#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mi6 s ILE 3 N 0.00 5.26 -0.20 -1.33 1.01 -1.26 -1.58 121.20 123.10 3mi6 s ILE 3 Ca 0.00 0.35 -0.03 0.00 0.00 0.00 0.00 60.65 60.97 3mi6 s ILE 3 Cb 0.00 -3.60 -0.01 0.00 0.01 0.00 0.00 42.46 38.86 3mi6 s ILE 3 CO 0.00 0.22 -0.07 -1.00 0.00 0.00 0.00 174.94 174.10 3mi6 s HIS 4 N 1.79 2.93 -0.09 3.97 3.76 0.12 -5.00 115.29 122.76 3mi6 s HIS 4 Ca 0.11 -0.92 0.00 0.00 -0.15 0.00 0.00 55.06 54.10 3mi6 s HIS 4 Cb -0.16 -2.05 -0.03 0.00 1.11 0.00 0.00 32.58 31.46 3mi6 s HIS 4 CO 0.10 -0.49 -0.09 0.08 -0.85 0.00 0.00 174.74 173.48 3mi6 s VAL 5 N 1.24 3.47 -0.51 -0.90 1.01 -1.26 -1.21 120.40 122.25 3mi6 s VAL 5 Ca 0.03 -0.55 -0.07 0.00 0.00 0.00 0.00 61.98 61.39 3mi6 s VAL 5 Cb -0.14 -2.43 0.13 0.00 0.00 0.00 0.00 36.38 33.94 3mi6 s VAL 5 CO -0.02 0.56 0.36 0.21 0.00 0.00 0.00 175.10 176.21 3mi6 s ASN 6 N -0.36 5.58 0.25 3.32 2.47 -0.52 -4.98 114.94 120.70 3mi6 s ASN 6 Ca 0.05 -2.17 -0.06 0.00 0.42 0.00 0.00 52.86 51.10 3mi6 s ASN 6 Cb -0.12 -1.95 0.27 0.00 -1.45 0.00 0.00 41.25 37.99 3mi6 s ASN 6 CO 0.02 -0.59 1.93 -0.33 -3.72 0.00 0.00 177.10 174.41 3mi6 h GLU 7 N 8.04 1.31 -0.34 0.43 5.08 -1.96 0.65 114.58 127.78 3mi6 h GLU 7 Ca -0.13 -0.09 0.04 0.00 -1.00 0.00 0.00 59.36 58.18 3mi6 h GLU 7 Cb 1.04 -0.29 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 3mi6 h GLU 7 CO 0.79 0.87 0.23 0.00 -1.00 0.00 0.00 179.01 179.90 3mi6 h ALA 8 N 1.37 1.93 0.00 3.43 0.00 -1.96 -3.13 119.26 120.90 3mi6 h ALA 8 Ca 0.36 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.26 3mi6 h ALA 8 Cb -0.14 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3mi6 h ALA 8 CO -0.08 0.02 -0.66 0.09 0.00 0.00 0.00 179.25 178.62 3mi6 n ASN 9 N -4.49 1.11 -3.00 0.00 3.02 -0.68 -5.00 115.26 106.23 3mi6 n ASN 9 Ca 0.03 -0.51 -0.21 0.00 -0.03 0.00 0.00 54.58 53.87 3mi6 n ASN 9 Cb 0.18 1.11 0.05 0.00 -0.61 0.00 0.00 39.78 40.51 3mi6 n ASN 9 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3mi6 n LEU 10 N -1.36 -2.90 -4.67 3.41 4.77 0.22 -4.57 117.00 111.90 3mi6 n LEU 10 Ca 0.01 -0.36 -0.40 0.00 -0.03 0.00 0.00 56.01 55.23 3mi6 n LEU 10 Cb 0.15 -2.78 -0.06 0.00 -2.33 0.00 0.00 43.42 38.41 3mi6 n LEU 10 CO 0.17 0.38 0.38 -0.89 -1.33 0.00 0.00 177.39 176.10 3mi6 s THR 11 N -3.20 5.02 -0.22 -5.08 2.01 -1.13 -2.16 115.64 110.89 3mi6 s THR 11 Ca 0.39 1.21 -0.02 0.00 0.31 0.00 0.00 61.69 63.59 3mi6 s THR 11 Cb -0.17 -3.95 0.01 0.00 0.01 0.00 0.00 72.50 68.40 3mi6 s THR 11 CO 0.48 0.13 -0.09 -0.36 -0.69 0.00 0.00 174.62 174.09 3mi6 s PHE 12 N 1.77 2.96 -0.22 4.92 0.08 0.30 -1.44 117.98 126.35 3mi6 s PHE 12 Ca 0.30 -1.38 -0.00 0.00 0.12 0.00 0.00 56.93 55.96 3mi6 s PHE 12 Cb -0.16 -2.04 0.06 0.00 -0.57 0.00 0.00 43.02 40.31 3mi6 s PHE 12 CO 0.11 -0.69 -0.02 -1.58 -0.10 0.00 0.00 175.22 172.94 3mi6 s HIS 13 N 1.36 1.97 -0.20 0.36 2.46 -0.35 -0.75 115.29 120.15 3mi6 s HIS 13 Ca 0.03 -1.49 -0.13 0.00 0.47 0.00 0.00 55.06 53.95 3mi6 s HIS 13 Cb -0.15 -1.42 -0.05 0.00 -0.13 0.00 0.00 32.58 30.84 3mi6 s HIS 13 CO -0.06 -0.73 0.26 -0.51 -2.47 0.00 0.00 174.74 171.23 3mi6 s LEU 14 N 1.54 4.17 -0.20 8.88 1.02 0.11 0.11 118.68 134.32 3mi6 s LEU 14 Ca -0.04 0.34 0.00 0.00 0.02 0.00 0.00 54.13 54.46 3mi6 s LEU 14 Cb -0.18 -2.29 0.02 0.00 0.02 0.00 0.00 46.19 43.76 3mi6 s LEU 14 CO -0.07 0.05 -0.16 -1.10 0.02 0.00 0.00 176.35 175.09 3mi6 s GLN 15 N 0.88 2.96 0.62 1.70 -0.21 -0.61 -1.28 119.66 123.72 3mi6 s GLN 15 Ca 0.13 -0.86 -0.07 0.00 0.02 0.00 0.00 55.36 54.57 3mi6 s GLN 15 Cb -0.13 -2.68 0.14 0.00 1.00 0.00 0.00 33.01 31.33 3mi6 s GLN 15 CO 0.04 -0.25 0.85 0.25 -2.12 0.00 0.00 175.29 174.06 3mi6 n THR 16 N 4.63 0.00 -0.16 -0.19 -2.24 -0.62 -1.68 114.28 114.02 3mi6 n THR 16 Ca -0.20 -0.85 0.16 0.00 -2.27 0.00 0.00 64.05 60.89 3mi6 n THR 16 Cb 0.49 -1.42 0.51 0.00 -2.10 0.00 0.00 70.33 67.81 3mi6 n THR 16 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3mi6 h ASP 17 N -0.92 0.38 0.00 3.42 3.32 -1.15 -3.29 116.42 118.17 3mi6 h ASP 17 Ca -0.28 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.79 3mi6 h ASP 17 Cb 0.85 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.34 3mi6 h ASP 17 CO 0.23 0.19 0.00 1.41 -1.72 0.00 0.00 179.24 179.35 3mi6 n HIS 18 N -4.47 0.00 -4.26 4.55 8.25 -1.26 -4.97 115.22 113.06 3mi6 n HIS 18 Ca 0.14 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.46 3mi6 n HIS 18 Cb 0.53 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.54 3mi6 n HIS 18 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3mi6 s THR 19 N -0.07 1.04 -0.04 1.59 -4.23 -1.24 -1.06 115.64 111.64 3mi6 s THR 19 Ca 0.00 -2.04 0.03 0.00 -1.18 0.00 0.00 61.69 58.51 3mi6 s THR 19 Cb 0.00 -1.98 -0.00 0.00 1.34 0.00 0.00 72.50 71.86 3mi6 s THR 19 CO 0.00 -0.63 -0.14 -0.44 -0.54 0.00 0.00 174.62 172.87 3mi6 s SER 20 N -3.19 1.74 -0.15 3.99 0.01 -0.09 -1.59 113.70 114.42 3mi6 s SER 20 Ca 0.20 -0.28 -0.00 0.00 1.31 0.00 0.00 55.95 57.18 3mi6 s SER 20 Cb 0.04 -0.47 0.03 0.00 0.21 0.00 0.00 66.02 65.83 3mi6 s SER 20 CO 0.02 0.11 -0.08 -0.47 0.41 0.00 0.00 173.24 173.24 3mi6 s TYR 21 N 0.11 1.72 -0.05 2.43 6.14 -0.40 -2.13 117.35 125.16 3mi6 s TYR 21 Ca -0.03 -1.00 0.02 0.00 0.64 0.00 0.00 57.07 56.69 3mi6 s TYR 21 Cb -0.10 -1.34 0.02 0.00 0.42 0.00 0.00 41.96 40.96 3mi6 s TYR 21 CO 0.01 -0.59 -0.08 0.42 0.64 0.00 0.00 175.55 175.95 3mi6 s ILE 22 N 1.63 0.82 0.06 3.14 1.01 -0.11 -0.71 121.20 127.03 3mi6 s ILE 22 Ca 0.03 -0.29 -0.05 0.00 0.00 0.00 0.00 60.65 60.34 3mi6 s ILE 22 Cb -0.14 -0.79 -0.02 0.00 0.01 0.00 0.00 42.46 41.53 3mi6 s ILE 22 CO -0.08 0.29 0.08 0.72 0.00 0.00 0.00 174.94 175.95 3mi6 s PHE 23 N 0.79 0.29 0.02 3.97 -0.71 0.07 -0.39 117.98 122.02 3mi6 s PHE 23 Ca -0.13 -0.71 0.01 0.00 -1.04 0.00 0.00 56.93 55.06 3mi6 s PHE 23 Cb -0.15 -0.20 -0.01 0.00 -1.21 0.00 0.00 43.02 41.45 3mi6 s PHE 23 CO 0.02 -0.43 -0.05 -1.14 -1.34 0.00 0.00 175.22 172.29 3mi6 s GLN 24 N -3.43 0.35 0.75 1.99 0.74 0.17 -0.54 119.66 119.70 3mi6 s GLN 24 Ca 0.02 -0.43 -0.09 0.00 0.05 0.00 0.00 55.36 54.90 3mi6 s GLN 24 Cb 0.04 -0.18 0.06 0.00 1.10 0.00 0.00 33.01 34.03 3mi6 s GLN 24 CO -0.08 0.03 1.09 0.42 -0.55 0.00 0.00 175.29 176.20 3mi6 s ILE 25 N -0.81 2.32 -0.05 -2.34 -1.09 -0.92 -0.09 121.20 118.22 3mi6 s ILE 25 Ca -0.06 -0.07 0.13 0.00 -2.23 0.00 0.00 60.65 58.41 3mi6 s ILE 25 Cb -0.06 -3.06 -0.13 0.00 -1.58 0.00 0.00 42.46 37.63 3mi6 s ILE 25 CO -0.00 -0.08 1.05 0.50 -1.23 0.00 0.00 174.94 175.19 3mi6 h LYS 27 N -0.79 0.00 -0.01 2.79 3.64 -2.01 -3.47 116.57 116.72 3mi6 h LYS 27 Ca -0.45 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 3mi6 h LYS 27 Cb 1.31 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.13 3mi6 h LYS 27 CO 0.63 0.57 -0.16 0.27 -2.27 0.00 0.00 179.45 178.50 3mi6 n ASN 28 N -3.13 1.08 0.00 4.20 6.94 -1.26 -4.94 115.26 118.15 3mi6 n ASN 28 Ca -0.06 -1.03 0.00 0.00 -0.02 0.00 0.00 54.58 53.47 3mi6 n ASN 28 Cb 0.89 0.07 0.00 0.00 -2.36 0.00 0.00 39.78 38.38 3mi6 n ASN 28 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3mi6 n GLY 29 N 1.28 0.70 3.93 4.83 0.00 -1.26 -4.82 105.19 109.85 3mi6 n GLY 29 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 3mi6 n GLY 29 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3mi6 s GLU 30 N -0.81 3.21 0.32 1.61 2.02 -1.26 -0.83 118.70 122.96 3mi6 s GLU 30 Ca 0.00 -0.14 -0.27 0.00 0.02 0.00 0.00 54.97 54.58 3mi6 s GLU 30 Cb 0.00 -2.44 -0.10 0.00 0.10 0.00 0.00 34.13 31.69 3mi6 s GLU 30 CO 0.00 -0.32 0.96 0.00 0.02 0.00 0.00 175.26 175.92 3mi6 s ALA 31 N -2.70 3.23 -0.06 5.21 0.00 -1.26 -4.41 121.76 121.76 3mi6 s ALA 31 Ca 0.49 0.58 -0.01 0.00 0.00 0.00 0.00 51.96 53.01 3mi6 s ALA 31 Cb -0.10 -3.20 0.03 0.00 0.00 0.00 0.00 23.12 19.84 3mi6 s ALA 31 CO 0.42 0.12 -0.00 0.20 0.00 0.00 0.00 175.76 176.50 3mi6 s GLY 32 N -1.51 0.43 0.11 0.00 0.00 0.87 -3.16 107.32 104.05 3mi6 s GLY 32 Ca 0.49 -0.06 -0.31 0.00 0.00 0.00 0.00 44.72 44.84 3mi6 s GLY 32 CO 0.26 0.98 1.33 1.62 0.00 0.00 0.00 173.10 177.29 3mi6 s GLN 33 N 1.71 4.36 -0.20 2.90 2.00 0.27 -0.65 119.66 130.04 3mi6 s GLN 33 Ca 0.01 1.99 -0.16 0.00 -2.00 0.00 0.00 55.36 55.20 3mi6 s GLN 33 Cb -0.13 -3.27 -0.08 0.00 0.80 0.00 0.00 33.01 30.33 3mi6 s GLN 33 CO -0.04 -0.37 -0.34 -0.89 -0.50 0.00 0.00 175.29 173.15 3mi6 n ILE 34 N 3.85 1.48 -3.62 -2.34 5.41 0.47 -4.61 119.36 120.00 3mi6 n ILE 34 Ca 0.10 -0.04 -0.15 0.00 1.00 0.00 0.00 62.75 63.66 3mi6 n ILE 34 Cb 0.43 -2.15 -0.07 0.00 -0.71 0.00 0.00 39.64 37.14 3mi6 n ILE 34 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 176.55 176.08 3mi6 s TYR 35 N -2.73 -0.62 -0.18 1.39 5.04 -1.06 -5.02 117.35 114.16 3mi6 s TYR 35 Ca -0.31 1.33 -0.05 0.00 -2.44 0.00 0.00 57.07 55.60 3mi6 s TYR 35 Cb 0.08 0.28 0.09 0.00 0.35 0.00 0.00 41.96 42.76 3mi6 s TYR 35 CO 0.43 -0.44 0.33 -0.47 -1.34 0.00 0.00 175.55 174.06 3mi6 s TYR 36 N -0.39 -0.60 0.00 4.97 5.04 -1.26 -0.94 117.35 124.18 3mi6 s TYR 36 Ca -0.05 1.03 0.00 0.00 -2.44 0.00 0.00 57.07 55.61 3mi6 s TYR 36 Cb -0.03 0.04 0.00 0.00 0.35 0.00 0.00 41.96 42.32 3mi6 s TYR 36 CO 0.04 -0.49 0.00 0.41 -1.34 0.00 0.00 175.55 174.17 3mi6 n GLY 37 N 5.36 0.77 3.68 8.97 0.00 -0.91 -5.02 105.19 118.05 3mi6 n GLY 37 Ca -0.06 -0.53 -0.40 0.00 0.00 0.00 0.00 46.02 45.04 3mi6 n GLY 37 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3mi6 n PRO 38 N 0.00 1.52 -1.69 1.61 -0.02 -1.26 -0.91 135.00 134.25 3mi6 n PRO 38 Ca 0.00 0.55 -0.44 0.00 -2.02 0.00 0.00 63.50 61.60 3mi6 n PRO 38 Cb 0.00 -2.33 -0.02 0.00 -0.02 0.00 0.00 33.50 31.13 3mi6 n PRO 38 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 3mi6 n ARG 39 N -0.50 2.12 -4.23 -0.52 0.63 -0.22 -4.22 116.66 109.72 3mi6 n ARG 39 Ca 0.10 0.75 -0.16 0.00 -0.92 0.00 0.00 57.85 57.62 3mi6 n ARG 39 Cb 0.43 -2.39 -0.11 0.00 0.45 0.00 0.00 32.46 30.84 3mi6 n ARG 39 CO 0.00 0.00 0.00 0.96 -2.51 0.00 0.00 177.63 176.08 3mi6 s ILE 40 N -0.45 1.18 0.24 5.15 -4.36 -1.26 -4.90 121.20 116.80 3mi6 s ILE 40 Ca 0.63 -1.84 -0.30 0.00 -0.26 0.00 0.00 60.65 58.88 3mi6 s ILE 40 Cb -0.61 -1.62 -0.14 0.00 1.25 0.00 0.00 42.46 41.34 3mi6 s ILE 40 CO 0.54 -0.58 1.14 1.41 0.24 0.00 0.00 174.94 177.68 3mi6 n HIS 41 N 0.24 1.45 -1.77 1.37 8.25 -1.26 -4.93 115.22 118.56 3mi6 n HIS 41 Ca -0.13 0.65 -0.42 0.00 -0.26 0.00 0.00 57.72 57.56 3mi6 n HIS 41 Cb 0.59 -2.30 -0.02 0.00 1.12 0.00 0.00 29.99 29.38 3mi6 n HIS 41 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3mi6 s VAL 42 N -0.58 2.08 0.15 1.59 1.01 -1.26 -5.03 120.40 118.36 3mi6 s VAL 42 Ca 0.65 0.07 0.05 0.00 0.00 0.00 0.00 61.98 62.75 3mi6 s VAL 42 Cb -0.75 -3.04 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 3mi6 s VAL 42 CO 0.55 0.01 -0.12 -1.10 0.00 0.00 0.00 175.10 174.44 3mi6 s GLN 43 N 0.30 1.09 0.59 2.72 -1.52 -1.26 -5.02 119.66 116.56 3mi6 s GLN 43 Ca 0.68 -1.40 0.35 0.00 -1.95 0.00 0.00 55.36 53.05 3mi6 s GLN 43 Cb -0.48 -0.79 1.86 0.00 -0.22 0.00 0.00 33.01 33.38 3mi6 s GLN 43 CO 0.40 0.12 