 0.00 0.00 27.41 30.01 3du8 h HIS 179 CO 0.57 0.99 0.00 0.54 -1.30 0.00 0.00 177.93 178.74 3du8 n ARG 180 N -4.30 -0.11 -2.71 5.26 1.74 -1.26 -2.70 116.66 112.59 3du8 n ARG 180 Ca -0.06 0.03 -0.09 0.00 -0.77 0.00 0.00 57.85 56.96 3du8 n ARG 180 Cb 0.50 -3.40 0.06 0.00 -1.02 0.00 0.00 32.46 28.59 3du8 n ARG 180 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3du8 n ASP 181 N -0.05 0.22 -4.70 0.55 2.03 -1.26 -2.47 116.55 110.87 3du8 n ASP 181 Ca 0.00 -2.68 -0.42 0.00 0.52 0.00 0.00 54.79 52.21 3du8 n ASP 181 Cb 0.03 0.03 -0.03 0.00 -0.72 0.00 0.00 41.12 40.43 3du8 n ASP 181 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3du8 s ILE 182 N -1.92 4.73 0.04 5.18 -1.09 -1.26 -4.86 121.20 122.01 3du8 s ILE 182 Ca 0.26 1.98 -0.27 0.00 -2.23 0.00 0.00 60.65 60.39 3du8 s ILE 182 Cb 0.43 -4.27 0.08 0.00 -1.58 0.00 0.00 42.46 37.12 3du8 s ILE 182 CO -0.01 0.07 0.73 -1.59 -1.23 0.00 0.00 174.94 172.91 3du8 s LYS 183 N 1.60 1.04 0.51 2.79 -2.85 -1.26 -4.84 119.74 116.74 3du8 s LYS 183 Ca 0.51 -0.19 0.30 0.00 -1.00 0.00 0.00 55.97 55.60 3du8 s LYS 183 Cb -0.20 0.49 1.43 0.00 -2.06 0.00 0.00 37.83 37.48 3du8 s LYS 183 CO 0.23 -0.42 1.85 -1.35 0.10 0.00 0.00 175.35 175.76 3du8 h PRO 184 N 2.30 0.07 0.00 1.78 0.11 -1.95 -0.59 132.00 133.72 3du8 h PRO 184 Ca -0.28 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3du8 h PRO 184 Cb 1.24 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3du8 h PRO 184 CO 0.36 0.05 0.00 0.00 -0.21 0.00 0.00 178.00 178.20 3du8 n GLN 185 N -4.30 0.18 -0.06 1.05 0.00 -1.26 -2.24 117.38 110.75 3du8 n GLN 185 Ca 0.21 0.17 0.12 0.00 0.00 0.00 0.00 57.00 57.50 3du8 n GLN 185 Cb 1.01 -1.72 0.42 0.00 0.00 0.00 0.00 30.24 29.95 3du8 n GLN 185 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 3du8 n ASN 186 N -2.04 1.66 -4.12 2.61 3.02 -0.23 -4.75 115.26 111.41 3du8 n ASN 186 Ca 0.06 -1.65 -0.37 0.00 -0.03 0.00 0.00 54.58 52.59 3du8 n ASN 186 Cb 0.39 -0.07 -0.10 0.00 -0.61 0.00 0.00 39.78 39.38 3du8 n ASN 186 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3du8 s LEU 187 N -1.71 5.34 0.30 3.41 1.43 -1.11 -0.98 118.68 125.37 3du8 s LEU 187 Ca 0.34 -2.42 -0.21 0.00 -1.03 0.00 0.00 54.13 50.81 3du8 s LEU 187 Cb 0.19 -1.87 -0.09 0.00 0.03 0.00 0.00 46.19 44.44 3du8 s LEU 187 CO 0.29 -0.48 0.83 -0.76 0.23 0.00 0.00 176.35 176.46 3du8 s LEU 188 N 0.58 4.25 -0.03 1.79 1.43 -0.46 0.04 118.68 126.29 3du8 s LEU 188 Ca 0.12 1.58 0.01 0.00 -1.03 0.00 0.00 54.13 54.81 3du8 s LEU 188 Cb -0.22 -3.93 0.02 0.00 0.03 0.00 0.00 46.19 42.10 3du8 s LEU 188 CO -0.04 -0.08 -0.02 -0.76 0.23 0.00 0.00 176.35 175.68 3du8 s LEU 189 N -2.29 1.27 -0.32 1.79 1.43 0.62 -0.89 118.68 120.29 3du8 s LEU 189 Ca 0.49 -0.06 -0.21 0.00 -1.03 0.00 0.00 54.13 53.32 3du8 s LEU 189 Cb -0.15 -0.30 -0.00 0.00 0.03 0.00 0.00 46.19 45.76 3du8 s LEU 189 CO 0.20 -0.08 0.68 -0.62 0.23 0.00 0.00 176.35 176.77 3du8 s ASP 190 N 0.92 6.52 0.34 2.29 -1.08 -0.22 -1.15 116.67 124.29 3du8 s ASP 190 Ca -0.10 0.40 0.07 0.00 -0.52 0.00 0.00 52.55 52.39 3du8 s ASP 190 Cb -0.13 -2.35 0.61 0.00 -1.46 0.00 0.00 42.92 39.58 3du8 s ASP 190 CO -0.01 -0.56 1.82 1.55 0.52 0.00 0.00 175.17 178.49 3du8 h PRO 191 N 8.27 0.33 0.04 4.34 0.13 -1.96 -1.22 132.00 141.93 3du8 h PRO 191 Ca -0.26 -0.10 -0.12 0.00 -0.87 0.00 0.00 66.00 64.65 3du8 h PRO 191 Cb 1.11 -0.03 0.01 0.00 0.13 0.00 0.00 31.00 32.22 3du8 h PRO 191 CO 0.84 0.52 -0.49 -0.44 -0.23 0.00 0.00 178.00 178.20 3du8 h ASP 192 N 0.30 0.35 0.71 1.44 3.32 -1.97 -3.31 116.42 117.26 3du8 h ASP 192 Ca 0.05 -0.86 0.00 0.00 0.02 0.00 0.00 57.03 56.25 3du8 h ASP 192 Cb 0.52 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.96 3du8 h ASP 192 CO 0.03 1.17 -0.27 0.35 -1.72 0.00 0.00 179.24 178.80 3du8 n THR 193 N -4.32 0.00 -1.44 0.35 -2.24 -1.24 -4.96 114.28 100.43 3du8 n THR 193 Ca -0.11 -0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.51 3du8 n THR 193 Cb 0.65 -0.08 -0.07 0.00 -2.10 0.00 0.00 70.33 68.73 3du8 n THR 193 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3du8 n ALA 194 N -1.48 -0.24 -2.18 6.98 0.00 -0.46 -4.14 120.51 118.98 3du8 n ALA 194 Ca 0.06 0.25 -0.42 0.00 0.00 0.00 0.00 53.44 53.34 3du8 n ALA 194 Cb 0.34 -1.82 -0.03 0.00 0.00 0.00 0.00 19.45 17.94 3du8 n ALA 194 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3du8 s VAL 195 N -2.32 3.45 -0.14 0.00 1.01 -1.23 -4.82 120.40 116.35 3du8 s VAL 195 Ca 0.00 1.07 -0.04 0.00 0.00 0.00 0.00 61.98 63.01 3du8 s VAL 195 Cb 0.00 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.66 3du8 s VAL 195 CO 0.00 0.10 0.00 -0.22 0.00 0.00 0.00 175.10 174.99 3du8 s LEU 196 N 0.78 3.53 -0.14 3.92 0.20 -1.26 -1.05 118.68 124.66 3du8 s LEU 196 Ca 0.61 0.03 0.01 0.00 0.69 0.00 0.00 54.13 55.47 3du8 s LEU 196 Cb -0.35 -1.85 0.02 0.00 -0.43 0.00 0.00 46.19 43.58 3du8 s LEU 196 CO 0.32 0.25 -0.15 -0.54 -0.29 0.00 0.00 176.35 175.94 3du8 s LYS 197 N -0.11 2.36 0.30 1.98 1.02 -0.07 -4.39 119.74 120.83 3du8 s LYS 197 Ca 0.04 -0.59 -0.29 0.00 0.02 0.00 0.00 55.97 55.15 3du8 s LYS 197 Cb -0.13 -2.10 -0.10 0.00 -0.52 0.00 0.00 37.83 34.99 3du8 s LYS 197 CO 0.02 -0.18 1.35 -1.17 -0.92 0.00 0.00 175.35 174.45 3du8 s LEU 198 N 1.30 4.41 0.00 3.17 2.96 0.44 -1.35 118.68 129.61 3du8 s LEU 198 Ca 0.01 2.67 0.03 0.00 -0.22 0.00 0.00 54.13 56.62 3du8 s LEU 198 Cb -0.14 -3.64 -0.01 0.00 0.50 0.00 0.00 46.19 42.90 3du8 s LEU 198 CO -0.08 -0.59 0.10 0.00 -1.32 0.00 0.00 176.35 174.46 3du8 n ASP 200 N -1.63 -6.55 -1.35 0.00 2.03 -1.26 -4.91 116.55 102.88 3du8 n ASP 200 Ca -0.05 0.33 0.01 0.00 0.52 0.00 0.00 54.79 55.61 3du8 n ASP 200 Cb 0.46 -4.36 0.21 0.00 -0.72 0.00 0.00 41.12 36.71 3du8 n ASP 200 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3du8 n PHE 201 N -0.56 1.27 0.30 -0.67 3.01 -1.26 -4.42 117.46 115.13 3du8 n PHE 201 Ca 0.08 -0.54 0.19 0.00 1.01 0.00 0.00 57.45 58.19 3du8 n PHE 201 Cb 0.38 -0.38 0.90 0.00 -0.01 0.00 0.00 39.48 40.37 3du8 n PHE 201 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 3du8 h GLY 202 N 4.14 0.00 -0.89 1.37 0.00 -1.91 -2.60 103.07 103.18 3du8 h GLY 202 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 3du8 h GLY 202 CO 0.33 0.00 -0.05 1.44 0.00 0.00 0.00 176.54 178.26 3du8 n SER 203 N -3.16 1.87 -4.77 0.19 7.64 -1.26 -4.93 113.62 109.20 3du8 n SER 203 Ca -0.01 -1.44 -0.38 0.00 1.01 0.00 0.00 58.87 58.05 3du8 n SER 203 Cb 0.21 0.10 -0.03 0.00 -1.01 0.00 0.00 64.21 63.48 3du8 n SER 203 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3du8 s ALA 204 N -1.12 3.15 -0.07 -0.43 0.00 -0.98 -4.63 121.76 117.68 3du8 s ALA 204 Ca 0.13 0.89 -0.13 0.00 0.00 0.00 0.00 51.96 52.86 3du8 s ALA 204 Cb 0.10 -3.35 0.03 0.00 0.00 0.00 0.00 23.12 19.90 3du8 s ALA 204 CO 0.18 -0.43 0.32 0.21 0.00 0.00 0.00 175.76 176.04 3du8 s LYS 205 N -2.30 0.53 -0.07 0.00 2.20 -0.60 -4.87 119.74 114.63 3du8 s LYS 205 Ca 0.57 0.12 -0.30 0.00 -0.36 0.00 0.00 55.97 56.00 3du8 s LYS 205 Cb -0.28 0.24 -0.05 0.00 -1.51 0.00 0.00 37.83 36.23 3du8 s LYS 205 CO 0.36 -0.12 1.52 -1.14 -0.36 0.00 0.00 175.35 175.61 3du8 s GLN 206 N -0.61 4.21 -0.38 4.03 0.74 -1.26 -1.45 119.66 124.94 3du8 s GLN 206 Ca -0.07 2.03 -0.20 0.00 0.05 0.00 0.00 55.36 57.17 3du8 s GLN 206 Cb -0.04 -3.85 0.01 0.00 1.10 0.00 0.00 33.01 30.23 3du8 s GLN 206 CO 0.02 -0.76 0.60 -0.51 -0.55 0.00 0.00 175.29 174.09 3du8 s LEU 207 N 3.57 4.38 -0.23 3.68 1.43 -0.53 -4.97 118.68 126.02 3du8 s LEU 207 Ca 0.67 -0.09 -0.13 0.00 -1.03 0.00 0.00 54.13 53.55 3du8 s LEU 207 Cb -0.30 -2.70 -0.04 0.00 0.03 0.00 0.00 46.19 43.17 3du8 s LEU 207 CO 0.26 -0.63 0.28 -0.69 0.23 0.00 0.00 176.35 175.80 3du8 s VAL 208 N 2.65 5.27 0.30 -1.59 1.01 -1.26 -4.94 120.40 121.84 3du8 s VAL 208 Ca 0.22 0.45 -0.29 0.00 0.00 0.00 0.00 61.98 62.35 3du8 s VAL 208 Cb -0.15 -3.62 -0.13 0.00 0.00 0.00 0.00 36.38 32.49 3du8 s VAL 208 CO 0.16 0.29 1.36 -1.14 0.00 0.00 0.00 175.10 175.76 3du8 n ARG 209 N 4.46 2.15 -0.19 2.72 0.63 -1.26 -1.03 116.66 124.14 3du8 n ARG 209 Ca -0.11 0.76 0.00 0.00 -0.92 0.00 0.00 57.85 57.57 3du8 n ARG 209 Cb 0.51 -2.38 0.00 0.00 0.45 0.00 0.00 32.46 31.04 3du8 n ARG 209 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3du8 n GLY 210 N 1.37 2.00 3.82 5.14 0.00 -1.26 -5.03 105.19 111.22 3du8 n GLY 210 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 3du8 n GLY 210 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3du8 s GLU 211 N -0.05 4.23 0.28 1.61 2.02 -0.20 -5.09 118.70 121.51 3du8 s GLU 211 Ca 0.00 0.82 -0.19 0.00 0.02 0.00 0.00 54.97 55.62 3du8 s GLU 211 Cb 0.00 -2.95 -0.09 0.00 0.10 0.00 0.00 34.13 31.19 3du8 s GLU 211 CO 0.00 0.44 0.78 -1.25 0.02 0.00 0.00 175.26 175.26 3du8 s PRO 212 N -1.83 4.23 0.10 0.39 0.04 -1.26 -4.76 135.00 131.91 3du8 s PRO 212 Ca 0.40 0.91 0.05 0.00 0.04 0.00 0.00 61.00 62.41 3du8 s PRO 212 Cb -0.17 -2.68 -0.03 0.00 0.04 0.00 0.00 34.50 31.66 3du8 s PRO 212 CO 0.21 0.27 -0.14 -0.80 0.04 0.00 0.00 177.00 176.58 3du8 s ASN 213 N -1.87 1.85 0.35 6.66 0.01 0.74 -5.03 114.94 117.65 3du8 s ASN 213 Ca 0.49 -0.74 -0.29 0.00 -0.71 0.00 0.00 52.86 51.61 3du8 s ASN 213 Cb -0.14 -0.06 -0.11 0.00 0.41 0.00 0.00 41.25 41.35 3du8 s ASN 213 CO 0.20 -0.13 1.47 0.68 -1.51 0.00 0.00 177.10 177.80 3du8 s VAL 214 N -1.86 2.21 -2.34 1.60 -7.23 -1.26 -4.41 120.40 107.11 3du8 s VAL 214 Ca 0.05 0.20 0.21 0.00 -1.81 0.00 0.00 61.98 60.64 3du8 s VAL 214 Cb -0.06 -3.13 0.44 0.00 0.56 0.00 0.00 36.38 34.18 3du8 s VAL 214 CO 0.02 0.05 1.45 -1.54 -0.31 0.00 0.00 175.10 174.77 3du8 n SER 215 N 0.88 2.69 -1.03 4.85 3.41 -1.26 -4.24 113.62 118.91 3du8 n SER 215 Ca 0.02 -1.89 0.08 0.00 -0.26 0.00 0.00 58.87 56.82 3du8 n SER 215 Cb 0.39 -0.21 0.26 0.00 -0.26 0.00 0.00 64.21 64.39 3du8 n SER 215 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3du8 n TYR 216 N 0.99 0.98 -1.56 7.33 0.18 -1.26 -4.83 117.16 119.00 3du8 n TYR 216 Ca 0.18 -0.69 -0.30 0.00 1.88 0.00 0.00 57.90 58.97 3du8 n TYR 216 Cb 0.48 -0.22 0.10 0.00 -0.38 0.00 0.00 39.34 39.32 3du8 n TYR 216 CO 0.00 0.00 0.00 0.96 -2.08 0.00 0.00 176.86 175.74 3du8 s ILE 217 N -2.02 2.77 0.00 -3.48 -5.25 -1.26 -4.97 121.20 106.99 3du8 s ILE 217 Ca 0.39 0.25 0.00 0.00 -0.99 0.00 0.00 60.65 60.30 3du8 s ILE 217 Cb 0.27 -3.00 0.00 0.00 2.95 0.00 0.00 42.46 42.68 3du8 s ILE 217 CO 0.15 -0.33 0.00 0.00 -1.79 0.00 0.00 174.94 172.98 3du8 s SER 219 N -1.55 6.97 0.50 0.00 0.01 -1.26 -4.91 113.70 113.46 3du8 s SER 219 Ca 0.00 1.25 -0.22 0.00 1.31 0.00 0.00 55.95 58.28 3du8 s SER 219 Cb 0.00 -2.35 -0.07 0.00 0.21 0.00 0.00 66.02 63.80 3du8 s SER 219 CO 0.00 0.12 1.14 -2.11 0.41 0.00 0.00 173.24 172.80 3du8 n ARG 220 N 0.99 1.44 0.00 12.44 1.85 -1.26 -1.36 116.66 130.76 3du8 n ARG 220 Ca -0.05 0.53 0.00 0.00 -1.00 0.00 0.00 57.85 57.32 3du8 n ARG 220 Cb 0.51 -2.29 0.00 0.00 -1.05 0.00 0.00 32.46 29.64 3du8 n ARG 220 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 3du8 n TYR 221 N -0.91 0.00 0.59 2.89 0.53 -1.26 -4.82 117.16 114.18 3du8 n TYR 221 Ca 0.10 0.00 0.09 0.00 -1.02 0.00 0.00 57.90 57.08 3du8 n TYR 221 Cb 0.43 0.00 0.11 0.00 -1.03 0.00 0.00 39.34 38.85 3du8 n TYR 221 CO 0.00 0.00 0.00 0.66 -1.02 0.00 0.00 176.86 176.50 3du8 n TYR 222 N 0.00 0.15 -2.86 -0.72 4.01 -0.47 -4.62 117.16 112.65 3du8 n TYR 222 Ca 0.00 -0.09 -0.41 0.00 -0.16 0.00 0.00 57.90 57.23 3du8 n TYR 222 Cb 0.00 -0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 38.99 3du8 n TYR 222 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 3du8 s ARG 223 N -1.47 4.44 0.54 -0.72 0.52 -1.23 -3.78 118.95 117.24 3du8 s ARG 223 Ca 0.25 1.14 -0.22 0.00 -0.52 0.00 0.00 55.73 56.39 3du8 s ARG 223 Cb 0.17 -3.49 -0.05 0.00 0.52 0.00 0.00 34.95 32.09 3du8 s ARG 223 CO 0.24 -0.12 1.34 0.00 0.02 0.00 0.00 175.30 176.79 3du8 s ALA 224 N 1.35 2.82 0.44 2.13 0.00 -1.26 -4.84 121.76 122.40 3du8 s ALA 224 Ca 0.43 1.30 0.25 0.00 0.00 0.00 0.00 51.96 53.95 3du8 s ALA 224 Cb -0.18 -3.55 1.42 0.00 0.00 0.00 0.00 23.12 20.80 3du8 s ALA 224 CO 0.20 -1.32 2.08 -1.00 0.00 0.00 0.00 175.76 175.72 3du8 h PRO 225 N 1.48 0.00 0.00 0.00 0.13 -1.94 -0.05 132.00 131.61 3du8 h PRO 225 Ca -0.51 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.56 3du8 h PRO 225 Cb 1.30 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.42 3du8 h PRO 225 CO 0.57 0.12 -0.31 1.05 -0.23 0.00 0.00 178.00 179.19 3du8 h GLU 226 N 0.00 0.00 -0.32 0.86 9.09 -1.91 0.08 114.58 122.38 3du8 h GLU 226 Ca -0.00 0.00 -0.11 0.00 0.05 0.00 0.00 59.36 59.30 3du8 h GLU 226 Cb 0.29 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.38 3du8 h GLU 226 CO 0.01 0.31 -0.22 -0.07 0.05 0.00 0.00 179.01 179.09 3du8 h LEU 227 N 0.00 0.76 -0.18 3.06 3.38 -1.32 0.91 115.31 121.92 3du8 h LEU 227 Ca -0.00 -0.44 -0.01 0.00 0.09 0.00 0.00 57.88 57.52 3du8 h LEU 227 Cb 0.65 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 3du8 h LEU 227 CO 0.04 1.03 0.07 0.40 0.09 0.00 0.00 178.44 180.07 3du8 h ILE 228 N 0.49 1.17 0.00 1.22 2.04 -1.13 -0.60 117.51 120.70 3du8 h ILE 228 Ca 0.06 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.42 3du8 h ILE 228 Cb 0.78 1.17 0.00 0.00 -0.74 0.00 0.00 36.82 38.02 3du8 h ILE 228 CO 0.06 0.16 0.00 0.49 0.00 0.00 0.00 178.15 178.86 3du8 n PHE 229 N -4.84 0.00 -1.09 1.37 3.72 -0.02 -4.90 117.46 111.71 3du8 n PHE 229 Ca -0.04 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.33 3du8 n PHE 229 Cb 0.13 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.66 3du8 n PHE 229 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3du8 n GLY 230 N -0.61 0.62 3.77 1.37 0.00 -0.23 -4.38 105.19 105.72 3du8 n GLY 230 Ca 0.03 -0.65 -0.40 0.00 0.00 0.00 0.00 46.02 45.00 3du8 n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3du8 s ALA 