2.20 -1.35 -0.25 0.00 0.00 175.29 176.41 3mi6 h PRO 44 N 2.99 0.00 -1.67 2.91 0.11 -2.01 -3.45 132.00 130.88 3mi6 h PRO 44 Ca -0.38 0.00 0.20 0.00 0.11 0.00 0.00 66.00 65.93 3mi6 h PRO 44 Cb 1.20 0.00 -0.19 0.00 0.11 0.00 0.00 31.00 32.12 3mi6 h PRO 44 CO 0.59 0.04 0.72 -0.08 -0.21 0.00 0.00 178.00 179.05 3mi6 s THR 45 N -4.15 0.00 -0.59 -1.15 -1.32 -1.26 -4.69 115.64 102.48 3mi6 s THR 45 Ca -0.03 0.00 0.06 0.00 -1.21 0.00 0.00 61.69 60.51 3mi6 s THR 45 Cb 0.13 -1.00 0.26 0.00 -1.51 0.00 0.00 72.50 70.38 3mi6 s THR 45 CO 0.51 0.00 0.73 -1.22 -2.21 0.00 0.00 174.62 172.43 3mi6 n TYR 46 N -0.04 3.02 -0.13 9.09 4.02 -1.26 -4.97 117.16 126.90 3mi6 n TYR 46 Ca -0.03 -4.05 -0.04 0.00 -0.01 0.00 0.00 57.90 53.77 3mi6 n TYR 46 Cb 0.59 -0.52 0.04 0.00 -0.02 0.00 0.00 39.34 39.43 3mi6 n TYR 46 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 3mi6 h GLN 47 N 4.01 0.21 -0.89 -0.72 4.20 -2.02 -2.54 115.11 117.36 3mi6 h GLN 47 Ca 0.17 -0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.91 3mi6 h GLN 47 Cb 0.68 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 28.36 3mi6 h GLN 47 CO 0.77 0.14 0.57 -0.97 -0.67 0.00 0.00 178.83 178.68 3mi6 h ASN 48 N 0.22 0.95 0.00 1.46 -1.24 -2.06 -2.55 115.58 112.36 3mi6 h ASN 48 Ca 0.20 -0.00 -0.03 0.00 0.71 0.00 0.00 56.30 57.18 3mi6 h ASN 48 Cb 0.24 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.07 3mi6 h ASN 48 CO -0.26 0.64 -0.05 0.18 -1.29 0.00 0.00 177.43 176.65 3mi6 n LEU 49 N -4.53 5.04 0.00 0.34 4.77 -0.96 -4.95 117.00 116.71 3mi6 n LEU 49 Ca 0.12 -2.40 0.00 0.00 -0.03 0.00 0.00 56.01 53.70 3mi6 n LEU 49 Cb 0.10 -1.11 0.00 0.00 -2.33 0.00 0.00 43.42 40.08 3mi6 n LEU 49 CO 0.34 1.06 0.00 -1.20 -1.33 0.00 0.00 177.39 176.25 3mi6 n SER 51 N 1.69 -0.47 -4.24 -1.43 7.64 -0.96 -5.03 113.62 110.81 3mi6 n SER 51 Ca 0.06 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.64 3mi6 n SER 51 Cb 0.54 0.37 -0.16 0.00 -1.01 0.00 0.00 64.21 63.94 3mi6 n SER 51 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 3mi6 s GLN 52 N -5.15 2.36 0.14 1.43 -0.21 -1.26 -5.14 119.66 111.83 3mi6 s GLN 52 Ca 0.00 -0.85 0.07 0.00 0.02 0.00 0.00 55.36 54.61 3mi6 s GLN 52 Cb 0.00 -2.03 -0.04 0.00 1.00 0.00 0.00 33.01 31.95 3mi6 s GLN 52 CO 0.00 0.36 -0.17 -1.21 -2.12 0.00 0.00 175.29 172.16 3mi6 s GLU 53 N -0.15 1.13 0.31 2.91 2.02 -1.26 -5.02 118.70 118.64 3mi6 s GLU 53 Ca -0.03 -1.29 -0.29 0.00 0.02 0.00 0.00 54.97 53.38 3mi6 s GLU 53 Cb -0.13 -1.15 -0.10 0.00 0.10 0.00 0.00 34.13 32.85 3mi6 s GLU 53 CO 0.03 0.23 1.24 -0.46 0.02 0.00 0.00 175.26 176.33 3mi6 s TRP 54 N -1.93 3.22 -0.02 1.61 -0.11 -1.26 -4.96 118.94 115.49 3mi6 s TRP 54 Ca 0.11 1.49 0.03 0.00 1.22 0.00 0.00 56.10 58.95 3mi6 s TRP 54 Cb -0.06 -3.56 -0.00 0.00 -1.50 0.00 0.00 33.47 28.35 3mi6 s TRP 54 CO 0.05 -1.46 -0.10 1.03 -4.62 0.00 0.00 176.95 171.84 3mi6 s ARG 55 N -1.60 0.92 0.65 5.86 1.81 -1.26 -5.15 118.95 120.19 3mi6 s ARG 55 Ca 0.48 -0.34 -0.13 0.00 -1.72 0.00 0.00 55.73 54.02 3mi6 s ARG 55 Cb -0.37 -0.87 -0.01 0.00 -0.45 0.00 0.00 34.95 33.24 3mi6 s ARG 55 CO 0.49 0.16 1.06 -0.51 -0.68 0.00 0.00 175.30 175.82 3mi6 s ASP 56 N 0.01 5.55 -1.49 0.23 1.01 -1.26 -4.24 116.67 116.48 3mi6 s ASP 56 Ca -0.00 1.71 -0.07 0.00 0.71 0.00 0.00 52.55 54.91 3mi6 s ASP 56 Cb -0.07 -2.51 0.02 0.00 1.01 0.00 0.00 42.92 41.37 3mi6 s ASP 56 CO 0.00 -1.32 0.76 0.00 0.21 0.00 0.00 175.17 174.82 3mi6 n ALA 57 N -2.62 -1.08 -3.08 5.23 0.00 -1.26 -5.00 120.51 112.71 3mi6 n ALA 57 Ca 0.08 0.30 -0.12 0.00 0.00 0.00 0.00 53.44 53.70 3mi6 n ALA 57 Cb 0.53 -4.25 -0.11 0.00 0.00 0.00 0.00 19.45 15.62 3mi6 n ALA 57 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3mi6 s THR 58 N -3.20 0.05 0.75 0.00 -1.32 -1.26 -5.16 115.64 105.50 3mi6 s THR 58 Ca 0.40 -0.41 -0.13 0.00 -1.21 0.00 0.00 61.69 60.34 3mi6 s THR 58 Cb -0.18 -0.34 0.05 0.00 -1.51 0.00 0.00 72.50 70.51 3mi6 s THR 58 CO 0.50 -0.23 1.13 -2.84 -2.21 0.00 0.00 174.62 170.97 3mi6 s PRO 59 N -0.78 2.21 0.31 7.08 0.02 -1.26 -5.02 135.00 137.56 3mi6 s PRO 59 Ca -0.09 1.44 0.10 0.00 0.02 0.00 0.00 61.00 62.47 3mi6 s PRO 59 Cb -0.05 -1.87 -0.05 0.00 0.02 0.00 0.00 34.50 32.54 3mi6 s PRO 59 CO 0.01 -1.71 -0.11 -1.12 -0.33 0.00 0.00 177.00 173.74 3mi6 s SER 60 N -2.70 3.83 0.13 2.53 0.01 -1.26 -4.34 113.70 111.90 3mi6 s SER 60 Ca 0.67 -1.04 -0.20 0.00 1.31 0.00 0.00 55.95 56.69 3mi6 s SER 60 Cb -0.22 -0.41 -0.03 0.00 0.21 0.00 0.00 66.02 65.57 3mi6 s SER 60 CO 0.49 -0.09 1.70 0.25 0.41 0.00 0.00 173.24 176.00 3mi6 h LEU 61 N 2.07 -0.21 0.00 2.44 6.46 -1.37 -3.48 115.31 121.23 3mi6 h LEU 61 Ca -0.42 0.06 0.27 0.00 -0.12 0.00 0.00 57.88 57.67 3mi6 h LEU 61 Cb 1.25 0.13 -0.05 0.00 -0.73 0.00 0.00 40.66 41.26 3mi6 h LEU 61 CO 0.65 -0.08 0.68 -0.46 -0.62 0.00 0.00 178.44 178.61 3mi6 n ASN 62 N -5.21 -0.83 0.25 1.25 0.23 -1.26 -5.02 115.26 104.67 3mi6 n ASN 62 Ca -0.03 -1.13 0.16 0.00 -0.53 0.00 0.00 54.58 53.05 3mi6 n ASN 62 Cb 0.13 1.27 0.54 0.00 -2.08 0.00 0.00 39.78 39.65 3mi6 n ASN 62 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3mi6 h GLU 63 N 0.00 0.00 0.00 -3.83 4.39 -1.99 -1.87 114.58 111.28 3mi6 h GLU 63 Ca -0.15 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.55 3mi6 h GLU 63 Cb 0.85 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.50 3mi6 h GLU 63 CO 0.22 0.00 -0.36 0.39 -1.16 0.00 0.00 179.01 178.10 3mi6 n GLU 64 N -2.99 0.23 -2.82 2.33 4.71 -1.26 -4.37 120.64 116.47 3mi6 n GLU 64 Ca 0.02 0.11 -0.17 0.00 -0.01 0.00 0.00 57.16 57.11 3mi6 n GLU 64 Cb 0.35 -1.69 -0.00 0.00 -1.01 0.00 0.00 31.44 29.09 3mi6 n GLU 64 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3mi6 n ASN 65 N -2.06 2.11 -0.33 1.62 3.02 -0.71 -4.93 115.26 113.98 3mi6 n ASN 65 Ca 0.04 -3.07 0.23 0.00 -0.03 0.00 0.00 54.58 51.76 3mi6 n ASN 65 Cb 0.42 -0.55 0.51 0.00 -0.61 0.00 0.00 39.78 39.55 3mi6 n ASN 65 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3mi6 h PRO 66 N 2.93 0.37 -0.00 3.52 0.13 -1.74 -0.34 132.00 136.87 3mi6 h PRO 66 Ca 0.05 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 3mi6 h PRO 66 Cb 1.00 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.05 3mi6 h PRO 66 CO 0.59 0.25 -0.06 0.09 -0.23 0.00 0.00 178.00 178.63 3mi6 n ASN 67 N -4.66 0.46 -4.46 1.44 5.03 -1.26 -4.45 115.26 107.36 3mi6 n ASN 67 Ca 0.27 -0.75 -0.43 0.00 0.87 0.00 0.00 54.58 54.53 3mi6 n ASN 67 Cb 0.91 -0.07 -0.03 0.00 -1.02 0.00 0.00 39.78 39.58 3mi6 n ASN 67 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 3mi6 s PHE 68 N -2.32 2.86 -0.23 3.10 2.19 -0.14 -4.47 117.98 118.99 3mi6 s PHE 68 Ca 0.34 -0.94 0.02 0.00 0.33 0.00 0.00 56.93 56.68 3mi6 s PHE 68 Cb 0.21 -4.30 0.05 0.00 -1.31 0.00 0.00 43.02 37.66 3mi6 s PHE 68 CO 0.43 -1.59 -0.10 -0.65 1.83 0.00 0.00 175.22 175.14 3mi6 s GLN 69 N 3.49 2.11 0.60 10.12 -0.21 -1.26 -1.37 119.66 133.14 3mi6 s GLN 69 Ca 0.28 -1.05 0.29 0.00 0.02 0.00 0.00 55.36 54.90 3mi6 s GLN 69 Cb -0.11 -2.63 1.61 0.00 1.00 0.00 0.00 33.01 32.88 3mi6 s GLN 69 CO 0.01 -0.49 2.00 -1.35 -2.12 0.00 0.00 175.29 173.34 3mi6 h PRO 70 N 7.90 0.00 0.00 2.91 0.11 -1.84 -0.22 132.00 140.86 3mi6 h PRO 70 Ca -0.24 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.85 3mi6 h PRO 70 Cb 1.08 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 3mi6 h PRO 70 CO 0.47 0.00 -0.06 0.00 -0.21 0.00 0.00 178.00 178.20 3mi6 h ALA 71 N 1.59 1.15 -0.13 -0.75 0.00 -1.86 -2.93 119.26 116.32 3mi6 h ALA 71 Ca 0.12 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 3mi6 h ALA 71 Cb 0.76 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.46 3mi6 h ALA 71 CO -0.00 0.07 -0.57 0.25 0.00 0.00 0.00 179.25 179.00 3mi6 n THR 72 N -3.37 2.21 -4.00 0.00 -2.24 -0.10 -4.97 114.28 101.82 3mi6 n THR 72 Ca -0.02 -3.37 -0.30 0.00 -2.27 0.00 0.00 64.05 58.10 3mi6 n THR 72 Cb 0.21 -0.36 -0.16 0.00 -2.10 0.00 0.00 70.33 67.91 3mi6 n THR 72 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3mi6 s ILE 73 N -3.41 1.53 -0.03 2.28 1.01 -1.11 -4.96 121.20 116.51 3mi6 s ILE 73 Ca 0.40 -0.68 -0.30 0.00 0.00 0.00 0.00 60.65 60.07 3mi6 s ILE 73 Cb 0.38 -1.48 -0.07 0.00 0.01 0.00 0.00 42.46 41.29 3mi6 s ILE 73 CO -0.05 0.38 1.92 -0.54 0.00 0.00 0.00 174.94 176.65 3mi6 s LYS 74 N 1.49 4.00 0.33 2.79 1.02 -1.26 -4.96 119.74 123.15 3mi6 s LYS 74 Ca 0.04 2.40 0.07 0.00 0.02 0.00 0.00 55.97 58.50 3mi6 s LYS 74 Cb -0.14 -4.15 -0.02 0.00 -0.52 0.00 0.00 37.83 33.01 3mi6 s LYS 74 CO -0.10 -1.10 0.37 0.00 -0.92 0.00 0.00 175.35 173.60 3mi6 s ALA 75 N 4.90 4.01 -0.03 5.17 0.00 -1.26 -0.56 121.76 133.99 3mi6 s ALA 75 Ca 0.86 -1.54 0.14 0.00 0.00 0.00 0.00 51.96 51.42 3mi6 s ALA 75 Cb -0.39 -1.42 -0.21 0.00 0.00 0.00 0.00 23.12 21.10 3mi6 s ALA 75 CO 0.38 0.01 0.29 -1.91 0.00 0.00 0.00 175.76 174.53 3mi6 n GLU 76 N -1.48 0.51 -2.68 0.00 4.07 -1.19 -4.14 120.64 115.73 3mi6 n GLU 76 Ca -0.02 -0.12 -0.04 0.00 -0.06 0.00 0.00 57.16 56.92 3mi6 n GLU 76 Cb 0.59 -1.33 0.06 0.00 -0.06 0.00 0.00 31.44 30.70 3mi6 n GLU 76 CO 0.00 0.00 0.00 0.98 -0.06 0.00 0.00 177.13 178.05 3mi6 n TYR 77 N -2.01 -0.90 -3.03 4.31 9.36 -1.26 -4.36 117.16 119.27 3mi6 n TYR 77 Ca -0.04 -0.78 -0.36 0.00 3.32 0.00 0.00 57.90 60.04 3mi6 n TYR 77 Cb 0.39 1.14 -0.06 0.00 -0.63 0.00 0.00 39.34 40.18 3mi6 n TYR 77 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3mi6 s ALA 78 N 0.45 3.34 0.62 2.98 0.00 -1.26 -4.83 121.76 123.05 3mi6 s ALA 78 Ca 0.26 0.23 -0.05 0.00 0.00 0.00 0.00 51.96 52.41 3mi6 s ALA 78 Cb 0.18 -2.90 0.03 0.00 0.00 0.00 0.00 23.12 20.42 3mi6 s ALA 78 CO -0.10 0.29 0.91 -1.54 0.00 0.00 0.00 175.76 175.31 3mi6 s SER 79 N -1.75 5.28 -0.14 0.00 1.04 -1.26 -0.84 113.70 116.03 3mi6 s SER 79 Ca 0.47 0.48 -0.04 0.00 0.48 0.00 0.00 55.95 57.35 3mi6 s SER 79 Cb -0.16 -1.35 -0.03 0.00 0.10 0.00 0.00 66.02 64.58 3mi6 s SER 79 CO 0.21 -1.24 -0.02 -0.22 0.98 0.00 0.00 173.24 172.94 3mi6 s LEU 80 N -5.02 3.37 0.00 2.42 2.96 -1.26 -4.61 118.68 116.54 3mi6 s LEU 80 Ca 0.56 -0.06 0.00 0.00 -0.22 0.00 0.00 54.13 54.42 3mi6 s LEU 80 Cb -0.11 -1.81 0.00 0.00 0.50 0.00 0.00 46.19 44.78 3mi6 s LEU 80 CO 0.43 0.21 0.00 0.61 -1.32 0.00 0.00 176.35 176.29 3mi6 n GLY 81 N 3.26 1.33 1.35 7.98 0.00 -1.26 -4.74 105.19 113.11 3mi6 n GLY 81 Ca -0.17 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.92 3mi6 n GLY 81 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3mi6 n LYS 82 N -0.06 3.80 0.00 1.61 4.76 -1.26 -4.91 118.16 122.10 3mi6 n LYS 82 Ca 0.00 -2.94 0.00 0.00 -2.87 0.00 0.00 58.31 52.50 3mi6 n LYS 82 Cb 0.00 -1.99 0.00 0.00 -1.84 0.00 0.00 35.03 31.20 3mi6 n LYS 82 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3mi6 n GLY 83 N 0.16 1.76 3.72 0.72 0.00 -1.26 -4.82 105.19 105.46 3mi6 n GLY 83 Ca 0.24 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.89 3mi6 n GLY 83 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3mi6 s ASP 84 N -1.97 6.42 -0.06 1.61 -1.08 -1.26 -3.92 116.67 116.41 3mi6 s ASP 84 Ca 0.00 0.49 0.12 0.00 -0.52 0.00 0.00 52.55 52.64 3mi6 s ASP 84 Cb 0.00 -2.18 0.38 0.00 -1.46 0.00 0.00 42.92 39.65 3mi6 s ASP 84 CO 0.00 0.08 1.31 0.49 0.52 0.00 0.00 175.17 177.56 3mi6 n PHE 85 N 3.72 0.62 -1.66 -5.34 3.72 -1.26 -4.00 117.46 113.25 3mi6 n PHE 85 Ca -0.12 -0.62 -0.29 0.00 -0.05 0.00 0.00 57.45 56.37 3mi6 n PHE 85 Cb 0.52 -0.12 0.16 0.00 -0.94 0.00 0.00 39.48 39.10 3mi6 n PHE 85 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 3mi6 s ARG 86 N -1.57 0.81 0.13 -1.08 0.52 -1.26 -4.98 118.95 111.51 3mi6 s ARG 86 Ca 0.29 -0.00 -0.31 0.00 -0.52 0.00 0.00 55.73 55.19 3mi6 s ARG 86 Cb 0.19 -1.83 -0.08 0.00 0.52 0.00 0.00 34.95 33.76 3mi6 s ARG 86 CO 0.13 -2.36 1.32 -0.65 0.02 0.00 0.00 175.30 173.76 3mi6 s GLN 87 N -5.54 4.37 0.60 3.54 -1.52 -1.26 -4.89 119.66 114.96 3mi6 s GLN 87 Ca 0.67 1.99 -0.11 0.00 -1.95 0.00 0.00 55.36 55.96 3mi6 s GLN 87 Cb -0.10 -3.26 -0.04 0.00 -0.22 0.00 0.00 33.01 29.39 3mi6 s GLN 87 CO 0.53 -0.33 1.01 -1.25 -0.25 0.00 0.00 175.29 174.99 3mi6 s PRO 88 N 0.74 3.64 0.27 2.91 0.05 -1.26 -4.95 135.00 136.40 3mi6 s PRO 88 Ca 0.61 0.74 0.17 0.00 0.05 0.00 0.00 61.00 62.57 3mi6 s PRO 88 Cb -0.35 -2.11 0.08 0.00 0.05 0.00 0.00 34.50 32.17 3mi6 s PRO 88 CO 0.32 -0.51 1.34 0.00 0.05 0.00 0.00 177.00 178.20 3mi6 h ALA 89 N -0.13 0.72 -2.85 8.56 0.00 -1.31 -3.48 119.26 120.76 3mi6 h ALA 89 Ca -0.45 -0.40 -0.08 0.00 0.00 0.00 0.00 54.91 53.99 3mi6 h ALA 89 Cb 1.19 -0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.90 3mi6 h ALA 89 CO 0.62 0.51 -0.10 -0.59 0.00 0.00 0.00 179.25 179.69 3mi6 s PHE 90 N -3.03 0.42 -0.25 0.00 -0.71 -1.24 -0.97 117.98 112.20 3mi6 s PHE 90 Ca 0.03 -0.79 -0.20 0.00 -1.04 0.00 0.00 56.93 54.94 3mi6 s PHE 90 Cb 0.07 0.20 0.07 0.00 -1.21 0.00 0.00 43.02 42.15 3mi6 s PHE 90 CO 0.75 -1.05 0.65 -1.14 -1.34 0.00 0.00 175.22 173.09 3mi6 s GLN 91 N -3.82 0.72 -0.07 1.99 0.74 0.16 -4.51 119.66 114.88 3mi6 s GLN 91 Ca 0.23 0.98 0.03 0.00 0.05 0.00 0.00 55.36 56.66 3mi6 s GLN 91 Cb -0.01 0.28 0.00 0.00 1.10 0.00 0.00 33.01 34.39 3mi6 s GLN 91 CO 0.10 -0.11 -0.18 0.08 -0.55 0.00 0.00 175.29 174.63 3mi6 s VAL 92 N 0.76 1.56 -0.16 1.34 1.01 -1.26 -0.89 120.40 122.75 3mi6 s VAL 92 Ca -0.03 -0.74 -0.07 0.00 0.00 0.00 0.00 61.98 61.13 3mi6 s VAL 92 Cb -0.05 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.92 3mi6 s VAL 92 CO -0.06 0.45 0.09 -0.89 0.00 0.00 0.00 175.10 174.69 3mi6 s THR 93 N 0.37 5.07 0.74 3.92 2.01 0.14 -4.10 115.64 123.80 3mi6 s THR 93 Ca -0.13 0.06 -0.04 0.00 0.31 0.00 0.00 61.69 61.89 3mi6 s THR 93 Cb -0.15 -3.26 0.12 0.00 0.01 0.00 0.00 72.50 69.21 3mi6 s THR 93 CO 0.05 0.51 1.03 -1.10 -0.69 0.00 0.00 174.62 174.42 3mi6 s GLN 94 N -0.08 1.68 0.31 4.92 -0.21 0.27 -1.74 119.66 124.80 3mi6 s GLN 94 Ca 0.08 -0.79 0.01 0.00 0.02 0.00 0.00 55.36 54.67 3mi6 s GLN 94 Cb -0.12 -2.23 0.53 0.00 1.00 0.00 0.00 33.01 32.19 3mi6 s GLN 94 CO 0.01 -1.51 1.93 0.00 -2.12 0.00 0.00 175.29 173.60 3mi6 h ALA 95 N -0.68 1.51 0.00 6.09 0.00 -1.89 -2.97 119.26 121.32 3mi6 h ALA 95 Ca -0.40 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.48 3mi6 h ALA 95 Cb 1.27 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3mi6 h ALA 95 CO 0.45 0.38 0.00 0.27 0.00 0.00 0.00 179.25 180.35 3mi6 n ASN 96 N -4.47 0.00 0.00 0.00 0.23 -1.26 -4.88 115.26 104.88 3mi6 n ASN 96 Ca 0.12 -0.30 0.00 0.00 -0.53 0.00 0.00 54.58 53.87 3mi6 n ASN 96 Cb 0.16 -0.23 0.00 0.00 -2.08 0.00 0.00 39.78 37.63 3mi6 n ASN 96 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3mi6 n GLY 97 N 1.14 2.61 3.79 4.83 0.00 -1.12 -5.08 105.19 111.35 3mi6 n GLY 97 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 3mi6 n GLY 97 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3mi6 s SER 98 N -1.55 6.94 -0.08 1.61 0.15 -1.26 -4.70 113.70 114.81 3mi6 s SER 98 Ca 0.00 1.91 0.11 0.00 0.70 0.00 0.00 55.95 58.67 3mi6 s SER 98 Cb 0.00 -2.57 0.17 0.00 -1.71 0.00 0.00 66.02 61.90 3mi6 s SER 98 CO 0.00 -0.36 1.06 0.54 1.20 0.00 0.00 173.24 175.68 3mi6 n ARG 99 N -0.04 1.49 -2.96 5.44 1.74 -1.26 -0.56 116.66 120.50 3mi6 n ARG 99 Ca 0.05 -2.02 -0.40 0.00 -0.77 0.00 0.00 57.85 54.71 3mi6 n ARG 99 Cb 0.51 -1.20 -0.06 0.00 -1.02 0.00 0.00 32.46 30.69 3mi6 n ARG 99 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3mi6 s ILE 100 N -1.92 4.46 -0.03 0.55 -1.09 -1.26 -4.41 121.20 117.50 3mi6 s ILE 100 Ca 0.19 1.72 0.02 0.00 -2.23 0.00 0.00 60.65 60.34 3mi6 s ILE 100 Cb 0.16 -4.15 0.01 0.00 -1.58 0.00 0.00 42.46 36.90 3mi6 s ILE 100 CO 0.02 0.47 -0.08 -0.89 -1.23 0.00 0.00 174.94 173.23 3mi6 s THR 101 N -0.80 0.72 -0.67 2.92 2.01 -1.26 -4.91 115.64 113.64 3mi6 s THR 101 Ca 0.37 -0.30 0.05 0.00 0.31 0.00 0.00 61.69 62.12 3mi6 s THR 101 Cb -0.23 -0.66 0.19 0.00 0.01 0.00 0.00 72.50 71.82 3mi6 s THR 101 CO 0.26 0.24 0.57 -0.62 -0.69 0.00 0.00 174.62 174.37 3mi6 n GLU 102 N 3.45 1.97 -1.75 4.92 1.02 -1.26 -4.90 120.64 124.09 3mi6 n GLU 102 Ca -0.20 -4.48 -0.41 0.00 -0.02 0.00 0.00 57.16 52.05 3mi6 n GLU 102 Cb 0.54 -2.24 -0.00 0.00 -0.02 0.00 0.00 31.44 29.71 3mi6 n GLU 102 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3mi6 n LEU 103 N 1.64 4.48 -3.86 -4.62 4.77 -1.26 -1.54 117.00 116.62 3mi6 n LEU 103 Ca 0.23 1.22 -0.15 0.00 -0.03 0.00 0.00 56.01 57.28 3mi6 n LEU 103 Cb 0.38 -1.59 -0.15 0.00 -2.33 0.00 0.00 43.42 39.73 3mi6 n LEU 103 CO 0.30 -0.02 -0.37 -0.89 -1.33 0.00 0.00 177.39 175.08 3mi6 s THR 104 N -1.12 0.13 0.37 -5.08 2.01 0.23 -4.15 115.64 108.02 3mi6 s THR 104 Ca 0.54 0.02 -0.27 0.00 0.31 0.00 0.00 61.69 62.29 3mi6 s THR 104 Cb -0.50 -0.17 -0.09 0.00 0.01 0.00 0.00 72.50 71.75 3mi6 s THR 104 CO 0.63 0.08 1.27 -0.47 -0.69 0.00 0.00 174.62 175.45 3mi6 s TYR 105 N 0.46 2.99 0.13 4.92 5.04 -0.01 -0.97 117.35 129.92 3mi6 s TYR 105 Ca -0.04 1.45 0.00 0.00 -2.44 0.00 0.00 57.07 56.04 3mi6 s TYR 105 Cb -0.07 -3.61 0.00 0.00 0.35 0.00 0.00 41.96 38.64 3mi6 s TYR 105 CO -0.01 -1.79 0.00 -3.47 -1.34 0.00 0.00 175.55 168.94 3mi6 n ASP 106 N 0.43 0.73 -3.81 4.32 2.03 -1.05 -4.85 116.55 114.35 3mi6 n ASP 106 Ca 0.02 0.20 -0.10 0.00 0.52 0.00 0.00 54.79 55.44 3mi6 n ASP 106 Cb 0.43 -0.15 -0.05 0.00 -0.72 0.00 0.00 41.12 40.64 3mi6 n ASP 106 CO 0.00 0.00 0.00 -1.38 -1.92 0.00 0.00 177.20 173.90 3mi6 s HIS 107 N -2.00 0.03 0.46 -0.67 -3.43 -1.25 -5.04 115.29 103.39 3mi6 s HIS 107 Ca 0.00 -0.39 0.03 0.00 -0.80 0.00 0.00 55.06 53.90 3mi6 s HIS 107 Cb 0.00 0.27 -0.03 0.00 -1.43 0.00 0.00 32.58 31.39 3mi6 s HIS 107 CO 0.00 -0.87 0.04 1.52 -2.00 0.00 0.00 174.74 173.43 3mi6 s TYR 108 N -3.90 1.97 -0.18 0.38 1.13 -1.26 -0.83 117.35 114.66 3mi6 s TYR 108 Ca 0.12 -0.98 -0.13 0.00 -1.41 0.00 0.00 57.07 54.67 3mi6 s TYR 108 Cb 0.00 -1.52 0.05 0.00 -1.10 0.00 0.00 41.96 39.40 3mi6 s TYR 108 CO -0.02 0.14 0.45 -1.14 -2.51 0.00 0.00 175.55 172.47 3mi6 s GLN 109 N -3.81 0.47 -0.29 -3.49 0.74 0.26 -4.98 119.66 108.55 3mi6 s GLN 109 Ca 0.17 0.74 0.03 0.00 0.05 0.00 0.00 55.36 56.35 3mi6 s GLN 109 Cb 0.04 0.12 0.08 0.00 1.10 0.00 0.00 33.01 34.34 3mi6 s GLN 109 CO 0.09 -0.11 -0.03 -1.17 -0.55 0.00 0.00 175.29 173.51 3mi6 s LEU 110 N 0.88 3.89 0.06 3.68 0.20 -1.26 -1.27 118.68 124.85 3mi6 s LEU 110 Ca -0.05 -1.70 0.01 0.00 0.69 0.00 0.00 54.13 53.07 3mi6 s LEU 110 Cb -0.06 -1.53 -0.04 0.00 -0.43 0.00 0.00 46.19 44.13 3mi6 s LEU 110 CO -0.07 -0.28 0.16 -0.76 -0.29 0.00 0.00 176.35 175.11 3mi6 s LEU 111 N 1.06 4.15 0.15 -0.68 1.43 0.09 -4.97 118.68 119.90 3mi6 s LEU 111 Ca 0.00 0.17 -0.27 0.00 -1.03 0.00 0.00 54.13 53.00 3mi6 s LEU 111 Cb -0.19 -2.74 -0.07 0.00 0.03 0.00 0.00 46.19 43.21 3mi6 s LEU 111 CO -0.07 0.18 0.84 -0.89 0.23 0.00 0.00 176.35 176.64 3mi6 s THR 112 N -1.44 4.41 0.00 5.49 2.01 -1.26 -0.95 115.64 123.90 3mi6 s THR 112 Ca 0.32 1.83 0.00 0.00 0.31 0.00 0.00 61.69 64.15 3mi6 s THR 112 Cb -0.13 -4.20 0.00 0.00 0.01 0.00 0.00 72.50 68.18 3mi6 s THR 112 CO 0.25 0.45 0.00 0.61 -0.69 0.00 0.00 174.62 175.24 3mi6 n GLY 113 N 1.85 -1.43 3.52 4.40 0.00 0.10 -4.78 105.19 108.85 3mi6 n GLY 113 Ca -0.03 -1.39 -0.00 0.00 0.00 0.00 0.00 46.02 44.60 3mi6 n GLY 113 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3mi6 s LYS 114 N 0.00 0.57 0.28 1.61 2.47 -1.26 -2.82 119.74 120.58 3mi6 s LYS 114 Ca 0.00 1.34 -0.08 0.00 -1.56 0.00 0.00 55.97 55.67 3mi6 s LYS 114 Cb 0.00 0.78 -0.06 0.00 -1.46 0.00 0.00 37.83 37.09 3mi6 s LYS 114 CO 0.00 -0.30 0.58 -0.65 0.16 0.00 0.00 175.35 175.15 3mi6 s GLN 115 N 2.88 3.72 0.67 4.03 -1.52 -1.26 -1.31 119.66 126.87 3mi6 s GLN 115 Ca 0.00 0.18 -0.17 0.00 -1.95 0.00 0.00 55.36 53.41 3mi6 s GLN 115 Cb -0.13 -2.61 -0.00 0.00 -0.22 0.00 0.00 33.01 30.05 3mi6 s GLN 115 CO -0.19 0.22 1.21 0.54 -0.25 0.00 0.00 175.29 176.82 3mi6 n ARG 116 N -0.67 0.91 -1.59 2.91 1.74 -1.26 -4.79 116.66 113.92 3mi6 n ARG 116 Ca -0.00 0.37 -0.32 0.00 -0.77 0.00 0.00 57.85 57.13 3mi6 n ARG 116 Cb 0.53 -2.44 0.06 0.00 -1.02 0.00 0.00 32.46 29.59 3mi6 n ARG 116 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3mi6 s LEU 117 N -4.08 3.23 0.16 0.55 1.43 -1.26 -4.98 118.68 113.72 3mi6 s LEU 117 Ca 0.80 1.84 -0.06 0.00 -1.03 0.00 0.00 54.13 55.68 3mi6 s LEU 117 Cb -0.37 -4.53 0.00 0.00 0.03 0.00 0.00 46.19 41.32 3mi6 s LEU 117 CO 0.43 -1.68 1.42 0.00 0.23 0.00 0.00 176.35 176.76 3mi6 h ALA 118 N -0.46 0.54 0.00 4.21 0.00 -1.99 -3.38 119.26 118.19 3mi6 h ALA 118 Ca -0.45 -0.56 -0.01 0.00 0.00 0.00 0.00 54.91 53.90 3mi6 h ALA 118 Cb 1.23 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 3mi6 h ALA 118 CO 0.54 0.70 -0.36 0.09 0.00 0.00 0.00 179.25 180.23 3mi6 n ASN 119 N -3.93 0.79 -4.15 0.00 4.13 -1.26 -5.05 115.26 105.79 3mi6 n ASN 119 Ca -0.05 -2.37 -0.22 0.00 1.68 0.00 0.00 54.58 53.63 3mi6 n ASN 119 Cb 0.67 -0.28 -0.14 0.00 -1.54 0.00 0.00 39.78 38.49 3mi6 n ASN 119 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3mi6 s LEU 120 N -0.95 2.11 0.43 3.41 1.43 -1.26 -4.84 118.68 119.00 3mi6 s LEU 120 Ca 0.12 -0.38 -0.23 0.00 -1.03 0.00 0.00 54.13 52.61 3mi6 s LEU 120 Cb 0.10 -0.72 -0.12 0.00 0.03 0.00 0.00 46.19 45.49 3mi6 s LEU 120 CO 0.00 0.11 0.67 -2.65 0.23 0.00 0.00 176.35 174.72 3mi6 n PRO 121 N 2.25 0.75 -3.77 1.29 -0.01 -1.26 -4.41 135.00 129.84 3mi6 n PRO 121 Ca -0.16 0.27 -0.02 0.00 -0.01 0.00 0.00 63.50 63.58 3mi6 n PRO 121 Cb 0.55 -1.65 -0.00 0.00 -0.01 0.00 0.00 33.50 32.38 3mi6 n PRO 121 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 175.50 173.95 3mi6 s SER 122 N -0.92 -0.10 0.28 2.55 1.04 -1.26 -4.80 113.70 110.49 3mi6 s SER 122 Ca 0.64 -0.42 -0.04 0.00 0.48 0.00 0.00 55.95 56.61 3mi6 s SER 122 Cb -0.59 0.42 -0.05 0.00 0.10 0.00 0.00 66.02 65.90 3mi6 s SER 122 CO 0.57 -0.79 0.53 0.42 0.98 0.00 0.00 173.24 174.96 3mi6 s THR 123 N -2.77 5.05 0.18 2.02 -4.23 -1.26 -4.74 115.64 109.90 3mi6 s THR 123 Ca 0.16 -0.03 -0.11 0.00 -1.18 0.00 0.00 61.69 60.53 3mi6 s THR 123 Cb -0.00 -3.74 -0.00 0.00 1.34 0.00 0.00 72.50 70.09 3mi6 s THR 123 CO 0.02 -0.32 0.35 0.72 -0.54 0.00 0.00 174.62 174.85 3mi6 s PHE 