231 N -2.06 3.30 -1.03 4.61 0.00 0.29 -4.84 121.76 122.02 3du8 s ALA 231 Ca 0.00 1.36 0.08 0.00 0.00 0.00 0.00 51.96 53.40 3du8 s ALA 231 Cb 0.00 -3.54 0.07 0.00 0.00 0.00 0.00 23.12 19.65 3du8 s ALA 231 CO 0.00 -0.97 0.76 0.25 0.00 0.00 0.00 175.76 175.80 3du8 n THR 232 N 0.09 0.00 -1.35 0.00 -2.24 -1.26 -4.45 114.28 105.08 3du8 n THR 232 Ca 0.04 -0.50 -0.06 0.00 -2.27 0.00 0.00 64.05 61.26 3du8 n THR 232 Cb 0.42 1.17 0.21 0.00 -2.10 0.00 0.00 70.33 70.03 3du8 n THR 232 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3du8 n ASP 233 N 0.46 2.91 -4.81 3.42 3.85 -1.26 -0.19 116.55 120.93 3du8 n ASP 233 Ca 0.05 -3.64 -0.31 0.00 -0.71 0.00 0.00 54.79 50.18 3du8 n ASP 233 Cb 0.21 -0.66 0.06 0.00 -1.35 0.00 0.00 41.12 39.38 3du8 n ASP 233 CO 0.00 0.00 0.00 -0.72 -1.01 0.00 0.00 177.20 175.47 3du8 s TYR 234 N -3.20 3.04 0.46 2.11 -0.85 -1.26 -5.02 117.35 112.63 3du8 s TYR 234 Ca 0.47 1.39 0.03 0.00 -0.52 0.00 0.00 57.07 58.43 3du8 s TYR 234 Cb 0.41 -2.92 0.03 0.00 0.38 0.00 0.00 41.96 39.85 3du8 s TYR 234 CO 0.03 -1.34 0.22 0.25 -1.52 0.00 0.00 175.55 173.18 3du8 n THR 235 N -3.20 0.00 0.27 -3.49 -2.24 -1.26 -4.98 114.28 99.39 3du8 n THR 235 Ca 0.08 -1.96 0.17 0.00 -2.27 0.00 0.00 64.05 60.07 3du8 n THR 235 Cb 0.54 0.11 0.87 0.00 -2.10 0.00 0.00 70.33 69.75 3du8 n THR 235 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3du8 h SER 236 N 0.76 0.00 0.00 3.42 0.02 -1.96 -2.73 113.55 113.06 3du8 h SER 236 Ca -0.33 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 3du8 h SER 236 Cb 1.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.64 3du8 h SER 236 CO 0.52 0.00 0.00 -1.54 -1.14 0.00 0.00 176.83 174.67 3du8 n SER 237 N -2.70 0.00 0.06 3.07 3.41 -1.26 -1.97 113.62 114.23 3du8 n SER 237 Ca -0.02 -0.31 -0.06 0.00 -0.26 0.00 0.00 58.87 58.22 3du8 n SER 237 Cb 0.09 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.17 3du8 n SER 237 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 175.04 175.04 3du8 h ILE 238 N 0.00 1.35 -0.56 -1.33 3.07 -1.89 -2.71 117.51 115.44 3du8 h ILE 238 Ca 0.00 -1.84 0.04 0.00 1.55 0.00 0.00 64.86 64.61 3du8 h ILE 238 Cb 0.00 1.87 -0.03 0.00 -0.27 0.00 0.00 36.82 38.39 3du8 h ILE 238 CO 0.00 0.55 0.37 0.44 -1.05 0.00 0.00 178.15 178.46 3du8 h ASP 239 N 0.25 0.54 -0.02 2.16 3.32 -1.67 -1.02 116.42 119.98 3du8 h ASP 239 Ca 0.00 -0.01 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 3du8 h ASP 239 Cb 1.05 -0.12 0.01 0.00 0.22 0.00 0.00 39.33 40.48 3du8 h ASP 239 CO 0.09 0.37 -0.32 0.58 -1.72 0.00 0.00 179.24 178.24 3du8 h VAL 240 N 0.62 1.48 -0.77 -1.35 2.07 -1.66 0.16 116.25 116.81 3du8 h VAL 240 Ca 0.23 -1.88 0.10 0.00 0.82 0.00 0.00 66.70 65.97 3du8 h VAL 240 Cb 0.13 2.58 -0.12 0.00 -1.52 0.00 0.00 31.29 32.36 3du8 h VAL 240 CO -0.06 0.53 -0.49 -0.25 0.02 0.00 0.00 177.57 177.32 3du8 h TRP 241 N -0.33 -1.47 -0.73 1.57 2.91 -1.33 0.44 115.95 117.02 3du8 h TRP 241 Ca -0.03 0.10 0.07 0.00 1.13 0.00 0.00 58.89 60.16 3du8 h TRP 241 Cb 1.03 0.75 -0.06 0.00 -0.51 0.00 0.00 29.16 30.37 3du8 h TRP 241 CO 0.16 -0.41 0.41 0.77 -1.03 0.00 0.00 178.44 178.33 3du8 h SER 242 N -0.14 0.59 -0.61 2.65 0.02 -0.94 -1.51 113.55 113.62 3du8 h SER 242 Ca 0.20 0.04 -0.07 0.00 -0.84 0.00 0.00 61.79 61.12 3du8 h SER 242 Cb 0.53 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.96 3du8 h SER 242 CO -0.81 0.37 0.13 0.00 -1.14 0.00 0.00 176.83 175.38 3du8 h ALA 243 N 1.39 1.04 -0.50 3.77 0.00 -0.22 -0.40 119.26 124.34 3du8 h ALA 243 Ca 0.34 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3du8 h ALA 243 Cb 0.25 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3du8 h ALA 243 CO -0.21 0.63 0.24 0.78 0.00 0.00 0.00 179.25 180.69 3du8 h GLY 244 N 1.04 0.74 1.14 0.00 0.00 -0.14 -1.10 103.07 104.75 3du8 h GLY 244 Ca 0.20 -0.33 -0.12 0.00 0.00 0.00 0.00 47.33 47.08 3du8 h GLY 244 CO 0.00 0.32 -0.15 0.00 0.00 0.00 0.00 176.54 176.71 3du8 h VAL 246 N 0.87 1.02 0.39 0.00 2.07 -0.34 -1.92 116.25 118.35 3du8 h VAL 246 Ca 0.13 -0.09 -0.02 0.00 0.82 0.00 0.00 66.70 67.54 3du8 h VAL 246 Cb 0.72 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 3du8 h VAL 246 CO 0.05 0.05 -0.20 0.25 0.02 0.00 0.00 177.57 177.74 3du8 h LEU 247 N 0.26 -0.49 -1.11 2.57 5.85 -1.15 -1.32 115.31 119.92 3du8 h LEU 247 Ca 0.09 0.02 0.16 0.00 0.84 0.00 0.00 57.88 58.99 3du8 h LEU 247 Cb -0.00 0.13 -0.09 0.00 0.37 0.00 0.00 40.66 41.07 3du8 h LEU 247 CO -0.04 -0.34 0.61 0.00 -0.34 0.00 0.00 178.44 178.33 3du8 h ALA 248 N 0.06 1.71 -0.26 1.25 0.00 -1.33 -0.88 119.26 119.80 3du8 h ALA 248 Ca -0.05 0.04 -0.20 0.00 0.00 0.00 0.00 54.91 54.70 3du8 h ALA 248 Cb 0.43 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3du8 h ALA 248 CO 0.08 -0.00 -0.61 1.49 0.00 0.00 0.00 179.25 180.21 3du8 h GLU 249 N 0.80 0.86 -0.97 0.00 4.81 -1.09 0.14 114.58 119.13 3du8 h GLU 249 Ca 0.52 -0.58 0.04 0.00 -0.13 0.00 0.00 59.36 59.21 3du8 h GLU 249 Cb 0.75 0.08 -0.06 0.00 0.63 0.00 0.00 28.75 30.16 3du8 h GLU 249 CO -0.29 1.21 0.63 -0.07 -0.73 0.00 0.00 179.01 179.77 3du8 h LEU 250 N 0.64 1.04 -0.07 1.64 3.38 -0.81 -0.86 115.31 120.27 3du8 h LEU 250 Ca -0.00 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 3du8 h LEU 250 Cb 1.22 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.74 3du8 h LEU 250 CO 0.13 0.70 -0.27 -0.07 0.09 0.00 0.00 178.44 179.02 3du8 h LEU 251 N 1.20 0.37 -0.63 1.67 3.38 -0.80 -3.35 115.31 117.14 3du8 h LEU 251 Ca 0.39 -0.63 -0.13 0.00 0.09 0.00 0.00 57.88 57.61 3du8 h LEU 251 Cb 0.05 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 3du8 h LEU 251 CO -0.13 0.93 -0.61 -0.07 0.09 0.00 0.00 178.44 178.65 3du8 h LEU 252 N -0.18 0.00 0.00 1.67 3.38 -0.68 -3.46 115.31 116.04 3du8 h LEU 252 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3du8 h LEU 252 Cb 0.91 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.66 3du8 h LEU 252 CO 0.06 0.61 0.00 0.61 0.09 0.00 0.00 178.44 179.81 3du8 n GLY 253 N 0.49 0.87 3.41 0.83 0.00 -0.33 -5.01 105.19 105.44 3du8 n GLY 253 Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 3du8 n GLY 253 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3du8 s GLN 254 N -0.39 1.24 0.32 1.61 -2.07 -1.21 -4.84 119.66 114.33 3du8 s GLN 254 Ca 0.00 -0.57 -0.29 0.00 -1.82 0.00 0.00 55.36 52.69 3du8 s GLN 254 Cb 0.00 0.55 -0.13 0.00 -1.09 0.00 0.00 33.01 32.35 3du8 s GLN 254 CO 0.00 -0.53 1.27 -2.30 -1.32 0.00 0.00 175.29 172.41 3du8 n PRO 255 N -0.34 2.00 0.09 9.60 -0.02 -1.26 -4.36 135.00 140.71 3du8 n PRO 255 Ca -0.16 0.70 -0.13 0.00 -2.02 0.00 0.00 63.50 61.89 3du8 n PRO 255 Cb 0.64 -2.26 -0.10 0.00 -0.02 0.00 0.00 33.50 31.76 3du8 n PRO 255 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 3du8 h ILE 256 N 2.54 1.51 -2.22 4.25 2.10 -1.88 -3.39 117.51 120.42 3du8 h ILE 256 Ca -0.45 -2.95 -0.58 0.00 1.08 0.00 0.00 64.86 61.96 3du8 h ILE 256 Cb 1.29 2.79 -0.42 0.00 -1.09 0.00 0.00 36.82 39.39 3du8 h ILE 256 CO 0.64 0.86 -0.71 0.49 -1.08 0.00 0.00 178.15 178.36 3du8 n PHE 257 N -3.56 3.32 -1.69 2.19 3.72 -1.26 -4.88 117.46 115.30 3du8 n PHE 257 Ca -0.07 -4.00 -0.29 0.00 -0.05 0.00 0.00 57.45 53.04 3du8 n PHE 257 Cb 0.95 -0.49 0.13 0.00 -0.94 0.00 0.00 39.48 39.13 3du8 n PHE 257 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 3du8 s PRO 258 N -2.98 1.21 0.00 -1.08 0.04 -1.26 -4.44 135.00 126.50 3du8 s PRO 258 Ca 0.45 0.12 0.00 0.00 0.04 0.00 0.00 61.00 61.60 3du8 s PRO 258 Cb 0.25 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.92 3du8 s PRO 258 CO -0.10 -2.11 0.00 0.41 0.04 0.00 0.00 177.00 175.24 3du8 n GLY 259 N -2.72 4.19 0.07 0.56 0.00 -1.26 -4.16 105.19 101.87 3du8 n GLY 259 Ca 0.09 -0.43 0.13 0.00 0.00 0.00 0.00 46.02 45.81 3du8 n GLY 259 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3du8 n ASP 260 N 0.00 0.63 -4.26 1.61 10.43 -1.26 -4.76 116.55 118.94 3du8 n ASP 260 Ca 0.00 0.36 -0.14 0.00 2.57 0.00 0.00 54.79 57.58 3du8 n ASP 260 Cb 0.00 -0.37 -0.10 0.00 1.84 0.00 0.00 41.12 42.49 3du8 n ASP 260 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 3du8 s SER 261 N -4.08 1.65 0.31 -2.24 1.04 -1.26 -5.04 113.70 104.09 3du8 s SER 261 Ca 0.10 -1.08 0.07 0.00 0.48 0.00 0.00 55.95 55.52 3du8 s SER 261 Cb 0.14 0.02 0.78 0.00 0.10 0.00 0.00 66.02 67.07 3du8 s SER 261 CO 0.63 -0.41 1.76 1.23 0.98 0.00 0.00 173.24 177.43 3du8 h GLY 262 N 2.73 1.81 0.96 7.32 0.00 -1.96 -2.00 103.07 111.93 3du8 h GLY 262 Ca -0.37 -0.35 -0.05 0.00 0.00 0.00 0.00 47.33 46.57 3du8 h GLY 262 CO 0.64 -0.11 0.11 -2.08 0.00 0.00 0.00 176.54 175.10 3du8 h VAL 263 N 0.71 1.24 -0.15 4.60 2.07 -1.98 -0.44 116.25 122.30 3du8 h VAL 263 Ca 0.60 -0.83 -0.10 0.00 0.82 0.00 0.00 66.70 67.18 3du8 h VAL 263 Cb 0.99 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 3du8 h VAL 263 CO -0.40 0.30 -0.36 0.44 0.02 0.00 0.00 177.57 177.56 3du8 h ASP 264 N 0.63 0.33 -0.03 0.57 3.32 -1.76 -2.12 116.42 117.36 3du8 h ASP 264 Ca 0.15 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 3du8 h ASP 264 Cb 0.33 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.79 3du8 h ASP 264 CO 0.00 0.67 -0.01 1.56 -1.72 0.00 0.00 179.24 179.74 3du8 h GLN 265 N 0.27 0.05 -0.99 3.56 4.20 -0.88 -2.56 115.11 118.76 3du8 h GLN 265 Ca 0.03 -0.02 0.12 0.00 0.06 0.00 0.00 58.65 58.84 3du8 h GLN 265 Cb 0.76 -0.00 -0.08 0.00 0.30 0.00 0.00 27.48 28.46 3du8 h GLN 265 CO 0.06 0.40 0.62 -0.07 -0.67 0.00 0.00 178.83 179.18 3du8 h LEU 266 N -0.31 0.92 -0.68 1.46 3.38 -1.04 0.54 115.31 119.57 3du8 h LEU 266 Ca 0.01 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 3du8 h LEU 266 Cb 0.39 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 3du8 h LEU 266 CO 0.00 0.50 0.42 0.58 0.09 0.00 0.00 178.44 180.02 3du8 h VAL 267 N 0.99 1.20 -0.57 1.22 2.07 -1.27 0.49 116.25 120.38 3du8 h VAL 267 Ca 0.49 -0.43 -0.07 0.00 0.82 0.00 0.00 66.70 67.51 3du8 h VAL 267 Cb 0.46 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 3du8 h VAL 267 CO -0.26 0.20 0.07 -0.33 0.02 0.00 0.00 177.57 177.27 3du8 h GLU 268 N 0.93 0.93 -0.22 1.57 4.39 -0.83 -1.37 114.58 119.99 3du8 h GLU 268 Ca 0.25 -0.24 -0.02 0.00 0.34 0.00 0.00 59.36 59.69 3du8 h GLU 268 Cb -0.04 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.49 3du8 h GLU 268 CO -0.05 0.88 0.06 0.82 -1.16 0.00 0.00 179.01 179.57 3du8 h ILE 269 N 0.88 1.20 -0.42 3.13 2.04 -0.53 -3.12 117.51 120.69 3du8 h ILE 269 Ca 0.18 -0.63 -0.11 0.00 1.00 0.00 0.00 64.86 65.29 3du8 h ILE 269 Cb 0.42 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 3du8 h ILE 269 CO 0.01 0.20 -0.18 0.40 0.00 0.00 0.00 178.15 178.59 3du8 h ILE 270 N 0.18 1.27 -0.79 -0.67 2.04 -0.79 0.49 117.51 119.24 3du8 h ILE 270 Ca 0.07 -1.28 0.16 0.00 1.00 0.00 0.00 64.86 64.82 3du8 h ILE 270 Cb 0.25 1.13 -0.05 0.00 -0.74 0.00 0.00 36.82 37.41 3du8 h ILE 270 CO -0.00 0.43 0.53 0.11 0.00 0.00 0.00 178.15 179.22 3du8 h LYS 271 N 0.71 0.38 0.00 2.37 1.57 -1.21 0.25 116.57 120.64 3du8 h LYS 271 Ca 0.11 -0.02 -0.12 0.00 -1.87 0.00 0.00 60.65 58.75 3du8 h LYS 271 Cb 0.68 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.89 3du8 h LYS 271 CO 0.05 0.25 -0.87 0.28 -0.57 0.00 0.00 179.45 178.59 3du8 h VAL 272 N 0.39 0.45 0.00 0.50 2.07 -1.26 -3.23 116.25 115.17 3du8 h VAL 272 Ca 0.39 -1.59 0.00 0.00 0.82 0.00 0.00 66.70 66.32 3du8 h VAL 272 Cb 0.95 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 3du8 h VAL 272 CO -0.12 0.15 -0.19 -0.07 0.02 0.00 0.00 177.57 177.36 3du8 h LEU 273 N -1.00 0.00 0.00 2.57 3.38 -0.97 -2.40 115.31 116.89 3du8 h LEU 273 Ca -0.17 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.77 3du8 h LEU 273 Cb 0.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.65 3du8 h LEU 273 CO -0.11 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.05 3du8 n GLY 274 N 1.20 -0.57 3.73 0.83 0.00 0.08 -4.54 105.19 105.92 3du8 n GLY 274 Ca 0.04 -1.69 -0.42 0.00 0.00 0.00 0.00 46.02 43.95 3du8 n GLY 274 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3du8 s THR 275 N -2.30 2.49 0.37 2.61 2.01 -0.34 -4.56 115.64 115.93 3du8 s THR 275 Ca 0.00 0.38 -0.25 0.00 0.31 0.00 0.00 61.69 62.13 3du8 s THR 275 Cb 0.00 -3.24 -0.09 0.00 0.01 0.00 0.00 72.50 69.18 3du8 s THR 275 CO 0.00 0.05 1.08 -2.16 -0.69 0.00 0.00 174.62 172.90 3du8 s PRO 276 N 0.29 4.25 0.88 4.92 0.04 -1.26 -5.01 135.00 139.11 3du8 s PRO 276 Ca 0.65 1.64 -0.12 0.00 0.04 0.00 0.00 61.00 63.21 3du8 s PRO 276 Cb -0.44 -2.71 0.12 0.00 0.04 0.00 0.00 34.50 31.50 3du8 s PRO 276 CO 0.39 -0.09 1.11 0.95 0.04 0.00 0.00 177.00 179.39 3du8 s THR 277 N -1.50 2.47 0.42 1.26 -4.23 -1.26 -4.80 115.64 108.00 3du8 s THR 277 Ca 0.55 0.15 0.09 0.00 -1.18 0.00 0.00 61.69 61.30 3du8 s THR 277 Cb -0.26 -2.84 0.27 0.00 1.34 0.00 0.00 72.50 71.02 3du8 s THR 277 CO 0.33 -0.20 2.06 0.03 -0.54 0.00 0.00 174.62 176.30 3du8 h ARG 278 N -1.41 0.47 -0.02 3.99 3.08 -1.98 -0.71 114.38 117.79 3du8 h ARG 278 Ca -0.50 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 59.52 3du8 h ARG 278 Cb 1.30 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 31.25 3du8 h ARG 278 CO 0.60 0.31 0.00 1.49 -1.07 0.00 0.00 179.97 181.30 3du8 h GLU 279 N 0.48 0.04 -0.95 0.04 4.81 -1.99 -1.66 114.58 115.35 3du8 h GLU 279 Ca 0.15 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.36 3du8 h GLU 279 Cb -0.00 -0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.33 3du8 h GLU 279 CO -0.03 0.26 0.59 1.96 -0.73 0.00 0.00 179.01 181.06 3du8 h GLN 280 N -0.20 1.28 -0.95 1.92 4.20 -1.82 -1.24 115.11 118.30 3du8 h GLN 280 Ca 0.01 -0.11 -0.00 0.00 0.06 0.00 0.00 58.65 58.61 3du8 h GLN 280 Cb 0.25 -0.27 -0.05 0.00 0.30 0.00 0.00 27.48 27.71 3du8 h GLN 280 CO 0.00 0.88 0.58 0.82 -0.67 0.00 0.00 178.83 180.44 3du8 h ILE 281 N 1.30 1.26 -0.09 2.54 