124 N -2.07 0.33 -0.60 3.99 -0.12 0.31 -4.10 117.98 115.72 3mi6 s PHE 124 Ca 0.43 -0.69 0.04 0.00 -0.05 0.00 0.00 56.93 56.67 3mi6 s PHE 124 Cb -0.11 0.04 0.16 0.00 -0.63 0.00 0.00 43.02 42.48 3mi6 s PHE 124 CO 0.30 -0.79 0.40 0.34 -0.05 0.00 0.00 175.22 175.42 3mi6 s ASP 125 N -2.97 4.19 0.00 1.98 2.15 -0.43 -4.52 116.67 117.08 3mi6 s ASP 125 Ca 0.17 -3.45 0.27 0.00 0.43 0.00 0.00 52.55 49.97 3mi6 s ASP 125 Cb 0.02 -1.43 0.96 0.00 -0.30 0.00 0.00 42.92 42.17 3mi6 s ASP 125 CO 0.01 -0.14 1.70 0.47 -0.17 0.00 0.00 175.17 177.04 3mi6 n ASP 126 N 2.48 0.62 -0.48 -0.34 8.00 -1.26 -4.41 116.55 121.16 3mi6 n ASP 126 Ca 0.17 -0.55 0.07 0.00 0.71 0.00 0.00 54.79 55.19 3mi6 n ASP 126 Cb 0.36 0.01 0.19 0.00 -0.02 0.00 0.00 41.12 41.66 3mi6 n ASP 126 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3mi6 n THR 127 N -0.98 2.11 -3.98 -3.53 -2.24 -1.26 -4.99 114.28 99.42 3mi6 n THR 127 Ca 0.12 -3.00 -0.27 0.00 -2.27 0.00 0.00 64.05 58.63 3mi6 n THR 127 Cb 0.31 -0.23 -0.02 0.00 -2.10 0.00 0.00 70.33 68.29 3mi6 n THR 127 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3mi6 n ASP 128 N -1.18 -0.66 -1.38 3.42 2.03 -1.26 -4.84 116.55 112.68 3mi6 n ASP 128 Ca 0.18 -1.05 0.06 0.00 0.52 0.00 0.00 54.79 54.50 3mi6 n ASP 128 Cb 0.68 -2.87 0.31 0.00 -0.72 0.00 0.00 41.12 38.52 3mi6 n ASP 128 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 3mi6 n ASP 129 N -2.93 4.55 -0.71 1.67 2.03 -1.26 -4.93 116.55 114.98 3mi6 n ASP 129 Ca -0.29 -3.06 -0.08 0.00 0.52 0.00 0.00 54.79 51.87 3mi6 n ASP 129 Cb 0.68 -0.62 -0.03 0.00 -0.72 0.00 0.00 41.12 40.43 3mi6 n ASP 129 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3mi6 n ASP 130 N -0.13 -3.69 -4.78 1.67 8.00 -1.26 -4.60 116.55 111.76 3mi6 n ASP 130 Ca 0.27 0.14 -0.35 0.00 0.71 0.00 0.00 54.79 55.56 3mi6 n ASP 130 Cb 1.07 -2.20 -0.01 0.00 -0.02 0.00 0.00 41.12 39.96 3mi6 n ASP 130 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3mi6 s ALA 131 N -2.33 2.81 0.05 2.24 0.00 -1.26 -4.58 121.76 118.68 3mi6 s ALA 131 Ca 0.00 0.79 0.02 0.00 0.00 0.00 0.00 51.96 52.77 3mi6 s ALA 131 Cb 0.00 -3.33 -0.03 0.00 0.00 0.00 0.00 23.12 19.76 3mi6 s ALA 131 CO 0.00 -0.61 -0.07 -0.65 0.00 0.00 0.00 175.76 174.43 3mi6 s GLN 132 N -3.12 0.58 -0.14 0.00 -0.21 -0.93 0.01 119.66 115.85 3mi6 s GLN 132 Ca 0.69 -0.88 0.02 0.00 0.02 0.00 0.00 55.36 55.21 3mi6 s GLN 132 Cb -0.23 -0.24 0.01 0.00 1.00 0.00 0.00 33.01 33.56 3mi6 s GLN 132 CO 0.27 0.03 -0.20 0.99 -2.12 0.00 0.00 175.29 174.26 3mi6 s THR 133 N -1.93 1.89 -0.29 -0.19 2.01 -0.12 -0.62 115.64 116.38 3mi6 s THR 133 Ca -0.05 -0.87 -0.11 0.00 0.31 0.00 0.00 61.69 60.97 3mi6 s THR 133 Cb -0.06 -1.69 -0.04 0.00 0.01 0.00 0.00 72.50 70.72 3mi6 s THR 133 CO -0.01 0.52 0.19 -0.22 -0.69 0.00 0.00 174.62 174.40 3mi6 s LEU 134 N 0.95 4.07 -0.21 4.42 2.96 0.13 -0.73 118.68 130.27 3mi6 s LEU 134 Ca -0.05 -0.11 -0.07 0.00 -0.22 0.00 0.00 54.13 53.68 3mi6 s LEU 134 Cb -0.15 -2.11 -0.04 0.00 0.50 0.00 0.00 46.19 44.40 3mi6 s LEU 134 CO -0.03 -0.09 0.07 -0.69 -1.32 0.00 0.00 176.35 174.28 3mi6 s VAL 135 N 1.74 4.56 -0.19 1.68 1.01 -0.40 -0.68 120.40 128.13 3mi6 s VAL 135 Ca 0.07 -0.10 0.01 0.00 0.00 0.00 0.00 61.98 61.96 3mi6 s VAL 135 Cb -0.16 -3.09 0.03 0.00 0.00 0.00 0.00 36.38 33.15 3mi6 s VAL 135 CO 0.10 0.40 -0.18 -0.69 0.00 0.00 0.00 175.10 174.73 3mi6 s VAL 136 N 0.94 2.05 0.17 2.92 1.01 -0.44 -0.58 120.40 126.47 3mi6 s VAL 136 Ca 0.04 -1.02 0.04 0.00 0.00 0.00 0.00 61.98 61.04 3mi6 s VAL 136 Cb -0.14 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 3mi6 s VAL 136 CO 0.03 0.45 0.22 -0.44 0.00 0.00 0.00 175.10 175.35 3mi6 s SER 137 N 1.27 5.89 0.09 3.32 0.01 -0.01 -0.74 113.70 123.53 3mi6 s SER 137 Ca 0.03 -0.01 -0.04 0.00 1.31 0.00 0.00 55.95 57.23 3mi6 s SER 137 Cb -0.14 -1.64 -0.02 0.00 0.21 0.00 0.00 66.02 64.42 3mi6 s SER 137 CO -0.12 0.04 0.09 -0.36 0.41 0.00 0.00 173.24 173.31 3mi6 s PHE 138 N -1.81 0.44 0.05 2.43 0.40 -0.05 -2.52 117.98 116.92 3mi6 s PHE 138 Ca 0.33 -0.90 0.06 0.00 -0.60 0.00 0.00 56.93 55.82 3mi6 s PHE 138 Cb -0.10 -0.26 -0.02 0.00 0.51 0.00 0.00 43.02 43.15 3mi6 s PHE 138 CO 0.26 -0.50 -0.18 -0.80 0.70 0.00 0.00 175.22 174.70 3mi6 s ASN 139 N -2.93 2.16 -0.12 1.36 -0.87 -0.14 -2.02 114.94 112.38 3mi6 s ASN 139 Ca 0.10 -0.51 -0.29 0.00 -1.57 0.00 0.00 52.86 50.59 3mi6 s ASN 139 Cb 0.06 -0.16 -0.01 0.00 -0.02 0.00 0.00 41.25 41.12 3mi6 s ASN 139 CO -0.07 0.10 0.99 -0.62 -2.57 0.00 0.00 177.10 174.93 3mi6 s ASP 140 N -1.23 7.21 0.56 -1.22 2.15 0.86 -0.60 116.67 124.40 3mi6 s ASP 140 Ca 0.05 1.49 0.33 0.00 0.43 0.00 0.00 52.55 54.85 3mi6 s ASP 140 Cb -0.09 -2.55 1.64 0.00 -0.30 0.00 0.00 42.92 41.63 3mi6 s ASP 140 CO 0.02 -0.46 2.11 0.03 -0.17 0.00 0.00 175.17 176.70 3mi6 h ARG 141 N 7.14 0.00 0.00 4.34 3.08 -1.62 -2.13 114.38 125.19 3mi6 h ARG 141 Ca -0.30 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.58 3mi6 h ARG 141 Cb 1.14 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.16 3mi6 h ARG 141 CO 0.86 0.06 -1.17 -0.89 -1.07 0.00 0.00 179.97 177.77 3mi6 n ILE 142 N -3.34 1.49 0.45 2.04 5.41 -1.26 -4.69 119.36 119.46 3mi6 n ILE 142 Ca -0.01 0.02 0.11 0.00 1.00 0.00 0.00 62.75 63.86 3mi6 n ILE 142 Cb 0.23 -2.15 -0.09 0.00 -0.71 0.00 0.00 39.64 36.91 3mi6 n ILE 142 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 3mi6 n THR 143 N -4.47 0.07 -0.26 1.39 -2.24 -1.24 -4.96 114.28 102.57 3mi6 n THR 143 Ca -0.26 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.24 3mi6 n THR 143 Cb 0.57 0.33 0.00 0.00 -2.10 0.00 0.00 70.33 69.13 3mi6 n THR 143 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3mi6 n GLY 144 N 1.36 1.22 3.65 3.38 0.00 -0.80 -4.75 105.19 109.24 3mi6 n GLY 144 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3mi6 n GLY 144 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3mi6 n LEU 145 N 0.00 2.70 -4.40 0.99 7.94 -1.26 -4.43 117.00 118.54 3mi6 n LEU 145 Ca 0.00 1.19 -0.33 0.00 -1.11 0.00 0.00 56.01 55.76 3mi6 n LEU 145 Cb 0.00 -1.39 -0.14 0.00 0.53 0.00 0.00 43.42 42.42 3mi6 n LEU 145 CO 0.00 -0.93 -0.43 0.00 -1.11 0.00 0.00 177.39 174.92 3mi6 s ALA 146 N -1.08 2.69 -0.11 1.96 0.00 0.16 -0.09 121.76 125.29 3mi6 s ALA 146 Ca 0.57 -0.88 0.01 0.00 0.00 0.00 0.00 51.96 51.67 3mi6 s ALA 146 Cb -0.63 -1.27 0.02 0.00 0.00 0.00 0.00 23.12 21.23 3mi6 s ALA 146 CO 0.61 0.25 -0.13 -1.17 0.00 0.00 0.00 175.76 175.32 3mi6 s LEU 147 N 0.33 1.60 -0.25 0.00 2.96 -0.86 0.15 118.68 122.60 3mi6 s LEU 147 Ca -0.09 -0.39 -0.08 0.00 -0.22 0.00 0.00 54.13 53.34 3mi6 s LEU 147 Cb -0.16 -1.01 -0.04 0.00 0.50 0.00 0.00 46.19 45.48 3mi6 s LEU 147 CO 0.05 -0.02 0.11 -1.81 -1.32 0.00 0.00 176.35 173.36 3mi6 s ASP 148 N 1.16 5.47 -0.20 3.68 1.01 0.34 -0.87 116.67 127.27 3mi6 s ASP 148 Ca -0.04 -0.11 -0.15 0.00 0.71 0.00 0.00 52.55 52.96 3mi6 s ASP 148 Cb -0.14 -1.99 -0.04 0.00 1.01 0.00 0.00 42.92 41.76 3mi6 s ASP 148 CO -0.04 -0.02 0.34 -0.76 0.21 0.00 0.00 175.17 174.91 3mi6 s LEU 149 N 1.52 4.17 -0.19 1.23 1.43 0.08 -1.15 118.68 125.76 3mi6 s LEU 149 Ca 0.06 0.46 -0.05 0.00 -1.03 0.00 0.00 54.13 53.58 3mi6 s LEU 149 Cb -0.15 -2.43 -0.02 0.00 0.03 0.00 0.00 46.19 43.62 3mi6 s LEU 149 CO 0.06 -0.02 -0.01 0.20 0.23 0.00 0.00 176.35 176.80 3mi6 s ASN 150 N 0.93 4.76 -0.14 2.29 0.01 0.03 -1.33 114.94 121.49 3mi6 s ASN 150 Ca 0.17 -0.21 0.01 0.00 -0.71 0.00 0.00 52.86 52.12 3mi6 s ASN 150 Cb -0.14 -1.80 0.02 0.00 0.41 0.00 0.00 41.25 39.73 3mi6 s ASN 150 CO 0.07 0.08 -0.16 -0.31 -1.51 0.00 0.00 177.10 175.26 3mi6 s TYR 151 N 0.90 2.25 -0.19 2.20 1.51 0.15 -2.27 117.35 121.90 3mi6 s TYR 151 Ca 0.01 -1.19 -0.02 0.00 -1.01 0.00 0.00 57.07 54.86 3mi6 s TYR 151 Cb -0.14 -1.61 -0.00 0.00 -0.11 0.00 0.00 41.96 40.09 3mi6 s TYR 151 CO 0.02 -0.61 -0.10 -1.12 -1.11 0.00 0.00 175.55 172.62 3mi6 s SER 152 N 1.19 3.93 -0.24 2.29 0.01 0.04 0.17 113.70 121.09 3mi6 s SER 152 Ca -0.01 -0.44 -0.25 0.00 1.31 0.00 0.00 55.95 56.56 3mi6 s SER 152 Cb -0.14 -1.64 -0.01 0.00 0.21 0.00 0.00 66.02 64.44 3mi6 s SER 152 CO -0.07 0.03 0.83 -0.63 0.41 0.00 0.00 173.24 173.82 3mi6 s ILE 153 N 1.15 4.84 -0.83 1.44 -1.09 0.20 -0.86 121.20 126.05 3mi6 s ILE 153 Ca 0.01 1.58 -0.03 0.00 -2.23 0.00 0.00 60.65 59.99 3mi6 s ILE 153 Cb -0.14 -4.12 0.21 0.00 -1.58 0.00 0.00 42.46 36.82 3mi6 s ILE 153 CO -0.03 -0.07 0.71 -0.36 -1.23 0.00 0.00 174.94 173.96 3mi6 s PHE 154 N 2.79 3.78 0.41 3.97 0.40 0.11 -2.19 117.98 127.26 3mi6 s PHE 154 Ca 0.35 -2.90 0.11 0.00 -0.60 0.00 0.00 56.93 53.89 3mi6 s PHE 154 Cb -0.15 -3.27 0.92 0.00 0.51 0.00 0.00 43.02 41.02 3mi6 s PHE 154 CO 0.08 -0.78 1.98 -1.00 0.70 0.00 0.00 175.22 176.19 3mi6 h PRO 155 N 6.35 0.52 -0.00 0.24 0.13 -1.81 -2.63 132.00 134.79 3mi6 h PRO 155 Ca 0.12 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 3mi6 h PRO 155 Cb 0.86 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.87 3mi6 h PRO 155 CO 0.82 0.34 -0.09 0.72 -0.23 0.00 0.00 178.00 179.56 3mi6 n HIS 156 N -4.48 0.00 -0.40 1.56 8.25 -1.26 -0.52 115.22 118.37 3mi6 n HIS 156 Ca 0.10 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.58 3mi6 n HIS 156 Cb 0.30 -0.23 0.04 0.00 1.12 0.00 0.00 29.99 31.22 3mi6 n HIS 156 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 3mi6 n GLN 157 N -1.10 2.28 -4.05 -0.41 3.00 -1.01 -4.98 117.38 111.12 3mi6 n GLN 157 Ca 0.14 -1.73 -0.32 0.00 -0.01 0.00 0.00 57.00 55.08 3mi6 n GLN 157 Cb 0.27 -1.10 -0.00 0.00 0.00 0.00 0.00 30.24 29.41 3mi6 n GLN 157 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 3mi6 n ASP 158 N -0.72 -3.33 -4.43 1.08 8.00 -1.16 -4.81 116.55 111.18 3mi6 n ASP 158 Ca 0.04 -0.92 -0.32 0.00 0.71 0.00 0.00 54.79 54.30 3mi6 n ASP 158 Cb 0.38 -3.27 -0.14 0.00 -0.02 0.00 0.00 41.12 38.07 3mi6 n ASP 158 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3mi6 s VAL 159 N -3.41 2.82 -0.06 2.53 1.01 -1.12 -3.80 120.40 118.38 3mi6 s VAL 159 Ca 0.57 -0.81 0.06 0.00 0.00 0.00 0.00 61.98 61.80 3mi6 s VAL 159 Cb -0.30 -2.09 -0.01 0.00 0.00 0.00 0.00 36.38 33.98 3mi6 s VAL 159 CO 0.88 0.59 -0.24 -0.63 0.00 0.00 0.00 175.10 175.70 3mi6 s ILE 160 N -0.63 1.94 -0.11 2.22 1.01 -0.60 -0.71 121.20 124.31 3mi6 s ILE 160 Ca 0.10 -1.00 0.01 0.00 0.00 0.00 0.00 60.65 59.76 3mi6 s ILE 160 Cb -0.11 -1.64 -0.01 0.00 0.01 0.00 0.00 42.46 40.70 3mi6 s ILE 160 CO 0.01 0.54 -0.15 -0.69 0.00 0.00 0.00 174.94 174.65 3mi6 s VAL 161 N -0.11 2.91 0.06 2.92 1.01 -0.04 -0.70 120.40 126.46 3mi6 s VAL 161 Ca -0.04 -0.73 0.07 0.00 0.00 0.00 0.00 61.98 61.28 3mi6 s VAL 161 Cb -0.13 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 3mi6 s VAL 161 CO 0.04 0.54 -0.19 -0.54 0.00 0.00 0.00 175.10 174.95 3mi6 s LYS 162 N 0.15 1.17 0.17 2.72 1.02 -0.26 -0.78 119.74 123.93 3mi6 s LYS 162 Ca -0.08 -0.98 -0.24 0.00 0.02 0.00 0.00 55.97 54.69 3mi6 s LYS 162 Cb -0.15 -1.31 0.06 0.00 -0.52 0.00 0.00 37.83 35.91 3mi6 s LYS 162 CO 0.05 0.32 0.75 -1.54 -0.92 0.00 0.00 175.35 174.01 3mi6 s SER 163 N -1.46 -0.36 -0.00 2.83 1.04 -0.96 0.28 113.70 115.06 3mi6 s SER 163 Ca 0.05 -0.28 0.06 0.00 0.48 0.00 0.00 55.95 56.27 3mi6 s SER 163 Cb -0.09 0.59 -0.02 0.00 0.10 0.00 0.00 66.02 66.60 3mi6 s SER 163 CO 0.03 -1.03 -0.19 0.00 0.98 0.00 0.00 173.24 173.02 3mi6 s ALA 164 N -3.63 1.62 -0.14 5.32 0.00 -1.26 -0.79 121.76 122.88 3mi6 s ALA 164 Ca 0.07 -0.87 0.02 0.00 0.00 0.00 0.00 51.96 51.18 3mi6 s ALA 164 Cb -0.03 -0.39 0.01 0.00 0.00 0.00 0.00 23.12 22.71 3mi6 s ALA 164 CO -0.03 0.39 -0.22 0.21 0.00 0.00 0.00 175.76 176.11 3mi6 s LYS 165 N -0.59 3.02 -0.14 0.00 2.20 -0.30 -1.50 119.74 122.43 3mi6 s LYS 165 Ca 0.07 -0.85 -0.10 0.00 -0.36 0.00 0.00 55.97 54.73 3mi6 s LYS 165 Cb -0.08 -2.45 -0.05 0.00 -1.51 0.00 0.00 37.83 33.75 3mi6 s LYS 165 CO -0.00 -0.03 0.20 -0.06 -0.36 0.00 0.00 175.35 175.09 3mi6 s PHE 166 N 0.85 3.54 0.01 4.03 0.40 0.19 -0.50 117.98 126.50 3mi6 s PHE 166 Ca -0.06 0.54 0.05 0.00 -0.60 0.00 0.00 56.93 56.86 3mi6 s PHE 166 Cb -0.15 -2.11 -0.02 0.00 0.51 0.00 0.00 43.02 41.25 3mi6 s PHE 166 CO -0.03 0.51 -0.15 0.99 0.70 0.00 0.00 175.22 177.24 3mi6 s THR 167 N -0.37 1.18 -0.68 0.64 2.01 0.39 -1.34 115.64 117.48 3mi6 s THR 167 Ca 0.14 -0.77 0.04 0.00 0.31 0.00 0.00 61.69 61.41 3mi6 s THR 167 Cb -0.12 -1.01 0.16 0.00 0.01 0.00 0.00 72.50 71.54 3mi6 s THR 167 CO 0.03 0.23 0.46 0.21 -0.69 0.00 0.00 174.62 174.87 3mi6 s ASN 168 N -0.63 4.84 0.00 3.53 3.84 -0.85 0.40 114.94 126.07 3mi6 s ASN 168 Ca 0.05 -3.62 0.15 0.00 0.21 0.00 0.00 52.86 49.65 3mi6 s ASN 168 Cb -0.06 -1.67 0.85 0.00 -0.55 0.00 0.00 41.25 39.82 3mi6 s ASN 168 CO 0.00 -0.14 1.56 -0.81 -2.79 0.00 0.00 177.10 174.92 3mi6 n PRO 169 N 2.32 1.09 -1.32 0.43 -0.04 -1.26 -0.39 135.00 135.82 3mi6 n PRO 169 Ca 0.16 -0.14 -0.13 0.00 -0.04 0.00 0.00 63.50 63.35 3mi6 n PRO 169 Cb 0.35 -1.25 0.08 0.00 -0.04 0.00 0.00 33.50 32.64 3mi6 n PRO 169 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3mi6 n SER 170 N -0.60 0.40 -0.74 3.54 3.41 -1.26 -4.89 113.62 113.49 3mi6 n SER 170 Ca 0.12 -1.43 0.07 0.00 -0.26 0.00 0.00 58.87 57.36 3mi6 n SER 170 Cb 0.08 -0.41 0.19 0.00 -0.26 0.00 0.00 64.21 63.81 3mi6 n SER 170 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3mi6 n SER 171 N -3.17 3.28 -4.19 4.04 3.41 -1.26 -4.44 113.62 111.29 3mi6 n SER 171 Ca 0.08 -2.35 -0.24 0.00 -0.26 0.00 0.00 58.87 56.10 3mi6 n SER 171 Cb 0.30 -0.34 -0.15 0.00 -0.26 0.00 0.00 64.21 63.76 3mi6 n SER 171 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3mi6 s GLU 172 N -1.64 1.33 0.32 4.33 2.02 -1.26 -4.89 118.70 118.90 3mi6 s GLU 172 Ca 0.30 -0.77 -0.29 0.00 0.02 0.00 0.00 54.97 54.23 3mi6 s GLU 172 Cb 0.20 -1.35 -0.11 0.00 0.10 0.00 0.00 34.13 32.97 3mi6 s GLU 172 CO 0.13 0.35 1.55 0.15 0.02 0.00 0.00 175.26 177.47 3mi6 s LYS 173 N -0.82 4.12 -0.04 1.61 1.02 -1.26 -4.45 119.74 119.92 3mi6 s LYS 173 Ca 0.06 2.57 0.03 0.00 0.02 0.00 0.00 55.97 58.65 3mi6 s LYS 173 Cb -0.08 -3.01 0.00 0.00 -0.52 0.00 0.00 37.83 34.23 3mi6 s LYS 173 CO 0.01 -0.59 -0.14 -0.51 -0.92 0.00 0.00 175.35 173.19 3mi6 s LEU 174 N -1.00 1.83 -0.23 3.17 1.43 -0.73 -4.21 118.68 118.94 3mi6 s LEU 174 Ca 0.60 -0.29 -0.08 0.00 -1.03 0.00 0.00 54.13 53.32 3mi6 s LEU 174 Cb -0.47 -0.82 -0.04 0.00 0.03 0.00 0.00 46.19 44.89 3mi6 s LEU 174 CO 0.53 0.11 0.09 -0.69 0.23 0.00 0.00 176.35 176.61 3mi6 s VAL 175 N 0.20 4.71 -0.65 -1.59 1.01 -0.71 0.25 120.40 123.61 3mi6 s VAL 175 Ca -0.06 -0.04 -0.26 0.00 0.00 0.00 0.00 61.98 61.62 3mi6 s VAL 175 Cb -0.11 -3.18 0.04 0.00 0.00 0.00 0.00 36.38 33.12 3mi6 s VAL 175 CO 0.02 0.37 1.14 -0.76 0.00 0.00 0.00 175.10 175.86 3mi6 s LEU 176 N 1.17 3.64 0.29 3.92 1.43 0.11 -0.69 118.68 128.56 3mi6 s LEU 176 Ca 0.05 -0.41 0.15 0.00 -1.03 0.00 0.00 54.13 52.89 3mi6 s LEU 176 Cb -0.14 -2.72 0.24 0.00 0.03 0.00 0.00 46.19 43.60 3mi6 s LEU 176 CO 0.04 -1.57 1.52 0.78 0.23 0.00 0.00 176.35 177.35 3mi6 h ASN 177 N 9.70 0.00 -2.74 2.29 2.35 -1.31 -1.14 115.58 124.72 3mi6 h ASN 177 Ca -0.27 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.47 3mi6 h ASN 177 Cb 1.06 0.00 -0.23 0.00 0.05 0.00 0.00 38.32 39.20 3mi6 h ASN 177 CO 1.21 0.52 -0.14 -0.60 -1.65 0.00 0.00 177.43 176.76 3mi6 s ARG 178 N -3.15 0.56 -0.42 0.81 3.52 -1.18 -4.60 118.95 114.49 3mi6 s ARG 178 Ca 0.02 1.16 0.03 0.00 -0.13 0.00 0.00 55.73 56.82 3mi6 s ARG 178 Cb 0.09 0.31 0.16 0.00 -1.56 0.00 0.00 34.95 33.95 3mi6 s ARG 178 CO 0.73 -0.18 0.33 0.00 -0.81 0.00 0.00 175.30 175.37 3mi6 s ALA 179 N 2.02 1.48 0.69 6.12 0.00 -1.26 -0.66 121.76 130.15 3mi6 s ALA 179 Ca -0.08 -2.45 -0.11 0.00 0.00 0.00 0.00 51.96 49.32 3mi6 s ALA 179 Cb -0.08 -1.63 0.00 0.00 0.00 0.00 0.00 23.12 21.41 3mi6 s ALA 179 CO -0.17 -2.00 1.06 -0.51 0.00 0.00 0.00 175.76 174.14 3mi6 s LEU 180 N 0.12 3.03 -0.01 0.00 2.01 -0.14 -4.39 118.68 119.30 3mi6 s LEU 180 Ca 0.30 1.40 0.02 0.00 0.01 0.00 0.00 54.13 55.86 3mi6 s LEU 180 Cb -0.01 -4.28 -0.25 0.00 0.01 0.00 0.00 46.19 41.66 3mi6 s LEU 180 CO -0.16 -1.32 0.79 0.28 1.01 0.00 0.00 176.35 176.95 3mi6 h SER 181 N -0.64 0.24 -4.35 2.29 0.02 -1.25 -3.43 113.55 106.43 3mi6 h SER 181 Ca -0.45 -0.38 -0.05 0.00 -0.84 0.00 0.00 61.79 60.07 3mi6 h SER 181 Cb 1.22 -0.08 -0.20 0.00 0.14 0.00 0.00 62.40 63.48 3mi6 h SER 181 CO 0.60 1.33 0.15 -0.55 -1.14 0.00 0.00 176.83 177.22 3mi6 s SER 182 N -6.71 -0.72 -0.06 3.07 0.15 -0.96 -3.67 113.70 104.80 3mi6 s SER 182 Ca -0.08 1.19 0.03 0.00 0.70 0.00 0.00 55.95 57.79 3mi6 s SER 182 Cb 0.07 1.14 0.00 0.00 -1.71 0.00 0.00 66.02 65.52 3mi6 s SER 182 CO 0.83 -0.38 -0.16 -1.58 1.20 0.00 0.00 173.24 173.16 3mi6 s GLN 183 N -0.18 1.86 -0.09 5.44 0.74 -1.26 -2.44 119.66 123.73 3mi6 s GLN 183 Ca -0.04 -0.55 0.04 0.00 0.05 0.00 0.00 55.36 54.86 3mi6 s GLN 183 Cb -0.03 -1.55 0.00 0.00 1.10 0.00 0.00 33.01 32.53 3mi6 s GLN 183 CO 0.04 0.14 -0.21 -1.17 -0.55 0.00 0.00 175.29 173.54 3mi6 s LEU 184 N 0.33 1.99 -0.19 3.68 2.96 -0.16 -4.81 118.68 122.47 3mi6 s LEU 184 Ca -0.10 -0.50 -0.05 0.00 -0.22 0.00 0.00 54.13 53.26 3mi6 s LEU 184 Cb -0.14 -1.27 -0.03 0.00 0.50 0.00 0.00 46.19 45.25 3mi6 s LEU 184 CO 0.04 0.14 -0.00 -1.81 -1.32 0.00 0.00 176.35 173.39 3mi6 s ASP 185 N 0.39 4.86 0.09 3.68 1.01 -1.26 -0.16 116.67 125.27 3mi6 s ASP 185 Ca -0.17 -0.18 0.08 0.00 0.71 0.00 0.00 52.55 52.98 3mi6 s ASP 185 Cb -0.17 -1.83 -0.04 0.00 1.01 0.00 0.00 42.92 41.89 3mi6 s ASP 185 CO 0.08 0.08 -0.17 -0.76 0.21 0.00 0.00 175.17 174.61 3mi6 s LEU 186 N 0.90 2.72 0.39 1.23 1.43 0.07 -4.91 118.68 120.51 3mi6 s LEU 186 Ca 0.01 -0.48 0.28 0.00 -1.03 0.00 0.00 54.13 52.90 3mi6 s LEU 186 Cb -0.14 -1.58 1.03 0.00 0.03 0.00 0.00 46.19 45.53 3mi6 s LEU 186 CO 0.02 0.21 1.82 1.55 0.23 0.00 0.00 176.35 180.17 3mi6 h PRO 187 N 4.01 0.00 0.00 1.29 0.13 -1.91 -2.28 132.00 133.24 3mi6 h PRO 187 Ca -0.49 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.12 3mi6 h PRO 187 Cb 1.16 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.18 3mi6 h PRO 187 CO 0.47 0.00 -0.44 -0.40 -0.23 0.00 0.00 178.00 177.40 3mi6 n ASP 188 N -2.70 1.16 -0.41 1.44 5.68 -1.26 -4.48 116.55 115.98 3mi6 n ASP 188 Ca 0.02 -3.06 0.02 0.00 -0.50 0.00 0.00 54.79 51.27 3mi6 n ASP 188 Cb 0.33 1.00 0.03 0.00 -1.14 0.00 0.00 41.12 41.33 3mi6 n ASP 188 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3mi6 n ALA 189 N -1.15 2.04 -2.63 2.12 0.00 -1.06 -3.26 120.51 116.57 3mi6 n ALA 189 Ca -0.15 -1.32 -0.43 0.00 0.00 0.00 0.00 53.44 51.54 3mi6 n ALA 189 Cb 0.58 -0.47 -0.00 0.00 0.00 0.00 0.00 19.45 19.56 3mi6 n ALA 189 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3mi6 s ASN 190 N -1.37 6.85 0.11 0.00 0.02 -1.26 -4.55 114.94 114.73 3mi6 s ASN 190 Ca 0.06 -2.45 -0.07 0.00 -1.02 0.00 0.00 52.86 49.38 3mi6 s ASN 190 Cb 0.06 -2.55 -0.01 0.00 0.02 0.00 0.00 41.25 38.76 3mi6 s ASN 190 CO 0.01 -1.13 0.18 -0.31 0.02 0.00 0.00 177.10 175.86 3mi6 s TYR 191 N 3.90 0.32 -0.12 2.20 2.02 -1.26 -4.45 117.35 119.96 3mi6 s TYR 191 Ca 0.52 -0.74 -0.06 0.00 -0.37 0.00 0.00 57.07 56.41 3mi6 s TYR 191 Cb 0.03 -0.13 -0.04 0.00 -0.40 0.00 0.00 41.96 41.41 3mi6 s TYR 191 CO 0.05 -0.57 0.12 -0.51 -1.57 0.00 0.00 175.55 173.08 3mi6 s ASP 192 N -2.91 6.25 -0.07 2.29 1.01 0.12 -1.55 116.67 121.81 3mi6 s ASP 192 Ca 0.10 0.43 -0.27 0.00 0.71 0.00 0.00 52.55 53.52 3mi6 s ASP 192 Cb 0.05 -2.00 -0.03 0.00 1.01 0.00 0.00 42.92 41.96 3mi6 s ASP 192 CO -0.07 0.40 0.87 -0.22 0.21 0.00 0.00 175.17 176.37 3mi6 s LEU 193 N -0.99 4.30 -0.17 1.23 2.96 0.45 -2.07 118.68 124.38 3mi6 s LEU 193 Ca 0.15 1.41 0.01 0.00 -0.22 0.00 0.00 54.13 55.48 3mi6 s LEU 193 Cb -0.12 -3.36 0.02 0.00 0.50 0.00 0.00 46.19 43.23 3mi6 s LEU 193 CO 0.04 -0.27 -0.20 -0.63 -1.32 0.00 0.00 176.35 173.97 3mi6 s ILE 194 N 1.33 2.14 0.32 6.68 1.01 -1.26 -0.90 121.20 130.51 3mi6 s ILE 194 Ca 0.45 -0.92 0.04 0.00 0.00 0.00 0.00 60.65 60.21 3mi6 s ILE 194 Cb -0.19 -1.89 -0.06 0.00 0.01 0.00 0.00 42.46 40.33 3mi6 s ILE 194 CO 0.20 0.54 0.05 0.00 0.00 0.00 0.00 174.94 175.73 3mi6 s GLN 195 N 1.16 1.64 -0.32 2.79 -2.07 -0.55 -4.81 119.66 117.50 3mi6 s GLN 195 Ca 0.02 -1.90 0.00 0.00 -1.82 0.00 0.00 55.36 51.66 3mi6 s GLN 195 Cb -0.14 -0.91 0.10 0.00 -1.09 0.00 0.00 33.01 30.98 3mi6 s GLN 195 CO -0.09 -0.16 0.09 -0.06 -1.32 0.00 0.00 175.29 173.75 3mi6 s PHE 196 N -3.26 2.22 0.25 9.60 0.08 -1.26 -2.15 117.98 123.46 3mi6 s PHE 196 Ca 0.36 -2.07 0.12 0.00 0.12 0.00 0.00 56.93 55.45 3mi6 s PHE 196 Cb 0.08 -2.02 -0.05 0.00 -0.57 0.00 0.00 43.02 40.47 3mi6 s PHE 196 CO 0.15 -0.89 -0.21 -1.12 -0.10 0.00 0.00 175.22 173.05 3mi6 s SER 197 N 1.39 3.50 0.00 1.36 0.01 -0.69 -1.86 113.70 117.42 3mi6 s SER 197 Ca 0.10 -0.98 0.00 0.00 1.31 0.00 0.00 55.95 56.39 3mi6 s SER 197 Cb -0.18 -0.28 0.00 0.00 0.21 0.00 0.00 66.02 65.77 3mi6 s SER 197 CO -0.20 0.06 0.00 0.61 0.41 0.00 0.00 173.24 174.12 3mi6 n GLY 198 N -0.32 -0.73 0.00 3.44 0.00 -0.61 -1.60 105.19 105.36 3mi6 n GLY 198 Ca -0.08 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.71 3mi6 n GLY 198 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3mi6 n THR 199 N 0.39 0.00 -1.61 2.61 5.66 -0.54 -4.11 114.28 116.69 3mi6 n THR 199 Ca 0.00 0.00 -0.46 0.00 -3.05 0.00 0.00 64.05 60.54 3mi6 n THR 199 Cb 0.00 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 68.75 3mi6 n THR 199 CO 0.00 0.00 0.00 1.87 -3.05 0.00 0.00 175.07 173.89 3mi6 n TRP 200 N 0.00 1.50 -0.58 1.09 -0.00 -1.26 -1.58 117.44 116.61 3mi6 n TRP 200 Ca 0.00 0.63 0.00 0.00 -0.00 0.00 0.00 57.50 58.13 3mi6 n TRP 200 Cb 0.00 -2.31 0.00 0.00 -0.00 0.00 0.00 31.31 29.00 3mi6 n TRP 200 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 3mi6 n ALA 201 N 1.12 0.00 -3.00 5.87 0.00 -1.26 -4.72 120.51 118.51 3mi6 n ALA 201 Ca 0.12 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.41 3mi6 n ALA 201 Cb 0.29 -1.02 0.01 0.00 0.00 0.00 0.00 19.45 18.72 3mi6 n ALA 201 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 3mi6 n ARG 202 N -1.66 0.91 -3.02 0.00 1.85 -0.62 -4.60 116.66 