2.04 -1.09 -2.13 117.51 121.35 3du8 h ILE 281 Ca 0.34 -0.55 -0.14 0.00 1.00 0.00 0.00 64.86 65.51 3du8 h ILE 281 Cb -0.08 -0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 35.90 3du8 h ILE 281 CO -0.07 0.27 -0.56 -0.09 0.00 0.00 0.00 178.15 177.71 3du8 h ARG 282 N 1.30 0.26 -0.23 2.37 2.43 -0.42 0.80 114.38 120.90 3du8 h ARG 282 Ca 0.34 -0.16 -0.01 0.00 -0.81 0.00 0.00 59.98 59.34 3du8 h ARG 282 Cb -0.07 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 3du8 h ARG 282 CO -0.06 0.75 0.10 0.93 -1.51 0.00 0.00 179.97 180.17 3du8 h GLU 283 N 0.20 0.34 0.41 0.20 4.39 -0.91 -3.29 114.58 115.92 3du8 h GLU 283 Ca 0.00 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.62 3du8 h GLU 283 Cb 1.04 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.64 3du8 h GLU 283 CO 0.09 0.38 -0.20 0.52 -1.16 0.00 0.00 179.01 178.64 3du8 h MET 284 N 0.23 -0.54 0.00 2.33 2.86 -1.34 -3.45 114.93 115.03 3du8 h MET 284 Ca 0.08 0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 3du8 h MET 284 Cb 0.16 0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.94 3du8 h MET 284 CO -0.01 -0.23 0.00 -1.71 1.06 0.00 0.00 176.91 176.02 3du8 n ASN 285 N -5.18 0.00 -4.56 1.22 2.85 0.27 -4.76 115.26 105.11 3du8 n ASN 285 Ca -0.09 0.00 -0.14 0.00 -0.11 0.00 0.00 54.58 54.23 3du8 n ASN 285 Cb 0.28 0.00 -0.07 0.00 1.24 0.00 0.00 39.78 41.24 3du8 n ASN 285 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 3du8 n PRO 286 N 0.00 0.59 -2.74 1.20 -0.02 -1.26 -4.67 135.00 128.09 3du8 n PRO 286 Ca 0.00 -0.80 -0.08 0.00 -2.02 0.00 0.00 63.50 60.60 3du8 n PRO 286 Cb 0.00 -3.69 0.06 0.00 -0.02 0.00 0.00 33.50 29.85 3du8 n PRO 286 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3du8 n PHE 293 N 18.60 -3.20 -2.95 6.00 3.01 -1.26 -4.95 117.46 132.70 3du8 n PHE 293 Ca 0.46 -1.78 -0.37 0.00 1.01 0.00 0.00 57.45 56.77 3du8 n PHE 293 Cb 0.44 1.57 -0.06 0.00 -0.01 0.00 0.00 39.48 41.41 3du8 n PHE 293 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 3du8 s PRO 294 N 0.62 4.47 -0.94 -1.08 0.05 -1.26 -5.05 135.00 131.80 3du8 s PRO 294 Ca 0.30 1.12 -0.07 0.00 0.05 0.00 0.00 61.00 62.40 3du8 s PRO 294 Cb 0.24 -2.97 0.24 0.00 0.05 0.00 0.00 34.50 32.06 3du8 s PRO 294 CO -0.22 0.41 0.88 -1.14 0.05 0.00 0.00 177.00 176.98 3du8 s GLN 295 N -1.76 3.65 -0.09 4.56 2.00 -1.26 -4.71 119.66 122.06 3du8 s GLN 295 Ca 0.43 -3.01 0.02 0.00 -2.00 0.00 0.00 55.36 50.80 3du8 s GLN 295 Cb -0.19 -4.28 -0.02 0.00 0.80 0.00 0.00 33.01 29.32 3du8 s GLN 295 CO 0.24 -1.25 -0.13 0.42 -0.50 0.00 0.00 175.29 174.06 3du8 s ILE 296 N -0.87 3.10 0.39 -2.34 1.09 -1.26 -5.01 121.20 116.29 3du8 s ILE 296 Ca 0.26 -0.68 -0.17 0.00 -1.10 0.00 0.00 60.65 58.95 3du8 s ILE 296 Cb -0.10 -2.26 -0.10 0.00 -1.06 0.00 0.00 42.46 38.95 3du8 s ILE 296 CO -0.09 0.56 0.85 -0.75 -0.10 0.00 0.00 174.94 175.41 3du8 s LYS 297 N -0.24 4.07 0.23 2.79 2.20 -1.26 -1.19 119.74 126.34 3du8 s LYS 297 Ca 0.01 0.86 -0.31 0.00 -0.36 0.00 0.00 55.97 56.17 3du8 s LYS 297 Cb -0.13 -2.30 -0.12 0.00 -1.51 0.00 0.00 37.83 33.77 3du8 s LYS 297 CO 0.03 0.03 1.69 0.00 -0.36 0.00 0.00 175.35 176.73 3du8 n ALA 298 N -0.66 2.76 -2.18 3.13 0.00 -1.26 -4.62 120.51 117.68 3du8 n ALA 298 Ca 0.05 0.39 -0.43 0.00 0.00 0.00 0.00 53.44 53.45 3du8 n ALA 298 Cb 0.54 -2.51 -0.02 0.00 0.00 0.00 0.00 19.45 17.45 3du8 n ALA 298 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3du8 s HIS 299 N 0.82 2.15 -0.09 0.00 2.46 -0.91 -4.91 115.29 114.82 3du8 s HIS 299 Ca 0.72 0.64 -0.32 0.00 0.47 0.00 0.00 55.06 56.56 3du8 s HIS 299 Cb -0.50 -4.15 -0.10 0.00 -0.13 0.00 0.00 32.58 27.70 3du8 s HIS 299 CO 0.37 -2.51 1.97 -0.35 -2.47 0.00 0.00 174.74 171.74 3du8 n PRO 300 N 8.05 2.28 0.05 2.88 -0.04 -1.26 -4.76 135.00 142.20 3du8 n PRO 300 Ca 0.19 0.81 0.20 0.00 -0.04 0.00 0.00 63.50 64.66 3du8 n PRO 300 Cb 0.47 -2.80 0.58 0.00 -0.04 0.00 0.00 33.50 31.71 3du8 n PRO 300 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3du8 h TRP 301 N 10.43 0.00 -0.24 0.54 4.06 -1.92 0.13 115.95 128.95 3du8 h TRP 301 Ca -0.47 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 60.37 3du8 h TRP 301 Cb 1.26 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.41 3du8 h TRP 301 CO 0.91 0.00 -0.33 1.15 -3.56 0.00 0.00 178.44 176.61 3du8 h THR 302 N 0.00 1.29 0.00 1.49 2.02 -1.94 -2.46 112.91 113.30 3du8 h THR 302 Ca 0.25 -1.43 -0.01 0.00 0.77 0.00 0.00 66.41 65.99 3du8 h THR 302 Cb 1.72 1.46 -0.00 0.00 -1.74 0.00 0.00 68.15 69.59 3du8 h THR 302 CO -0.00 0.45 -0.02 0.50 0.37 0.00 0.00 175.52 176.81 3du8 h LYS 303 N 0.44 0.00 -0.43 6.66 3.64 -1.32 -3.22 116.57 122.35 3du8 h LYS 303 Ca 0.05 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.29 3du8 h LYS 303 Cb 0.79 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 3du8 h LYS 303 CO 0.06 0.02 -0.30 0.28 -2.27 0.00 0.00 179.45 177.25 3du8 h VAL 304 N 0.00 1.27 -2.00 2.00 2.07 -1.52 -3.46 116.25 114.61 3du8 h VAL 304 Ca -0.00 -1.47 -0.47 0.00 0.82 0.00 0.00 66.70 65.58 3du8 h VAL 304 Cb 0.33 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 3du8 h VAL 304 CO 0.00 0.50 -0.43 -0.36 0.02 0.00 0.00 177.57 177.30 3du8 s PHE 305 N -4.52 3.14 0.93 1.57 0.08 -1.22 -5.04 117.98 112.92 3du8 s PHE 305 Ca -0.11 -0.17 -0.11 0.00 0.12 0.00 0.00 56.93 56.66 3du8 s PHE 305 Cb 0.11 -1.71 0.15 0.00 -0.57 0.00 0.00 43.02 41.01 3du8 s PHE 305 CO 0.87 0.27 1.11 -0.98 -0.10 0.00 0.00 175.22 176.39 3du8 s ARG 306 N -4.01 0.93 0.32 0.44 1.70 -1.26 -4.93 118.95 112.15 3du8 s ARG 306 Ca 0.38 1.26 0.04 0.00 -0.47 0.00 0.00 55.73 56.95 3du8 s ARG 306 Cb -0.08 -1.74 0.67 0.00 -0.57 0.00 0.00 34.95 33.23 3du8 s ARG 306 CO 0.28 -2.59 1.87 -1.35 -1.08 0.00 0.00 175.30 172.42 3du8 h PRO 307 N -1.83 0.84 -0.63 3.89 0.11 -1.99 -2.80 132.00 129.59 3du8 h PRO 307 Ca -0.47 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3du8 h PRO 307 Cb 1.27 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3du8 h PRO 307 CO 0.47 0.56 0.00 0.54 -0.21 0.00 0.00 178.00 179.35 3du8 n ARG 308 N -4.57 4.31 -1.69 1.05 1.74 -1.26 -4.96 116.66 111.28 3du8 n ARG 308 Ca 0.17 -2.80 -0.42 0.00 -0.77 0.00 0.00 57.85 54.03 3du8 n ARG 308 Cb 0.37 -2.12 -0.03 0.00 -1.02 0.00 0.00 32.46 29.66 3du8 n ARG 308 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 3du8 n THR 309 N 0.67 0.38 -1.67 0.55 -1.04 -1.06 -4.89 114.28 107.21 3du8 n THR 309 Ca 0.25 -0.07 -0.46 0.00 -2.04 0.00 0.00 64.05 61.73 3du8 n THR 309 Cb 1.05 -2.12 -0.04 0.00 -1.82 0.00 0.00 70.33 67.39 3du8 n THR 309 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 3du8 n PRO 310 N 5.69 2.22 -0.29 -2.82 -0.02 -1.26 -4.84 135.00 133.68 3du8 n PRO 310 Ca 0.18 0.81 0.26 0.00 -2.02 0.00 0.00 63.50 62.73 3du8 n PRO 310 Cb 0.37 -2.61 0.60 0.00 -0.02 0.00 0.00 33.50 31.85 3du8 n PRO 310 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3du8 h PRO 311 N 7.04 