109.53 3mi6 n ARG 202 Ca 0.00 -2.72 -0.31 0.00 -1.00 0.00 0.00 57.85 53.82 3mi6 n ARG 202 Cb 0.06 -1.39 -0.04 0.00 -1.05 0.00 0.00 32.46 30.04 3mi6 n ARG 202 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 3mi6 s GLU 203 N -1.01 3.82 -1.62 2.89 8.01 -1.02 -1.47 118.70 128.29 3mi6 s GLU 203 Ca 0.33 0.46 -0.01 0.00 0.01 0.00 0.00 54.97 55.76 3mi6 s GLU 203 Cb 0.28 -2.45 0.00 0.00 -4.31 0.00 0.00 34.13 27.66 3mi6 s GLU 203 CO -0.10 0.06 0.06 0.54 0.01 0.00 0.00 175.26 175.83 3mi6 n ARG 204 N -0.94 -2.10 -1.71 1.61 1.74 -1.21 -4.61 116.66 109.43 3mi6 n ARG 204 Ca 0.02 0.92 -0.38 0.00 -0.77 0.00 0.00 57.85 57.63 3mi6 n ARG 204 Cb 0.54 -5.59 0.05 0.00 -1.02 0.00 0.00 32.46 26.43 3mi6 n ARG 204 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3mi6 n HIS 205 N -3.93 1.95 -2.99 -1.55 8.25 -0.63 -4.36 115.22 111.96 3mi6 n HIS 205 Ca -0.21 0.44 -0.40 0.00 -0.26 0.00 0.00 57.72 57.28 3mi6 n HIS 205 Cb 0.67 -2.31 -0.05 0.00 1.12 0.00 0.00 29.99 29.42 3mi6 n HIS 205 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3mi6 s LEU 206 N -3.22 4.22 -0.01 2.41 0.20 -1.26 -1.71 118.68 119.32 3mi6 s LEU 206 Ca 0.74 1.12 0.08 0.00 0.69 0.00 0.00 54.13 56.75 3mi6 s LEU 206 Cb -0.42 -3.11 -0.02 0.00 -0.43 0.00 0.00 46.19 42.21 3mi6 s LEU 206 CO 0.48 -0.27 -0.25 -0.31 -0.29 0.00 0.00 176.35 175.71 3mi6 s TYR 207 N 1.58 2.20 -0.08 5.38 2.02 -0.91 -5.00 117.35 122.54 3mi6 s TYR 207 Ca 0.36 -0.41 -0.01 0.00 -0.37 0.00 0.00 57.07 56.64 3mi6 s TYR 207 Cb -0.17 -1.40 0.03 0.00 -0.40 0.00 0.00 41.96 40.02 3mi6 s TYR 207 CO 0.14 -0.02 -0.01 0.50 -1.57 0.00 0.00 175.55 174.60 3mi6 s ARG 208 N -0.66 0.74 -0.05 -0.62 3.52 -1.26 -1.49 118.95 119.12 3mi6 s ARG 208 Ca 0.10 0.06 -0.04 0.00 -0.13 0.00 0.00 55.73 55.71 3mi6 s ARG 208 Cb -0.09 -1.05 0.02 0.00 -1.56 0.00 0.00 34.95 32.26 3mi6 s ARG 208 CO -0.01 -0.29 0.13 -1.01 -0.81 0.00 0.00 175.30 173.31 3mi6 s HIS 209 N 1.92 -0.15 0.56 5.12 3.76 -0.08 -4.95 115.29 121.48 3mi6 s HIS 209 Ca 0.05 0.38 -0.21 0.00 -0.15 0.00 0.00 55.06 55.12 3mi6 s HIS 209 Cb -0.12 0.02 -0.04 0.00 1.11 0.00 0.00 32.58 33.54 3mi6 s HIS 209 CO -0.06 -0.09 1.35 -2.14 -0.85 0.00 0.00 174.74 172.95 3mi6 s PRO 210 N 0.31 3.04 0.50 8.40 0.02 -1.26 0.17 135.00 146.18 3mi6 s PRO 210 Ca -0.02 2.20 -0.22 0.00 0.02 0.00 0.00 61.00 62.98 3mi6 s PRO 210 Cb -0.03 -2.19 -0.06 0.00 0.02 0.00 0.00 34.50 32.24 3mi6 s PRO 210 CO -0.01 -1.25 1.27 -0.51 -0.33 0.00 0.00 177.00 176.17 3mi6 s LEU 211 N -3.67 3.93 0.24 -5.54 1.02 -0.59 -4.69 118.68 109.39 3mi6 s LEU 211 Ca 0.73 2.56 0.05 0.00 0.02 0.00 0.00 54.13 57.50 3mi6 s LEU 211 Cb -0.40 -4.24 -0.05 0.00 0.02 0.00 0.00 46.19 41.51 3mi6 s LEU 211 CO 0.46 -1.26 -0.05 0.00 0.02 0.00 0.00 176.35 175.52 3mi6 s ARG 212 N -2.79 1.38 0.16 1.70 1.70 -1.26 -4.96 118.95 114.89 3mi6 s ARG 212 Ca 0.68 -1.68 -0.34 0.00 -0.47 0.00 0.00 55.73 53.92 3mi6 s ARG 212 Cb -0.35 -0.86 -0.15 0.00 -0.57 0.00 0.00 34.95 33.02 3mi6 s ARG 212 CO 0.42 -0.00 1.42 -2.30 -1.08 0.00 0.00 175.30 173.76 3mi6 n PRO 213 N -0.45 1.74 0.00 3.89 -0.02 -1.26 -4.36 135.00 134.54 3mi6 n PRO 213 Ca -0.06 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 3mi6 n PRO 213 Cb 0.63 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 3mi6 n PRO 213 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mi6 n GLY 214 N 2.69 1.05 0.00 -1.23 0.00 0.68 -4.90 105.19 103.48 3mi6 n GLY 214 Ca 0.16 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.42 3mi6 n GLY 214 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mi6 n GLN 216 N 0.00 0.00 -4.21 1.61 0.00 -0.66 -1.61 117.38 112.52 3mi6 n GLN 216 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 57.00 56.86 3mi6 n GLN 216 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 30.24 30.14 3mi6 n GLN 216 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 3mi6 s SER 217 N 0.00 1.62 0.06 2.61 1.04 -1.26 -1.56 113.70 116.21 3mi6 s SER 217 Ca 0.00 -0.90 0.07 0.00 0.48 0.00 0.00 55.95 55.60 3mi6 s SER 217 Cb 0.00 -0.00 -0.03 0.00 0.10 0.00 0.00 66.02 66.09 3mi6 s SER 217 CO 0.00 -0.29 -0.19 0.27 0.98 0.00 0.00 173.24 174.01 3mi6 s ILE 218 N -2.81 1.55 0.36 -1.02 -4.36 -0.50 -5.00 121.20 109.41 3mi6 s ILE 218 Ca 0.10 -1.26 -0.11 0.00 -0.26 0.00 0.00 60.65 59.12 3mi6 s ILE 218 Cb -0.01 -1.38 0.03 0.00 1.25 0.00 0.00 42.46 42.36 3mi6 s ILE 218 CO 0.00 0.08 0.67 -0.94 0.24 0.00 0.00 174.94 174.99 3mi6 s SER 219 N -1.39 0.29 -0.02 4.36 1.04 -1.26 -1.69 113.70 115.03 3mi6 s SER 219 Ca 0.06 -1.22 -0.03 0.00 0.48 0.00 0.00 55.95 55.24 3mi6 s SER 219 Cb -0.09 0.77 0.00 0.00 0.10 0.00 0.00 66.02 66.81 3mi6 s SER 219 CO 0.02 -1.52 0.07 -0.55 0.98 0.00 0.00 173.24 172.24 3mi6 s SER 220 N -3.12 -0.05 0.00 7.02 0.15 -0.61 -4.75 113.70 112.34 3mi6 s SER 220 Ca 0.20 0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.94 3mi6 s SER 220 Cb -0.03 0.15 0.01 0.00 -1.71 0.00 0.00 66.02 64.44 3mi6 s SER 220 CO 0.14 -0.07 0.67 0.18 1.20 0.00 0.00 173.24 175.35 3mi6 n LEU 221 N 2.82 1.34 -0.02 3.45 4.77 -1.26 -3.77 117.00 124.33 3mi6 n LEU 221 Ca -0.14 -1.31 -0.00 0.00 -0.03 0.00 0.00 56.01 54.53 3mi6 n LEU 221 Cb 0.59 -0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.68 3mi6 n LEU 221 CO 0.23 0.33 -0.00 0.03 -1.33 0.00 0.00 177.39 176.65 3mi6 h ARG 222 N 0.07 0.00 0.00 3.23 3.08 -1.95 -3.50 114.38 115.32 3mi6 h ARG 222 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3mi6 h ARG 222 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.22 3mi6 h ARG 222 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.90 3mi6 n ALA 224 N -2.38 -0.12 -2.32 0.04 0.00 -1.26 -4.36 120.51 110.12 3mi6 n ALA 224 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 3mi6 n ALA 224 Cb 0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 19.45 19.30 3mi6 n ALA 224 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3mi6 s SER 225 N -2.69 6.96 0.88 0.00 1.04 -0.42 -4.47 113.70 115.00 3mi6 s SER 225 Ca 0.00 2.09 -0.15 0.00 0.48 0.00 0.00 55.95 58.38 3mi6 s SER 225 Cb 0.00 -2.57 -0.02 0.00 0.10 0.00 0.00 66.02 63.52 3mi6 s SER 225 CO 0.00 -0.58 0.21 -1.20 0.98 0.00 0.00 173.24 172.65 3mi6 n SER 226 N 4.39 -2.57 0.14 7.02 7.64 -1.09 -3.79 113.62 125.36 3mi6 n SER 226 Ca 0.11 0.39 -0.00 0.00 1.01 0.00 0.00 58.87 60.37 3mi6 n SER 226 Cb 0.45 -1.12 0.16 0.00 -1.01 0.00 0.00 64.21 62.69 3mi6 n SER 226 CO 0.00 0.00 0.00 0.45 -3.01 0.00 0.00 175.04 172.48 3mi6 h HIS 227 N -1.08 0.00 0.06 1.43 3.86 -1.82 -3.38 115.15 114.21 3mi6 h HIS 227 Ca -0.44 0.00 -0.24 0.00 -1.16 0.00 0.00 60.37 58.53 3mi6 h HIS 227 Cb 1.31 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.78 3mi6 h HIS 227 CO 0.34 0.61 -1.06 1.96 0.86 0.00 0.00 177.93 180.64 3mi6 h GLN 228 N 0.00 0.29 -2.69 2.45 7.50 -1.89 -3.26 115.11 117.52 3mi6 h GLN 228 Ca -0.01 -0.39 -0.13 0.00 0.50 0.00 0.00 58.65 58.62 3mi6 h GLN 228 Cb 1.16 0.13 -0.28 0.00 0.05 0.00 0.00 27.48 28.54 3mi6 h GLN 228 CO 0.08 1.12 -0.37 -0.65 -1.50 0.00 0.00 178.83 177.51 3mi6 s GLN 229 N -2.97 0.31 0.29 1.46 -1.52 -1.26 -1.57 119.66 114.40 3mi6 s GLN 229 Ca -0.04 0.82 -0.08 0.00 -1.95 0.00 0.00 55.36 54.11 3mi6 s GLN 229 Cb 0.08 0.06 -0.06 0.00 -0.22 0.00 0.00 33.01 32.87 3mi6 s GLN 229 CO 0.87 -0.20 0.59 1.21 -0.25 0.00 0.00 175.29 177.51 3mi6 s ASN 230 N 1.86 6.53 0.45 5.90 2.47 -0.77 -2.66 114.94 128.71 3mi6 s ASN 230 Ca -0.06 0.87 0.25 0.00 0.42 0.00 0.00 52.86 54.34 3mi6 s ASN 230 Cb -0.10 -2.21 0.95 0.00 -1.45 0.00 0.00 41.25 38.44 3mi6 s ASN 230 CO -0.12 -0.19 1.83 -0.65 -3.72 0.00 0.00 177.10 174.26 3mi6 h PRO 231 N 1.91 0.00 -7.05 0.43 0.11 -1.91 -3.43 132.00 122.06 3mi6 h PRO 231 Ca -0.47 0.00 -0.52 0.00 0.11 0.00 0.00 66.00 65.12 3mi6 h PRO 231 Cb 1.18 0.00 0.09 0.00 0.11 0.00 0.00 31.00 32.38 3mi6 h PRO 231 CO 0.67 0.20 0.49 0.12 -0.21 0.00 0.00 178.00 179.27 3mi6 s PHE 232 N -3.64 2.60 -0.14 0.65 5.36 -1.26 -4.66 117.98 116.89 3mi6 s PHE 232 Ca 0.01 1.50 -0.04 0.00 -0.96 0.00 0.00 56.93 57.44 3mi6 s PHE 232 Cb 0.10 -3.46 0.05 0.00 -0.34 0.00 0.00 43.02 39.37 3mi6 s PHE 232 CO 0.63 -1.95 0.08 -0.51 -1.46 0.00 0.00 175.22 172.01 3mi6 s LEU 235 N -3.54 0.38 -0.02 6.12 1.43 -0.40 -4.32 118.68 118.33 3mi6 s LEU 235 Ca 0.70 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 53.34 3mi6 s LEU 235 Cb -0.30 -0.25 -0.03 0.00 0.03 0.00 0.00 46.19 45.63 3mi6 s LEU 235 CO 0.35 -0.32 -0.02 0.00 0.23 0.00 0.00 176.35 176.58 3mi6 s ALA 236 N 2.12 3.19 0.90 4.21 0.00 -0.88 -0.31 121.76 131.00 3mi6 s ALA 236 Ca 0.02 -0.95 -0.10 0.00 0.00 0.00 0.00 51.96 50.94 3mi6 s ALA 236 Cb -0.15 -1.30 0.14 0.00 0.00 0.00 0.00 23.12 21.81 3mi6 s ALA 236 CO -0.08 0.63 1.14 1.03 0.00 0.00 0.00 175.76 178.48 3mi6 s ARG 237 N -1.39 1.11 0.49 0.00 1.81 -0.98 0.13 118.95 120.12 3mi6 s ARG 237 Ca 0.18 1.49 0.14 0.00 -1.72 0.00 0.00 55.73 55.82 3mi6 s ARG 237 Cb -0.11 -1.74 1.16 0.00 -0.45 0.00 0.00 34.95 33.80 3mi6 s ARG 237 CO 0.08 -2.55 2.11 -1.35 -0.68 0.00 0.00 175.30 172.91 3mi6 h PRO 238 N -1.81 0.10 -0.38 3.54 0.11 -1.91 -2.55 132.00 129.10 3mi6 h PRO 238 Ca -0.43 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3mi6 h PRO 238 Cb 1.27 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3mi6 h PRO 238 CO 0.43 0.09 0.00 1.04 -0.21 0.00 0.00 178.00 179.35 3mi6 n GLN 239 N -4.50 2.40 -2.59 1.05 3.00 -1.26 -4.97 117.38 110.51 3mi6 n GLN 239 Ca -0.02 -2.21 -0.38 0.00 -0.01 0.00 0.00 57.00 54.39 3mi6 n GLN 239 Cb 0.10 -1.47 -0.05 0.00 0.00 0.00 0.00 30.24 28.83 3mi6 n GLN 239 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 3mi6 s THR 240 N -1.35 3.80 0.00 5.09 2.01 -0.96 -4.92 115.64 119.31 3mi6 s THR 240 Ca 0.36 1.52 0.00 0.00 0.31 0.00 0.00 61.69 63.87 3mi6 s THR 240 Cb 0.21 -3.85 0.00 0.00 0.01 0.00 0.00 72.50 68.86 3mi6 s THR 240 CO 0.29 0.15 0.00 0.35 -0.69 0.00 0.00 174.62 174.71 3mi6 n THR 241 N 0.45 0.00 0.28 -0.82 -2.24 -0.33 -4.93 114.28 106.69 3mi6 n THR 241 Ca 0.03 0.00 0.17 0.00 -2.27 0.00 0.00 64.05 61.98 3mi6 n THR 241 Cb 0.48 0.00 0.74 0.00 -2.10 0.00 0.00 70.33 69.45 3mi6 n THR 241 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3mi6 h ASP 242 N 0.00 0.00 0.20 3.42 3.32 -1.94 -3.26 116.42 118.15 3mi6 h ASP 242 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3mi6 h ASP 242 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3mi6 h ASP 242 CO 0.00 0.03 -1.77 -0.62 -1.72 0.00 0.00 179.24 175.16 3mi6 n GLU 243 N -3.15 0.62 -3.55 3.56 1.02 -1.26 -1.82 120.64 116.07 3mi6 n GLU 243 Ca -0.00 -0.13 -0.15 0.00 -0.02 0.00 0.00 57.16 56.86 3mi6 n GLU 243 Cb 0.28 -1.58 -0.06 0.00 -0.02 0.00 0.00 31.44 30.07 3mi6 n GLU 243 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 3mi6 s GLN 244 N -3.47 0.85 0.00 3.49 -2.07 -1.23 -4.59 119.66 112.63 3mi6 s GLN 244 Ca -0.06 0.20 0.00 0.00 -1.82 0.00 0.00 55.36 53.68 3mi6 s GLN 244 Cb 0.13 0.40 0.00 0.00 -1.09 0.00 0.00 33.01 32.45 3mi6 s GLN 244 CO 0.88 -0.27 0.00 0.41 -1.32 0.00 0.00 175.29 175.00 3mi6 n GLY 