0.23 -0.25 0.52 0.11 -1.98 -1.07 132.00 136.59 3du8 h PRO 311 Ca -0.46 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.59 3du8 h PRO 311 Cb 1.26 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 3du8 h PRO 311 CO 0.91 0.15 -0.06 0.93 -0.21 0.00 0.00 178.00 179.72 3du8 h GLU 312 N 0.23 0.40 0.05 1.05 3.07 -1.97 -0.21 114.58 117.21 3du8 h GLU 312 Ca 0.54 -0.09 -0.00 0.00 -0.50 0.00 0.00 59.36 59.31 3du8 h GLU 312 Cb 1.68 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 29.53 3du8 h GLU 312 CO -0.16 0.47 -0.03 0.00 -1.40 0.00 0.00 179.01 177.90 3du8 h ALA 313 N 1.57 -0.07 -0.62 3.43 0.00 -1.56 -0.34 119.26 121.66 3du8 h ALA 313 Ca 0.08 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.87 3du8 h ALA 313 Cb 0.35 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 3du8 h ALA 313 CO 0.02 -0.35 0.30 0.82 0.00 0.00 0.00 179.25 180.04 3du8 h ILE 314 N -0.46 0.89 -0.49 0.00 2.04 -1.31 -0.66 117.51 117.52 3du8 h ILE 314 Ca -0.01 -0.19 -0.12 0.00 1.00 0.00 0.00 64.86 65.55 3du8 h ILE 314 Cb 0.41 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 3du8 h ILE 314 CO 0.01 0.10 -0.15 0.00 0.00 0.00 0.00 178.15 178.11 3du8 h ALA 315 N 1.36 0.80 -0.06 1.87 0.00 -0.93 -1.23 119.26 121.06 3du8 h ALA 315 Ca 0.29 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3du8 h ALA 315 Cb 0.26 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3du8 h ALA 315 CO -0.22 0.66 0.03 1.25 0.00 0.00 0.00 179.25 180.97 3du8 h LEU 316 N 0.84 0.08 -0.44 0.00 5.85 -0.50 -2.84 115.31 118.30 3du8 h LEU 316 Ca 0.12 -0.09 0.09 0.00 0.84 0.00 0.00 57.88 58.85 3du8 h LEU 316 Cb 0.70 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.63 3du8 h LEU 316 CO 0.05 0.14 -0.08 0.00 -0.34 0.00 0.00 178.44 178.22 3du8 h SER 318 N 0.03 0.00 0.11 0.00 4.64 -1.14 -0.14 113.55 117.05 3du8 h SER 318 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 3du8 h SER 318 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 3du8 h SER 318 CO -0.43 0.00 -0.76 0.54 -0.87 0.00 0.00 176.83 175.31 3du8 n ARG 319 N -3.48 0.26 -0.04 4.77 5.12 -0.70 -4.08 116.66 118.52 3du8 n ARG 319 Ca -0.03 -0.21 -0.22 0.00 -1.93 0.00 0.00 57.85 55.47 3du8 n ARG 319 Cb 0.08 -1.50 -0.13 0.00 -1.16 0.00 0.00 32.46 29.75 3du8 n ARG 319 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3du8 n LEU 320 N -1.19 2.41 -3.97 0.55 4.77 -0.84 -1.81 117.00 116.92 3du8 n LEU 320 Ca 0.06 0.26 -0.43 0.00 -0.03 0.00 0.00 56.01 55.87 3du8 n LEU 320 Cb 0.36 -1.06 0.01 0.00 -2.33 0.00 0.00 43.42 40.39 3du8 n LEU 320 CO 0.38 0.68 1.59 0.18 -1.33 0.00 0.00 177.39 178.89 3du8 n LEU 321 N -3.77 6.43 -4.49 2.23 4.77 -0.12 -4.28 117.00 117.77 3du8 n LEU 321 Ca -0.33 -4.84 -0.32 0.00 -0.03 0.00 0.00 56.01 50.48 3du8 n LEU 321 Cb 0.93 -1.42 -0.13 0.00 -2.33 0.00 0.00 43.42 40.48 3du8 n LEU 321 CO 0.34 1.44 -0.45 -1.61 -1.33 0.00 0.00 177.39 175.78 3du8 s GLU 322 N -0.67 2.45 0.10 3.23 0.41 -1.26 -4.87 118.70 118.08 3du8 s GLU 322 Ca 0.37 -0.74 -0.24 0.00 -0.41 0.00 0.00 54.97 53.94 3du8 s GLU 322 Cb 0.06 -2.36 -0.13 0.00 -1.78 0.00 0.00 34.13 29.92 3du8 s GLU 322 CO 0.04 0.61 1.71 1.88 -0.49 0.00 0.00 175.26 179.00 3du8 h TYR 323 N 5.14 -0.22 -2.78 1.61 0.99 -1.96 -3.41 116.97 116.34 3du8 h TYR 323 Ca -0.47 0.00 -0.57 0.00 2.00 0.00 0.00 58.73 59.69 3du8 h TYR 323 Cb 1.15 0.08 -0.03 0.00 1.00 0.00 0.00 36.73 38.94 3du8 h TYR 323 CO 0.51 -0.13 1.17 0.99 -0.00 0.00 0.00 178.16 180.70 3du8 s THR 324 N -6.16 3.64 0.17 -2.88 2.01 -1.26 -4.65 115.64 106.51 3du8 s THR 324 Ca -0.14 0.70 -0.19 0.00 0.31 0.00 0.00 61.69 62.37 3du8 s THR 324 Cb 0.06 -3.73 0.11 0.00 0.01 0.00 0.00 72.50 68.95 3du8 s THR 324 CO 0.66 -0.37 1.63 -0.65 -0.69 0.00 0.00 174.62 175.20 3du8 h PRO 325 N 11.36 -0.12 0.00 4.92 0.11 -1.87 -0.39 132.00 146.00 3du8 h PRO 325 Ca -0.33 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.79 3du8 h PRO 325 Cb 1.15 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3du8 h PRO 325 CO 1.02 -0.08 0.00 1.79 -0.21 0.00 0.00 178.00 180.52 3du8 h THR 326 N -0.12 0.00 0.00 -1.15 1.35 -1.96 -2.51 112.91 108.52 3du8 h THR 326 Ca 0.20 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 65.89 3du8 h THR 326 Cb 0.44 0.91 0.00 0.00 -1.73 0.00 0.00 68.15 67.77 3du8 h THR 326 CO -0.50 0.00 -0.03 0.00 -0.25 0.00 0.00 175.52 174.74 3du8 n ALA 327 N -1.87 2.37 -1.78 6.62 0.00 -0.16 -4.89 120.51 120.80 3du8 n ALA 327 Ca 0.00 -0.09 -0.36 0.00 0.00 0.00 0.00 53.44 52.98 3du8 n ALA 327 Cb 0.16 -1.45 -0.04 0.00 0.00 0.00 0.00 19.45 18.12 3du8 n ALA 327 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3du8 s ARG 328 N -3.03 4.12 0.50 0.00 0.52 -0.95 -4.95 118.95 115.16 3du8 s ARG 328 Ca 0.13 1.53 -0.22 0.00 -0.52 0.00 0.00 55.73 56.65 3du8 s ARG 328 Cb 0.17 -2.52 -0.08 0.00 0.52 0.00 0.00 34.95 33.04 3du8 s ARG 328 CO 0.56 -0.18 1.03 1.28 0.02 0.00 0.00 175.30 178.00 3du8 n LEU 329 N -0.13 3.27 -4.84 2.53 4.77 -0.75 -5.00 117.00 116.85 3du8 n LEU 329 Ca 0.05 0.95 -0.32 0.00 -0.03 0.00 0.00 56.01 56.66 3du8 n LEU 329 Cb 0.50 -1.39 0.01 0.00 -2.33 0.00 0.00 43.42 40.20 3du8 n LEU 329 CO 0.45 -1.52 0.71 0.42 -1.33 0.00 0.00 177.39 176.12 3du8 s THR 330 N -1.37 4.35 0.29 -5.08 -4.23 -1.26 -4.89 115.64 103.45 3du8 s THR 330 Ca 0.68 0.91 0.04 0.00 -1.18 0.00 0.00 61.69 62.14 3du8 s THR 330 Cb -0.49 -3.64 0.28 0.00 1.34 0.00 0.00 72.50 70.00 3du8 s THR 330 CO 0.53 -0.86 1.75 -0.65 -0.54 0.00 0.00 174.62 174.86 3du8 h PRO 331 N 0.02 0.63 -0.22 3.99 0.11 -1.92 -0.80 132.00 133.81 3du8 h PRO 331 Ca -0.45 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.54 3du8 h PRO 331 Cb 1.20 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 3du8 h PRO 331 CO 0.60 0.42 -0.16 1.25 -0.21 0.00 0.00 178.00 179.89 3du8 h LEU 332 N 0.65 0.53 -1.58 2.35 5.85 -1.94 -1.31 115.31 119.85 3du8 h LEU 332 Ca 0.55 -0.45 0.09 0.00 0.84 0.00 0.00 57.88 58.92 3du8 h LEU 332 Cb 0.89 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.73 3du8 h LEU 332 CO -0.41 0.86 0.42 -0.33 -0.34 0.00 0.00 178.44 178.64 3du8 h GLU 333 N 0.20 0.46 -0.17 1.25 5.08 -1.86 -2.75 114.58 116.78 3du8 h GLU 333 Ca 0.04 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.31 3du8 h GLU 333 Cb 0.69 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.83 3du8 h GLU 333 CO 0.04 0.31 -0.15 0.00 -1.00 0.00 0.00 179.01 178.21 3du8 h ALA 334 N 1.68 0.25 -0.43 3.43 0.00 -0.68 -2.56 119.26 120.95 3du8 h ALA 334 Ca 0.29 -0.32 0.12 0.00 0.00 0.00 0.00 54.91 54.99 3du8 h ALA 334 Cb 0.49 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 3du8 h ALA 334 CO -0.08 0.14 0.44 0.00 0.00 0.00 0.00 179.25 179.74 3du8 n ALA 336 N -2.37 2.97 -1.71 0.00 0.00 -0.99 -4.80 120.51 113.61 3du8 n ALA 336 Ca 0.08 -0.53 -0.35 0.00 0.00 0.00 0.00 53.44 52.63 3du8 n ALA 336 Cb 0.62 -0.99 0.03 0.00 0.00 0.00 0.00 19.45 19.11 3du8 n ALA 336 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3du8 s HIS 337 N -2.29 2.43 -0.23 0.00 2.46 -0.43 -4.92 115.29 112.31 3du8 s HIS 337 Ca 0.27 1.53 0.26 0.00 0.47 0.00 0.00 55.06 57.59 3du8 s HIS 337 Cb 0.19 -3.43 1.20 0.00 -0.13 0.00 0.00 32.58 30.42 3du8 s HIS 337 CO 0.45 -2.10 1.79 0.66 -2.47 0.00 0.00 174.74 173.07 3du8 h SER 338 N 0.80 0.00 -0.10 9.88 4.64 -1.92 -1.31 113.55 125.54 3du8 h SER 338 Ca -0.50 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 60.85 3du8 h SER 338 Cb 1.29 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3du8 h SER 338 CO 0.55 0.00 0.08 0.15 -0.87 0.00 0.00 176.83 176.74 3du8 h PHE 339 N 0.00 0.00 -0.46 4.77 3.57 -1.91 -1.37 116.94 121.53 3du8 h PHE 339 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3du8 h PHE 339 Cb 0.27 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.01 3du8 h PHE 339 CO 0.00 0.00 0.00 1.19 -2.23 0.00 0.00 178.31 177.27 3du8 n PHE 340 N -4.45 0.61 -0.32 0.41 3.72 -0.50 -4.43 117.46 112.52 3du8 n PHE 340 Ca -0.01 -0.31 0.03 0.00 -0.05 0.00 0.00 57.45 57.12 3du8 n PHE 340 Cb 0.19 0.00 0.22 0.00 -0.94 0.00 0.00 39.48 38.95 3du8 n PHE 340 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3du8 h ASP 341 N 3.03 0.95 -0.94 4.37 3.32 -1.36 -1.48 116.42 124.31 3du8 h ASP 341 Ca 0.00 0.00 0.22 0.00 0.02 0.00 0.00 57.03 57.27 3du8 h ASP 341 Cb 0.69 -0.20 -0.08 0.00 0.22 0.00 0.00 39.33 39.96 3du8 h ASP 341 CO 0.00 0.62 0.62 -0.08 -1.72 0.00 0.00 179.24 178.68 3du8 h GLU 342 N 1.09 0.43 0.00 3.56 4.81 -1.80 0.27 114.58 122.94 3du8 h GLU 342 Ca 0.39 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.57 3du8 h GLU 342 Cb 0.14 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.42 3du8 h GLU 342 CO -0.14 0.28 -0.11 -0.07 -0.73 0.00 0.00 179.01 178.25 3du8 h LEU 343 N 0.44 0.00 0.00 1.64 3.38 -1.59 -2.87 115.31 116.31 3du8 h LEU 343 Ca 0.51 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.48 3du8 h LEU 343 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 3du8 h LEU 343 CO -0.22 0.11 -0.56 0.54 0.09 0.00 0.00 178.44 178.41 3du8 n ARG 344 N -3.23 0.13 -1.82 1.13 1.74 0.94 -4.91 116.66 110.65 3du8 n ARG 344 Ca 0.01 0.03 -0.42 0.00 -0.77 0.00 0.00 57.85 56.70 3du8 n ARG 344 Cb 0.39 -1.58 -0.03 0.00 -1.02 0.00 0.00 32.46 30.22 3du8 n ARG 344 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3du8 s ASP 345 N -3.53 6.49 0.60 0.55 -1.08 -1.04 -4.85 116.67 113.80 3du8 s ASP 345 Ca 0.09 2.71 0.30 0.00 -0.52 0.00 0.00 52.55 55.12 3du8 s ASP 345 Cb 0.16 -2.58 1.72 0.00 -1.46 0.00 0.00 42.92 40.76 3du8 s ASP 345 CO 0.71 -0.92 2.13 1.55 0.52 0.00 0.00 175.17 179.15 3du8 h PRO 346 N 7.44 0.00 -0.01 4.34 0.13 -1.90 -2.75 132.00 139.25 3du8 h PRO 346 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 3du8 h PRO 346 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 3du8 h PRO 346 CO 0.94 0.00 -0.48 0.09 -0.23 0.00 0.00 178.00 178.32 3du8 n ASN 347 N -3.73 1.16 -4.55 1.44 3.02 -1.26 -4.96 115.26 106.38 3du8 n ASN 347 Ca 0.01 -0.93 -0.55 0.00 -0.03 0.00 0.00 54.58 53.07 3du8 n ASN 347 Cb 0.28 0.38 -0.07 0.00 -0.61 0.00 0.00 39.78 39.76 3du8 n ASN 347 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 3du8 n VAL 348 N -0.81 0.00 -4.18 2.41 3.14 -1.04 -5.01 118.33 112.84 3du8 n VAL 348 Ca 0.09 -0.00 -0.11 0.00 -2.96 0.00 0.00 64.34 61.36 3du8 n VAL 348 Cb 0.37 -0.45 -0.10 0.00 -1.06 0.00 0.00 33.84 32.60 3du8 n VAL 348 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 3du8 s LYS 349 N 0.29 0.88 0.58 1.45 -0.14 -1.26 -4.53 119.74 117.01 3du8 s LYS 349 Ca 0.88 -1.37 -0.18 0.00 -1.36 0.00 0.00 55.97 53.94 3du8 s LYS 349 Cb -1.10 -0.21 -0.04 0.00 -1.68 0.00 0.00 37.83 34.80 3du8 s LYS 349 CO 0.52 -0.04 1.10 -0.51 -0.76 0.00 0.00 175.35 175.66 3du8 s LEU 350 N -3.06 3.62 0.28 3.17 1.43 0.25 -4.90 118.68 119.47 3du8 s LEU 350 Ca 0.14 2.03 0.03 0.00 -1.03 0.00 0.00 54.13 55.30 3du8 s LEU 350 Cb 0.05 -4.56 0.67 0.00 0.03 0.00 0.00 46.19 42.38 3du8 s LEU 350 CO -0.03 -1.27 1.74 -0.65 0.23 0.00 0.00 176.35 176.37 3du8 h PRO 351 N 0.79 0.56 -0.28 1.29 0.11 -2.00 0.14 132.00 132.62 3du8 h PRO 351 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3du8 h PRO 351 Cb 1.24 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3du8 h PRO 351 CO 0.56 0.37 0.00 0.27 -0.21 0.00 0.00 178.00 179.00 3du8 n ASN 352 N -4.90 0.28 0.00 -2.05 0.23 -1.26 -4.86 115.26 102.69 3du8 n ASN 352 Ca 0.21 -1.08 0.00 0.00 -0.53 0.00 0.00 54.58 53.18 3du8 n ASN 352 Cb 0.56 -0.14 0.00 0.00 -2.08 0.00 0.00 39.78 38.12 3du8 n ASN 352 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3du8 n GLY 353 N 0.14 3.03 3.62 4.83 0.00 0.49 -5.03 105.19 112.27 3du8 n GLY 353 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 3du8 n GLY 353 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3du8 s ARG 354 N -0.16 0.25 0.65 1.61 0.52 -1.26 -4.69 118.95 115.87 3du8 s ARG 354 Ca 0.00 0.88 -0.16 0.00 -0.52 0.00 0.00 55.73 55.93 3du8 s ARG 354 Cb 0.00 -1.69 -0.01 0.00 0.52 0.00 0.00 34.95 33.78 3du8 s ARG 354 CO 0.00 -2.94 1.13 -0.51 0.02 0.00 0.00 175.30 172.99 3du8 s ASP 355 N -2.99 5.11 0.74 0.23 1.01 -1.26 -0.58 116.67 118.93 3du8 s ASP 355 Ca 0.66 2.08 -0.14 0.00 0.71 0.00 0.00 52.55 55.87 3du8 s ASP 355 Cb -0.21 -2.56 0.04 0.00 1.01 0.00 0.00 42.92 41.20 3du8 s ASP 355 CO 0.60 -1.63 1.15 0.42 0.21 0.00 0.00 175.17 175.91 3du8 s THR 356 N -2.18 2.74 1.22 -1.27 -4.23 -1.26 -4.59 115.64 106.07 3du8 s THR 356 Ca 0.69 0.32 -0.17 0.00 -1.18 0.00 0.00 61.69 61.35 3du8 s THR 356 Cb -0.22 -2.78 0.29 0.00 1.34 0.00 0.00 72.50 71.13 3du8 s THR 356 CO 0.39 -0.24 1.04 -2.16 -0.54 0.00 0.00 174.62 173.11 3du8 s PRO 357 N -4.23 -1.33 0.03 3.99 0.04 -1.26 -4.94 135.00 127.30 3du8 s PRO 357 Ca 0.69 0.30 -0.37 0.00 0.04 0.00 0.00 61.00 61.67 3du8 s PRO 357 Cb -0.24 -1.55 -0.16 0.00 0.04 0.00 0.00 34.50 32.60 3du8 s PRO 357 CO 0.47 -3.86 1.47 0.00 0.04 0.00 0.00 177.00 175.12 3du8 n ALA 358 N -4.93 -0.36 -0.09 8.56 0.00 -1.26 -4.89 120.51 117.53 3du8 n ALA 358 Ca 0.09 0.47 0.00 0.00 0.00 0.00 0.00 53.44 54.00 3du8 n ALA 358 Cb 0.58 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.86 3du8 n ALA 358 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3du8 n LEU 359 N 3.34 0.04 0.00 0.00 4.77 -1.26 -4.89 117.00 119.00 3du8 n LEU 359 Ca 0.20 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 3du8 n LEU 359 Cb 0.20 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 3du8 n LEU 359 CO 0.66 0.01 0.06 0.49 -1.33 0.00 0.00 177.39 177.28 3du8 n PHE 360 N -0.25 0.00 -0.68 -1.77 0.99 -1.26 -4.84 117.46 109.65 3du8 n PHE 360 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.45 57.33 3du8 n PHE 360 Cb 0.02 0.00 -0.09 0.00 -1.00 0.00 0.00 39.48 38.42 3du8 n PHE 360 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.76 177.03 3du8 n ASN 361 N -0.02 3.86 -4.77 