245 N 0.82 3.06 3.75 2.60 0.00 -0.28 -1.19 105.19 113.94 3mi6 n GLY 245 Ca -0.15 -1.96 -0.41 0.00 0.00 0.00 0.00 46.02 43.51 3mi6 n GLY 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mi6 s ALA 246 N -2.97 3.42 -0.28 4.61 0.00 -1.24 -0.69 121.76 124.61 3mi6 s ALA 246 Ca 0.00 0.93 -0.20 0.00 0.00 0.00 0.00 51.96 52.69 3mi6 s ALA 246 Cb 0.00 -3.37 0.08 0.00 0.00 0.00 0.00 23.12 19.83 3mi6 s ALA 246 CO 0.00 -0.26 0.72 0.54 0.00 0.00 0.00 175.76 176.76 3mi6 s VAL 247 N -0.72 0.00 0.06 0.00 0.11 -0.52 -2.33 120.40 117.00 3mi6 s VAL 247 Ca 0.48 0.00 -0.12 0.00 -2.93 0.00 0.00 61.98 59.41 3mi6 s VAL 247 Cb -0.32 -1.00 -0.06 0.00 -1.53 0.00 0.00 36.38 33.47 3mi6 s VAL 247 CO 0.40 0.00 0.42 -0.36 -3.33 0.00 0.00 175.10 172.22 3mi6 s PHE 248 N 1.05 3.64 -0.00 1.54 0.40 0.58 -2.51 117.98 122.67 3mi6 s PHE 248 Ca -0.05 0.88 0.08 0.00 -0.60 0.00 0.00 56.93 57.24 3mi6 s PHE 248 Cb -0.05 -2.22 -0.02 0.00 0.51 0.00 0.00 43.02 41.24 3mi6 s PHE 248 CO -0.10 0.55 -0.24 0.20 0.70 0.00 0.00 175.22 176.33 3mi6 s GLY 249 N -1.52 1.19 -0.03 4.36 0.00 0.02 -1.27 107.32 110.07 3mi6 s GLY 249 Ca 0.30 -1.06 0.02 0.00 0.00 0.00 0.00 44.72 43.98 3mi6 s GLY 249 CO 0.16 -0.91 -0.08 -1.36 0.00 0.00 0.00 173.10 170.92 3mi6 s PHE 250 N -0.62 0.94 0.32 1.90 0.40 -1.26 -1.70 117.98 117.96 3mi6 s PHE 250 Ca 0.09 -0.26 0.06 0.00 -0.60 0.00 0.00 56.93 56.23 3mi6 s PHE 250 Cb -0.09 -0.71 -0.02 0.00 0.51 0.00 0.00 43.02 42.71 3mi6 s PHE 250 CO -0.00 -0.14 0.23 -1.71 0.70 0.00 0.00 175.22 174.30 3mi6 n ASN 251 N 3.54 -0.23 -3.61 1.36 2.85 0.13 -4.33 115.26 114.98 3mi6 n ASN 251 Ca -0.21 -3.03 -0.18 0.00 -0.11 0.00 0.00 54.58 51.06 3mi6 n ASN 251 Cb 0.53 1.42 -0.15 0.00 1.24 0.00 0.00 39.78 42.82 3mi6 n ASN 251 CO 0.00 0.00 0.00 -0.22 -2.11 0.00 0.00 177.26 174.93 3mi6 s LEU 252 N 0.00 -0.08 -1.32 1.20 0.20 -1.26 -0.48 118.68 116.93 3mi6 s LEU 252 Ca 0.33 0.13 -0.17 0.00 0.69 0.00 0.00 54.13 55.11 3mi6 s LEU 252 Cb 0.02 0.32 0.04 0.00 -0.43 0.00 0.00 46.19 46.13 3mi6 s LEU 252 CO 0.23 -0.28 1.94 0.52 -0.29 0.00 0.00 176.35 178.48 3mi6 n VAL 253 N 5.32 3.51 -3.56 1.68 0.31 -0.61 -4.25 118.33 120.72 3mi6 n VAL 253 Ca -0.05 -3.42 -0.14 0.00 -0.01 0.00 0.00 64.34 60.71 3mi6 n VAL 253 Cb 0.50 -2.43 -0.06 0.00 -0.91 0.00 0.00 33.84 30.94 3mi6 n VAL 253 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 3mi6 s TYR 254 N 4.40 -0.55 0.00 3.52 5.04 -1.26 -4.35 117.35 124.16 3mi6 s TYR 254 Ca 0.53 1.03 0.00 0.00 -2.44 0.00 0.00 57.07 56.18 3mi6 s TYR 254 Cb 0.08 0.41 0.00 0.00 0.35 0.00 0.00 41.96 42.79 3mi6 s TYR 254 CO 0.03 -0.45 0.64 0.43 -1.34 0.00 0.00 175.55 174.86 3mi6 n SER 255 N 1.15 1.27 -0.20 4.32 7.64 -1.26 -4.21 113.62 122.33 3mi6 n SER 255 Ca -0.15 -1.32 0.00 0.00 1.01 0.00 0.00 58.87 58.41 3mi6 n SER 255 Cb 0.57 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.77 3mi6 n SER 255 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3mi6 n GLY 256 N -0.16 1.71 3.70 0.23 0.00 -1.26 -1.30 105.19 108.10 3mi6 n GLY 256 Ca 0.00 -1.72 -0.42 0.00 0.00 0.00 0.00 46.02 43.88 3mi6 n GLY 256 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3mi6 s ASN 257 N -1.00 7.19 0.27 1.61 0.01 -1.26 -2.51 114.94 119.26 3mi6 s ASN 257 Ca 0.00 1.71 0.07 0.00 -0.71 0.00 0.00 52.86 53.94 3mi6 s ASN 257 Cb 0.00 -2.56 -0.06 0.00 0.41 0.00 0.00 41.25 39.04 3mi6 s ASN 257 CO 0.00 -0.45 -0.08 0.72 -1.51 0.00 0.00 177.10 175.78 3mi6 s PHE 258 N 1.69 1.96 -0.07 2.20 -0.71 -1.25 -1.35 117.98 120.46 3mi6 s PHE 258 Ca 0.53 -0.64 0.02 0.00 -1.04 0.00 0.00 56.93 55.80 3mi6 s PHE 258 Cb -0.22 -1.07 0.01 0.00 -1.21 0.00 0.00 43.02 40.53 3mi6 s PHE 258 CO 0.23 0.34 -0.13 -1.17 -1.34 0.00 0.00 175.22 173.16 3mi6 s LEU 259 N -3.44 1.64 -0.33 -1.99 2.96 0.11 -1.58 118.68 116.05 3mi6 s LEU 259 Ca 0.29 -0.32 -0.06 0.00 -0.22 0.00 0.00 54.13 53.82 3mi6 s LEU 259 Cb 0.02 -0.86 0.04 0.00 0.50 0.00 0.00 46.19 45.89 3mi6 s LEU 259 CO 0.12 0.03 0.09 -1.81 -1.32 0.00 0.00 176.35 173.45 3mi6 s ASP 260 N 0.72 5.24 0.05 3.68 1.01 -0.68 -2.35 116.67 124.33 3mi6 s ASP 260 Ca -0.13 -1.10 0.07 0.00 0.71 0.00 0.00 52.55 52.09 3mi6 s ASP 260 Cb -0.16 -1.85 -0.02 0.00 1.01 0.00 0.00 42.92 41.90 3mi6 s ASP 260 CO 0.03 -0.30 -0.19 0.00 0.21 0.00 0.00 175.17 174.92 3mi6 s ALA 261 N 1.40 1.59 -0.15 5.23 0.00 0.63 -1.41 121.76 129.04 3mi6 s ALA 261 Ca -0.02 -1.01 -0.04 0.00 0.00 0.00 0.00 51.96 50.89 3mi6 s ALA 261 Cb -0.19 -0.29 0.06 0.00 0.00 0.00 0.00 23.12 22.70 3mi6 s ALA 261 CO 0.02 0.34 0.11 0.42 0.00 0.00 0.00 175.76 176.65 3mi6 s ILE 262 N -0.85 -0.13 -0.23 0.00 1.01 -0.60 -1.24 121.20 119.16 3mi6 s ILE 262 Ca 0.06 -0.06 -0.09 0.00 0.00 0.00 0.00 60.65 60.56 3mi6 s ILE 262 Cb -0.09 -0.52 -0.04 0.00 0.01 0.00 0.00 42.46 41.82 3mi6 s ILE 262 CO 0.02 -0.19 0.12 -0.70 0.00 0.00 0.00 174.94 174.19 3mi6 s GLU 263 N 2.17 3.96 -0.28 2.79 2.12 -0.45 -1.65 118.70 127.36 3mi6 s GLU 263 Ca 0.03 -0.33 -0.11 0.00 0.36 0.00 0.00 54.97 54.92 3mi6 s GLU 263 Cb -0.15 -3.43 -0.04 0.00 0.26 0.00 0.00 34.13 30.76 3mi6 s GLU 263 CO -0.08 0.04 0.18 0.08 -0.54 0.00 0.00 175.26 174.94 3mi6 s VAL 264 N 1.06 5.17 0.00 3.70 1.01 -0.63 -0.16 120.40 130.56 3mi6 s VAL 264 Ca 0.06 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.12 3mi6 s VAL 264 Cb -0.14 -3.48 0.00 0.00 0.00 0.00 0.00 36.38 32.76 3mi6 s VAL 264 CO 0.04 0.23 0.00 -0.90 0.00 0.00 0.00 175.10 174.47 3mi6 n ASP 265 N 5.05 0.00 0.10 3.32 5.68 -0.72 -0.23 116.55 129.74 3mi6 n ASP 265 Ca -0.14 -0.63 0.08 0.00 -0.50 0.00 0.00 54.79 53.60 3mi6 n ASP 265 Cb 0.52 0.00 0.38 0.00 -1.14 0.00 0.00 41.12 40.88 3mi6 n ASP 265 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3mi6 n GLN 266 N -0.63 0.10 -0.38 0.11 10.64 -1.26 -1.33 117.38 124.63 3mi6 n GLN 266 Ca 0.00 0.53 0.07 0.00 -1.83 0.00 0.00 57.00 55.77 3mi6 n GLN 266 Cb 0.00 -1.78 0.19 0.00 -0.86 0.00 0.00 30.24 27.79 3mi6 n GLN 266 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 3mi6 n TYR 267 N -1.97 0.28 -4.03 2.61 4.01 -1.26 -4.95 117.16 111.85 3mi6 n TYR 267 Ca -0.00 -1.21 -0.30 0.00 -0.16 0.00 0.00 57.90 56.23 3mi6 n TYR 267 Cb 0.07 -0.25 -0.01 0.00 -0.31 0.00 0.00 39.34 38.84 3mi6 n TYR 267 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3mi6 n SER 268 N -1.17 -2.48 -4.78 7.72 2.88 -0.44 -4.95 113.62 110.39 3mi6 n SER 268 Ca 0.20 -0.94 -0.26 0.00 -1.33 0.00 0.00 58.87 56.54 3mi6 n SER 268 Cb 0.74 -3.21 -0.06 0.00 -0.75 0.00 0.00 64.21 60.94 3mi6 n SER 268 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3mi6 s THR 269 N -3.55 4.35 -0.11 2.46 -4.23 -1.26 -2.55 115.64 110.76 3mi6 s THR 269 Ca 0.42 -1.20 -0.04 0.00 -1.18 0.00 0.00 61.69 59.70 3mi6 s THR 269 Cb -0.22 -3.24 -0.04 0.00 1.34 0.00 0.00 72.50 70.34 3mi6 s THR 269 CO 0.88 -0.15 0.05 -0.44 -0.54 0.00 0.00 174.62 174.42 3mi6 s SER 270 N -3.21 5.62 -0.17 3.99 0.01 -0.86 -1.76 113.70 117.33 3mi6 s SER 270 Ca 0.31 0.24 0.01 0.00 1.31 0.00 0.00 55.95 57.82 3mi6 s SER 270 Cb -0.10 -1.70 0.02 0.00 0.21 0.00 0.00 66.02 64.45 3mi6 s SER 270 CO 0.23 0.37 -0.20 -0.60 0.41 0.00 0.00 173.24 173.45 3mi6 s ARG 271 N -0.81 2.97 -0.30 12.44 3.52 0.78 -0.75 118.95 136.80 3mi6 s ARG 271 Ca 0.13 -0.83 -0.06 0.00 -0.13 0.00 0.00 55.73 54.84 3mi6 s ARG 271 Cb -0.12 -2.52 0.02 0.00 -1.56 0.00 0.00 34.95 30.77 3mi6 s ARG 271 CO 0.03 -0.17 0.06 0.42 -0.81 0.00 0.00 175.30 174.83 3mi6 s ILE 272 N 1.19 3.72 -0.09 4.11 1.09 0.77 -1.34 121.20 130.65 3mi6 s ILE 272 Ca 0.02 -0.88 0.02 0.00 -1.10 0.00 0.00 60.65 58.71 3mi6 s ILE 272 Cb -0.14 -2.97 -0.02 0.00 -1.06 0.00 0.00 42.46 38.27 3mi6 s ILE 272 CO -0.10 0.03 -0.13 -0.76 -0.10 0.00 0.00 174.94 173.87 3mi6 s LEU 273 N 1.44 2.74 0.03 2.97 1.43 -0.38 -0.99 118.68 125.92 3mi6 s LEU 273 Ca 0.01 -0.25 -0.00 0.00 -1.03 0.00 0.00 54.13 52.86 3mi6 s LEU 273 Cb -0.18 -1.59 -0.02 0.00 0.03 0.00 0.00 46.19 44.43 3mi6 s LEU 273 CO 0.01 0.26 -0.03 0.42 0.23 0.00 0.00 176.35 177.24 3mi6 s THR 274 N -0.22 0.14 -5.00 5.49 -4.23 -1.02 -0.27 115.64 110.53 3mi6 s THR 274 Ca 0.01 -1.08 0.00 0.00 -1.18 0.00 0.00 61.69 59.44 3mi6 s THR 274 Cb -0.13 -0.50 0.00 0.00 1.34 0.00 0.00 72.50 73.21 3mi6 s THR 274 CO 0.03 -0.59 0.00 0.61 -0.54 0.00 0.00 174.62 174.13 3mi6 n GLY 275 N 1.32 -0.90 3.72 3.99 0.00 -0.99 -0.81 105.19 111.52 3mi6 n GLY 275 Ca -0.22 -1.41 -0.42 0.00 0.00 0.00 0.00 46.02 43.96 3mi6 n GLY 275 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3mi6 n ILE 276 N 7.89 1.41 -1.63 -0.61 5.41 -1.26 -0.72 119.36 129.85 3mi6 n ILE 276 Ca 0.00 -0.35 -0.44 0.00 1.00 0.00 0.00 62.75 62.96 3mi6 n ILE 276 Cb 0.00 -1.76 -0.04 0.00 -0.71 0.00 0.00 39.64 37.13 3mi6 n ILE 276 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 3mi6 n ASN 277 N 1.53 3.58 -0.10 4.38 4.05 -0.46 -4.47 115.26 123.77 3mi6 n ASN 277 Ca 0.07 0.62 0.24 0.00 0.45 0.00 0.00 54.58 55.96 3mi6 n ASN 277 Cb 0.36 -1.49 0.68 0.00 1.23 0.00 0.00 39.78 40.56 3mi6 n ASN 277 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 177.26 173.56 3mi6 h PRO 278 N 12.14 0.05 -6.79 1.20 0.11 -1.89 -3.39 132.00 133.43 3mi6 h PRO 278 Ca -0.45 -0.00 -0.51 0.00 0.11 0.00 0.00 66.00 65.15 3mi6 h PRO 278 Cb 1.25 -0.01 0.03 0.00 0.11 0.00 0.00 31.00 32.38 3mi6 h PRO 278 CO 0.95 0.03 0.54 -0.51 -0.21 0.00 0.00 178.00 178.81 3mi6 s ASP 279 N -5.91 7.09 -1.38 -2.05 1.01 -1.26 -3.18 116.67 110.98 3mi6 s ASP 279 Ca -0.05 2.37 -0.09 0.00 0.71 0.00 0.00 52.55 55.49 3mi6 s ASP 279 Cb 0.21 -2.63 0.03 0.00 1.01 0.00 0.00 42.92 41.54 3mi6 s ASP 279 CO 0.75 -0.31 1.10 -0.62 0.21 0.00 0.00 175.17 176.30 3mi6 n GLU 280 N 1.44 -7.09 -3.76 8.23 -0.58 -1.26 -4.99 120.64 112.63 3mi6 n GLU 280 Ca 0.01 0.76 -0.13 0.00 -0.42 0.00 0.00 57.16 57.38 3mi6 n GLU 280 Cb 0.44 -5.75 -0.14 0.00 -0.57 0.00 0.00 31.44 25.42 3mi6 n GLU 280 CO 0.00 0.00 0.00 0.12 -0.48 0.00 0.00 177.13 176.77 3mi6 s PHE 281 N -3.34 -0.19 -0.27 -0.32 5.36 -1.19 -4.78 117.98 113.25 3mi6 s PHE 281 Ca 0.52 0.51 -0.22 0.00 -0.96 0.00 0.00 56.93 56.77 3mi6 s PHE 281 Cb -0.24 -0.03 0.08 0.00 -0.34 0.00 0.00 43.02 42.49 3mi6 s PHE 281 CO 0.76 -0.15 0.74 0.20 -1.46 0.00 0.00 175.22 175.30 3mi6 s GLY 282 N 0.90 -0.53 -0.07 13.12 0.00 -0.84 -4.70 107.32 115.20 3mi6 s GLY 282 Ca -0.07 2.20 -0.00 0.00 0.00 0.00 0.00 44.72 46.85 3mi6 s GLY 282 CO -0.05 1.95 -0.03 0.86 0.00 0.00 0.00 173.10 175.84 3mi6 s TRP 283 N 0.73 0.83 -0.42 1.90 -0.11 -0.43 -3.41 118.94 118.03 3mi6 s TRP 283 Ca -0.03 -0.27 -0.26 0.00 1.22 0.00 0.00 56.10 56.76 3mi6 s TRP 283 Cb -0.05 -0.83 0.02 0.00 -1.50 0.00 0.00 33.47 31.11 3mi6 s TRP 283 CO -0.05 -0.31 0.96 -0.80 -4.62 0.00 0.00 176.95 172.13 3mi6 s ASN 284 N 1.57 6.61 -0.59 5.86 0.01 -1.26 0.09 114.94 127.22 3mi6 s ASN 284 Ca -0.01 0.39 -0.15 0.00 -0.71 0.00 0.00 52.86 52.38 3mi6 s ASN 284 Cb -0.13 -2.47 0.15 0.00 0.41 0.00 0.00 41.25 39.20 3mi6 s ASN 284 CO -0.04 -1.00 0.54 -0.22 -1.51 0.00 0.00 177.10 174.87 3mi6 s LEU 285 N 3.75 6.27 0.82 0.60 2.96 0.14 -4.99 118.68 128.22 3mi6 s