4.37 6.94 -1.26 -4.91 115.26 119.47 3du8 n ASN 361 Ca 0.00 -2.18 -0.41 0.00 -0.02 0.00 0.00 54.58 51.97 3du8 n ASN 361 Cb 0.17 -0.97 -0.02 0.00 -2.36 0.00 0.00 39.78 36.61 3du8 n ASN 361 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 3du8 s PHE 362 N 2.07 2.98 0.26 -2.53 0.40 -1.26 -5.04 117.98 114.86 3du8 s PHE 362 Ca 0.43 1.36 0.04 0.00 -0.60 0.00 0.00 56.93 58.16 3du8 s PHE 362 Cb 0.18 -3.73 -0.03 0.00 0.51 0.00 0.00 43.02 39.95 3du8 s PHE 362 CO -0.01 -2.05 0.40 0.95 0.70 0.00 0.00 175.22 175.21 3du8 s THR 363 N -1.08 5.23 0.26 0.64 -4.23 -1.26 -5.00 115.64 110.21 3du8 s THR 363 Ca 0.50 -0.87 -0.01 0.00 -1.18 0.00 0.00 61.69 60.12 3du8 s THR 363 Cb -0.41 -3.86 0.24 0.00 1.34 0.00 0.00 72.50 69.82 3du8 s THR 363 CO 0.54 -0.37 1.75 0.74 -0.54 0.00 0.00 174.62 176.73 3du8 h THR 364 N 1.10 0.68 0.03 3.99 2.02 -1.97 -1.72 112.91 117.03 3du8 h THR 364 Ca -0.51 -0.19 0.03 0.00 0.77 0.00 0.00 66.41 66.51 3du8 h THR 364 Cb 1.23 0.08 -0.05 0.00 -1.74 0.00 0.00 68.15 67.67 3du8 h THR 364 CO 0.61 0.10 -0.29 -0.61 0.37 0.00 0.00 175.52 175.70 3du8 h GLN 365 N 0.55 -0.44 -0.72 6.66 5.75 -2.00 -0.29 115.11 124.62 3du8 h GLN 365 Ca 0.46 0.03 0.15 0.00 -0.15 0.00 0.00 58.65 59.15 3du8 h GLN 365 Cb 0.70 0.10 -0.05 0.00 1.07 0.00 0.00 27.48 29.30 3du8 h GLN 365 CO -0.39 -0.29 0.49 1.49 -2.65 0.00 0.00 178.83 177.47 3du8 h GLU 366 N -0.46 0.32 0.00 1.69 4.81 -1.80 -2.75 114.58 116.40 3du8 h GLU 366 Ca 0.05 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 3du8 h GLU 366 Cb 0.53 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.83 3du8 h GLU 366 CO -0.23 0.22 -0.60 1.28 -0.73 0.00 0.00 179.01 178.95 3du8 n LEU 367 N -4.46 0.59 0.13 1.64 4.77 -0.68 -4.57 117.00 114.43 3du8 n LEU 367 Ca 0.14 -0.09 0.18 0.00 -0.03 0.00 0.00 56.01 56.21 3du8 n LEU 367 Cb 0.56 -0.20 0.77 0.00 -2.33 0.00 0.00 43.42 42.21 3du8 n LEU 367 CO 0.34 0.14 1.16 0.77 -1.33 0.00 0.00 177.39 178.47 3du8 h SER 368 N 0.00 0.00 0.65 -1.43 4.64 -0.76 -0.95 113.55 115.70 3du8 h SER 368 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3du8 h SER 368 Cb 0.51 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.59 3du8 h SER 368 CO 0.00 0.00 -0.07 0.77 -0.87 0.00 0.00 176.83 176.66 3du8 h SER 369 N 0.00 0.00 0.00 4.97 4.64 -1.81 -3.38 113.55 117.97 3du8 h SER 369 Ca 0.15 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.33 3du8 h SER 369 Cb 0.75 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.71 3du8 h SER 369 CO -0.00 0.07 -0.20 -3.20 -0.87 0.00 0.00 176.83 172.63 3du8 n ASN 370 N -3.29 -1.86 -0.32 4.97 4.05 -0.40 -5.07 115.26 113.33 3du8 n ASN 370 Ca -0.01 -2.42 0.14 0.00 0.45 0.00 0.00 54.58 52.74 3du8 n ASN 370 Cb 0.27 1.22 0.33 0.00 1.23 0.00 0.00 39.78 42.83 3du8 n ASN 370 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 177.26 173.56 3du8 h PRO 371 N 3.26 0.51 0.00 1.20 0.11 -1.64 -1.14 132.00 134.30 3du8 h PRO 371 Ca -0.21 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.87 3du8 h PRO 371 Cb 1.15 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.14 3du8 h PRO 371 CO 0.02 0.34 0.45 -1.35 -0.21 0.00 0.00 178.00 177.24 3du8 h PRO 372 N 0.53 0.00 0.00 1.05 0.11 -1.98 -1.78 132.00 129.92 3du8 h PRO 372 Ca 0.58 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.69 3du8 h PRO 372 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3du8 h PRO 372 CO -0.48 0.00 0.00 -0.07 -0.21 0.00 0.00 178.00 177.24 3du8 h LEU 373 N 0.00 0.00 -1.66 2.35 3.38 -1.57 -2.51 115.31 115.31 3du8 h LEU 373 Ca 0.00 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.09 3du8 h LEU 373 Cb 0.89 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 3du8 h LEU 373 CO 0.00 0.00 0.62 0.00 0.09 0.00 0.00 178.44 179.15 3du8 h ALA 374 N 2.08 2.12 0.00 1.53 0.00 -1.53 0.95 119.26 124.40 3du8 h ALA 374 Ca 0.00 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 3du8 h ALA 374 Cb 0.58 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 3du8 h ALA 374 CO 0.00 -0.83 -0.53 1.79 0.00 0.00 0.00 179.25 179.68 3du8 h THR 375 N 0.00 1.25 0.13 0.00 1.35 -1.69 -2.18 112.91 111.76 3du8 h THR 375 Ca 0.20 -1.89 -0.36 0.00 -0.55 0.00 0.00 66.41 63.81 3du8 h THR 375 Cb 1.43 2.06 -0.01 0.00 -1.73 0.00 0.00 68.15 69.90 3du8 h THR 375 CO -0.00 0.52 -1.93 0.40 -0.25 0.00 0.00 175.52 174.26 3du8 h ILE 376 N 0.00 0.69 -0.14 6.82 2.04 -1.25 -3.43 117.51 122.23 3du8 h ILE 376 Ca -0.01 -2.36 -0.15 0.00 1.00 0.00 0.00 64.86 63.35 3du8 h ILE 376 Cb 1.01 2.54 -0.01 0.00 -0.74 0.00 0.00 36.82 39.62 3du8 h ILE 376 CO 0.07 0.87 -0.54 -0.07 0.00 0.00 0.00 178.15 178.48 3du8 h LEU 377 N 0.03 0.47 -8.37 1.44 3.38 -0.73 -3.37 115.31 108.16 3du8 h LEU 377 Ca -0.41 -0.25 -0.72 0.00 0.09 0.00 0.00 57.88 56.59 3du8 h LEU 377 Cb 2.01 -0.13 -0.21 0.00 0.09 0.00 0.00 40.66 42.42 3du8 h LEU 377 CO 0.09 0.92 -0.28 -0.63 0.09 0.00 0.00 178.44 178.63 3du8 s ILE 378 N -3.95 5.18 0.69 1.22 1.01 -0.84 -4.88 121.20 119.63 3du8 s ILE 378 Ca -0.06 -0.85 -0.11 0.00 0.00 0.00 0.00 60.65 59.63 3du8 s ILE 378 Cb 0.12 -4.11 0.00 0.00 0.01 0.00 0.00 42.46 38.48 3du8 s ILE 378 CO 0.82 -0.55 1.07 -2.16 0.00 0.00 0.00 174.94 174.12 3du8 s PRO 379 N 1.83 2.98 0.23 2.79 0.04 -1.26 -4.81 135.00 136.80 3du8 s PRO 379 Ca 0.06 0.70 -0.15 0.00 0.04 0.00 0.00 61.00 61.66 3du8 s PRO 379 Cb -0.22 -2.01 0.27 0.00 0.04 0.00 0.00 34.50 32.58 3du8 s PRO 379 CO 0.09 -1.00 1.58 -1.35 0.04 0.00 0.00 177.00 176.35 3du8 h PRO 380 N -0.64 -0.04 -0.07 0.56 0.11 -1.92 -0.45 132.00 129.54 3du8 h PRO 380 Ca -0.45 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.69 3du8 h PRO 380 Cb 1.23 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 3du8 h PRO 380 CO 0.61 -0.03 0.20 1.12 -0.21 0.00 0.00 178.00 179.69 3du8 h HIS 381 N -0.04 0.00 0.00 0.65 2.07 -1.93 -1.35 115.15 114.55 3du8 h HIS 381 Ca 0.35 0.00 -0.06 0.00 -2.85 0.00 0.00 60.37 57.81 3du8 h HIS 381 Cb 0.60 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.57 3du8 h HIS 381 CO -0.71 0.00 -0.68 0.00 -3.07 0.00 0.00 177.93 173.47 3du8 h ALA 382 N 1.68 0.71 -1.00 6.11 0.00 -1.43 -3.34 119.26 121.99 3du8 h ALA 382 Ca 0.04 -0.29 -0.76 0.00 0.00 0.00 0.00 54.91 53.90 3du8 h ALA 382 Cb 0.43 0.04 -0.23 0.00 0.00 0.00 0.00 17.79 18.02 3du8 h ALA 382 CO -0.00 0.35 1.27 2.89 0.00 0.00 0.00 179.25 183.75 3du8 n ARG 383 N -2.98 4.38 -4.27 0.00 1.85 -0.51 -4.96 116.66 110.17 3du8 n ARG 383 Ca -0.00 -3.93 -0.17 0.00 -1.00 0.00 0.00 57.85 52.74 3du8 n ARG 383 Cb 0.65 -2.43 -0.14 0.00 -1.05 0.00 0.00 32.46 29.49 3du8 n ARG 383 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 3du8 s ILE 384 N -3.63 0.64 0.00 8.89 1.01 -1.26 -5.03 121.20 121.83 3du8 s ILE 384 Ca 0.47 -0.47 0.00 0.00 0.00 0.00 0.00 60.65 60.65 3du8 s ILE 384 Cb 0.26 -0.56 0.00 0.00 0.01 0.00 0.00 42.46 42.17 3du8 s ILE 384 CO -0.20 0.10 0.07 0.00 0.00 0.00 0.00 174.94 174.91