LEU 285 Ca 0.39 -1.97 -0.12 0.00 -0.22 0.00 0.00 54.13 52.22 3mi6 s LEU 285 Cb -0.10 -2.20 0.08 0.00 0.50 0.00 0.00 46.19 44.47 3mi6 s LEU 285 CO 0.24 -0.80 1.11 0.00 -1.32 0.00 0.00 176.35 175.58 3mi6 s ALA 286 N 1.32 2.23 0.14 5.97 0.00 -1.26 -1.77 121.76 128.38 3mi6 s ALA 286 Ca 0.06 -0.33 -0.34 0.00 0.00 0.00 0.00 51.96 51.35 3mi6 s ALA 286 Cb -0.26 -3.07 -0.17 0.00 0.00 0.00 0.00 23.12 19.62 3mi6 s ALA 286 CO 0.01 -1.80 1.09 -2.30 0.00 0.00 0.00 175.76 172.76 3mi6 n PRO 287 N -3.46 0.83 -0.85 0.00 -0.02 -1.26 -1.34 135.00 128.90 3mi6 n PRO 287 Ca 0.07 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 3mi6 n PRO 287 Cb 0.57 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.30 3mi6 n PRO 287 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3mi6 n GLN 288 N 1.70 0.00 -2.68 -0.52 1.13 0.48 -4.98 117.38 112.52 3mi6 n GLN 288 Ca 0.17 0.00 -0.30 0.00 -1.94 0.00 0.00 57.00 54.92 3mi6 n GLN 288 Cb 0.21 -2.69 -0.03 0.00 0.11 0.00 0.00 30.24 27.84 3mi6 n GLN 288 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3mi6 s ALA 289 N -3.52 3.28 0.17 -1.58 0.00 -0.45 -4.86 121.76 114.80 3mi6 s ALA 289 Ca 0.00 -0.14 0.03 0.00 0.00 0.00 0.00 51.96 51.85 3mi6 s ALA 289 Cb 0.00 -2.81 -0.05 0.00 0.00 0.00 0.00 23.12 20.27 3mi6 s ALA 289 CO 0.00 -0.13 -0.04 0.95 0.00 0.00 0.00 175.76 176.54 3mi6 s THR 290 N -2.51 0.90 -0.10 0.00 -4.23 -1.26 -2.00 115.64 106.45 3mi6 s THR 290 Ca 0.53 -2.01 -0.04 0.00 -1.18 0.00 0.00 61.69 58.99 3mi6 s THR 290 Cb -0.10 -2.03 0.05 0.00 1.34 0.00 0.00 72.50 71.76 3mi6 s THR 290 CO 0.34 -0.58 0.20 0.12 -0.54 0.00 0.00 174.62 174.16 3mi6 s PHE 291 N -3.50 -0.26 -0.21 3.99 5.36 -0.45 -4.99 117.98 117.92 3mi6 s PHE 291 Ca 0.21 0.72 -0.08 0.00 -0.96 0.00 0.00 56.93 56.82 3mi6 s PHE 291 Cb 0.05 -0.14 -0.04 0.00 -0.34 0.00 0.00 43.02 42.55 3mi6 s PHE 291 CO 0.03 -0.28 0.08 -1.14 -1.46 0.00 0.00 175.22 172.45 3mi6 s GLN 292 N 2.05 3.89 0.45 10.12 2.00 -1.26 -0.63 119.66 136.28 3mi6 s GLN 292 Ca -0.01 -0.38 -0.12 0.00 -2.00 0.00 0.00 55.36 52.86 3mi6 s GLN 292 Cb -0.12 -3.30 -0.07 0.00 0.80 0.00 0.00 33.01 30.33 3mi6 s GLN 292 CO -0.07 0.10 0.85 0.95 -0.50 0.00 0.00 175.29 176.62 3mi6 s THR 293 N 0.87 4.71 1.00 -0.34 -4.23 -0.56 -5.04 115.64 112.05 3mi6 s THR 293 Ca 0.04 0.80 -0.13 0.00 -1.18 0.00 0.00 61.69 61.22 3mi6 s THR 293 Cb -0.14 -3.74 0.12 0.00 1.34 0.00 0.00 72.50 70.08 3mi6 s THR 293 CO 0.03 -0.62 0.65 -2.65 -0.54 0.00 0.00 174.62 171.49 3mi6 n PRO 294 N -1.49 -0.86 -3.23 3.99 -0.02 -1.26 -4.58 135.00 127.54 3mi6 n PRO 294 Ca 0.04 -0.21 -0.38 0.00 -2.02 0.00 0.00 63.50 60.93 3mi6 n PRO 294 Cb 0.54 -2.03 -0.06 0.00 -0.02 0.00 0.00 33.50 31.93 3mi6 n PRO 294 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3mi6 s GLU 295 N -4.02 4.36 0.13 -0.52 2.02 -1.26 -4.62 118.70 114.79 3mi6 s GLU 295 Ca 0.61 0.59 -0.14 0.00 0.02 0.00 0.00 54.97 56.06 3mi6 s GLU 295 Cb -0.21 -3.43 -0.07 0.00 0.10 0.00 0.00 34.13 30.52 3mi6 s GLU 295 CO 0.64 0.14 0.52 0.00 0.02 0.00 0.00 175.26 176.59 3mi6 s ALA 296 N 0.62 3.61 -0.21 5.21 0.00 0.14 -1.58 121.76 129.56 3mi6 s ALA 296 Ca 0.30 -0.16 -0.06 0.00 0.00 0.00 0.00 51.96 52.03 3mi6 s ALA 296 Cb -0.16 -2.48 -0.03 0.00 0.00 0.00 0.00 23.12 20.45 3mi6 s ALA 296 CO 0.13 0.47 0.04 0.42 0.00 0.00 0.00 175.76 176.82 3mi6 s ILE 297 N -1.42 4.27 0.09 0.00 -1.09 0.36 -1.10 121.20 122.31 3mi6 s ILE 297 Ca 0.36 -0.20 0.07 0.00 -2.23 0.00 0.00 60.65 58.65 3mi6 s ILE 297 Cb -0.15 -2.95 -0.04 0.00 -1.58 0.00 0.00 42.46 37.74 3mi6 s ILE 297 CO 0.19 0.41 -0.14 -0.76 -1.23 0.00 0.00 174.94 173.40 3mi6 s LEU 298 N 1.02 2.85 -0.05 2.97 1.02 0.13 -0.69 118.68 125.93 3mi6 s LEU 298 Ca 0.03 -0.43 -0.30 0.00 0.02 0.00 0.00 54.13 53.45 3mi6 s LEU 298 Cb -0.14 -1.67 0.07 0.00 0.02 0.00 0.00 46.19 44.46 3mi6 s LEU 298 CO 0.02 0.20 0.65 -0.55 0.02 0.00 0.00 176.35 176.70 3mi6 s SER 299 N -1.96 -0.62 0.09 2.29 0.15 -0.69 -1.56 113.70 111.40 3mi6 s SER 299 Ca 0.18 0.67 0.03 0.00 0.70 0.00 0.00 55.95 57.53 3mi6 s SER 299 Cb -0.11 0.52 -0.04 0.00 -1.71 0.00 0.00 66.02 64.69 3mi6 s SER 299 CO 0.10 -0.60 -0.08 -0.47 1.20 0.00 0.00 173.24 173.39 3mi6 s TYR 300 N -1.21 0.95 -0.06 3.44 6.14 -1.25 -0.79 117.35 124.56 3mi6 s TYR 300 Ca -0.11 -0.76 -0.30 0.00 0.64 0.00 0.00 57.07 56.55 3mi6 s TYR 300 Cb -0.00 -0.53 0.07 0.00 0.42 0.00 0.00 41.96 41.91 3mi6 s TYR 300 CO 0.09 -0.07 0.66 -0.08 0.64 0.00 0.00 175.55 176.80 3mi6 s THR 301 N -2.89 0.00 -1.18 4.34 -1.32 -1.04 -4.95 115.64 108.59 3mi6 s THR 301 Ca 0.07 -0.02 0.23 0.00 -1.21 0.00 0.00 61.69 60.76 3mi6 s THR 301 Cb 0.00 -0.98 -0.07 0.00 -1.51 0.00 0.00 72.50 69.94 3mi6 s THR 301 CO -0.02 -0.01 1.17 -1.20 -2.21 0.00 0.00 174.62 172.35 3mi6 n SER 302 N 1.04 0.93 -1.18 8.08 7.64 -1.26 -1.44 113.62 127.42 3mi6 n SER 302 Ca -0.19 -0.77 0.07 0.00 1.01 0.00 0.00 58.87 59.00 3mi6 n SER 302 Cb 0.57 0.59 0.26 0.00 -1.01 0.00 0.00 64.21 64.61 3mi6 n SER 302 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3mi6 n ALA 303 N -1.26 2.81 0.00 -0.43 0.00 -1.21 -1.13 120.51 119.29 3mi6 n ALA 303 Ca 0.06 -1.11 0.00 0.00 0.00 0.00 0.00 53.44 52.39 3mi6 n ALA 303 Cb 0.35 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.79 3mi6 n ALA 303 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mi6 n GLY 304 N 1.03 1.02 1.85 0.00 0.00 0.13 -3.90 105.19 105.32 3mi6 n GLY 304 Ca 0.19 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 45.12 3mi6 n GLY 304 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3mi6 n ASN 306 N 2.18 0.00 -0.21 1.61 3.02 -0.76 -1.70 115.26 119.41 3mi6 n ASN 306 Ca 0.00 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.53 3mi6 n ASN 306 Cb 0.00 0.00 0.08 0.00 -0.61 0.00 0.00 39.78 39.25 3mi6 n ASN 306 CO 0.00 0.00 0.00 -0.61 -2.62 0.00 0.00 177.26 174.03 3mi6 h GLN 307 N 0.00 0.61 -0.01 3.52 5.75 -1.78 -1.00 115.11 122.20 3mi6 h GLN 307 Ca 0.00 -0.04 0.03 0.00 -0.15 0.00 0.00 58.65 58.49 3mi6 h GLN 307 Cb 0.00 -0.14 -0.03 0.00 1.07 0.00 0.00 27.48 28.38 3mi6 h GLN 307 CO 0.00 0.40 -0.16 1.25 -2.65 0.00 0.00 178.83 177.68 3mi6 h LEU 308 N 0.63 -0.45 -0.56 -2.39 5.85 -1.66 -2.10 115.31 114.63 3mi6 h LEU 308 Ca 0.28 0.07 0.02 0.00 0.84 0.00 0.00 57.88 59.09 3mi6 h LEU 308 Cb 0.17 0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 3mi6 h LEU 308 CO -0.18 -0.21 0.35 0.28 -0.34 0.00 0.00 178.44 178.34 3mi6 h SER 309 N -0.25 0.57 -0.28 1.25 0.02 -1.67 -2.83 113.55 110.36 3mi6 h SER 309 Ca 0.05 -0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.94 3mi6 h SER 309 Cb 0.32 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.72 3mi6 h SER 309 CO -0.16 0.41 -0.01 1.56 -1.14 0.00 0.00 176.83 177.48 3mi6 h GLN 310 N 0.69 0.63 -1.29 3.45 4.20 -0.92 0.36 115.11 122.22 3mi6 h GLN 310 Ca 0.22 -0.15 -0.04 0.00 0.06 0.00 0.00 58.65 58.74 3mi6 h GLN 310 Cb -0.01 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 3mi6 h GLN 310 CO -0.08 0.66 0.05 0.00 -0.67 0.00 0.00 178.83 178.79 3mi6 n GLN 311 N -4.24 1.10 0.00 1.46 10.64 -0.81 -1.18 117.38 124.34 3mi6 n GLN 311 Ca 0.02 -0.22 0.00 0.00 -1.83 0.00 0.00 57.00 54.97 3mi6 n GLN 311 Cb 0.28 -1.09 0.00 0.00 -0.86 0.00 0.00 30.24 28.57 3mi6 n GLN 311 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3mi6 n ALA 313 N 0.68 0.00 -0.11 2.61 0.00 0.13 -1.15 120.51 122.67 3mi6 n ALA 313 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.43 3mi6 n ALA 313 Cb 0.56 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.02 3mi6 n ALA 313 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3mi6 h SER 314 N 0.00 -0.33 -0.39 0.00 0.02 -1.40 -0.01 113.55 111.43 3mi6 h SER 314 Ca 0.00 0.11 0.08 0.00 -0.84 0.00 0.00 61.79 61.14 3mi6 h SER 314 Cb 0.00 0.23 -0.08 0.00 0.14 0.00 0.00 62.40 62.69 3mi6 h SER 314 CO 0.00 -0.12 -0.12 0.15 -1.14 0.00 0.00 176.83 175.61 3mi6 h PHE 315 N 0.01 -0.26 -0.79 3.45 3.57 -1.39 -1.58 116.94 119.95 3mi6 h PHE 315 Ca 0.18 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.67 3mi6 h PHE 315 Cb 0.27 0.18 -0.03 0.00 2.79 0.00 0.00 35.95 39.15 3mi6 h PHE 315 CO -0.33 -0.19 0.31 1.88 -2.23 0.00 0.00 178.31 177.75 3mi6 h TYR 316 N -0.03 1.20 -0.53 0.41 0.05 -1.66 0.20 116.97 116.61 3mi6 h TYR 316 Ca 0.19 -0.09 0.00 0.00 0.05 0.00 0.00 58.73 58.88 3mi6 h TYR 316 Cb 0.32 -0.36 -0.03 0.00 1.01 0.00 0.00 36.73 37.67 3mi6 h TYR 316 CO -0.37 0.91 0.34 0.37 -1.05 0.00 0.00 178.16 178.37 3mi6 h GLN 317 N 1.15 0.71 0.00 4.88 4.15 -0.27 -1.14 115.11 124.58 3mi6 h GLN 317 Ca 0.26 -0.05 -0.19 0.00 0.77 0.00 0.00 58.65 59.45 3mi6 h GLN 317 Cb 0.22 -0.16 -0.04 0.00 0.21 0.00 0.00 27.48 27.72 3mi6 h GLN 317 CO -0.02 0.48 -2.19 1.04 -1.93 0.00 0.00 178.83 176.21 3mi6 n GLN 318 N -4.45 0.69 -0.01 1.69 6.02 -0.67 -4.69 117.38 115.97 3mi6 n GLN 318 Ca 0.05 -0.10 0.01 0.00 -0.01 0.00 0.00 57.00 56.95 3mi6 n GLN 318 Cb 0.06 -1.52 0.01 0.00 1.02 0.00 0.00 30.24 29.81 3mi6 n GLN 318 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 3mi6 n HIS 319 N -2.50 0.03 0.10 1.08 8.25 0.68 -4.71 115.22 118.14 3mi6 n HIS 319 Ca -0.19 -0.16 0.00 0.00 -0.26 0.00 0.00 57.72 57.12 3mi6 n HIS 319 Cb 0.86 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.96 3mi6 n HIS 319 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 3mi6 n LEU 320 N -0.02 -0.90 -4.61 2.41 7.94 -0.91 -0.53 117.00 120.37 3mi6 n LEU 320 Ca 0.01 0.36 -0.50 0.00 -1.11 0.00 0.00 56.01 54.78 3mi6 n LEU 320 Cb 0.12 1.00 -0.05 0.00 0.53 0.00 0.00 43.42 45.02 3mi6 n LEU 320 CO 0.01 -0.45 0.97 0.52 -1.11 0.00 0.00 177.39 177.33 3mi6 n VAL 321 N -3.04 0.11 -0.96 1.96 0.31 -0.48 -4.38 118.33 111.86 3mi6 n VAL 321 Ca 0.00 -0.03 -0.40 0.00 -0.01 0.00 0.00 64.34 63.90 3mi6 n VAL 321 Cb 0.00 -1.05 -0.07 0.00 -0.91 0.00 0.00 33.84 31.81 3mi6 n VAL 321 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 3mi6 n ASN 322 N 2.71 0.63 0.29 4.52 2.85 -0.83 -4.65 115.26 120.78 3mi6 n ASN 322 Ca 0.17 0.60 0.14 0.00 -0.11 0.00 0.00 54.58 55.39 3mi6 n ASN 322 Cb 0.23 -0.56 0.88 0.00 1.24 0.00 0.00 39.78 41.57 3mi6 n ASN 322 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3mi6 h PRO 323 N 4.28 0.00 0.00 1.20 0.11 -1.88 0.55 132.00 136.27 3mi6 h PRO 323 Ca -0.18 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.86 3mi6 h PRO 323 Cb 0.87 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.97 3mi6 h PRO 323 CO 0.65 0.01 -0.33 -0.09 -0.21 0.00 0.00 178.00 178.03 3mi6 h ARG 324 N 0.00 0.00 0.00 1.05 9.65 -1.92 -3.30 114.38 119.85 3mi6 h ARG 324 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3mi6 h ARG 324 Cb 0.03 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.61 3mi6 h ARG 324 CO 0.00 0.33 -0.44 1.19 2.80 0.00 0.00 179.97 183.86 3mi6 n PHE 325 N -3.42 0.00 -0.10 2.20 3.01 -0.93 -4.70 117.46 113.51 3mi6 n PHE 325 Ca 0.00 0.00 0.22 0.00 1.01 0.00 0.00 57.45 58.69 3mi6 n PHE 325 Cb 0.52 0.00 0.66 0.00 -0.01 0.00 0.00 39.48 40.65 3mi6 n PHE 325 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3mi6 h ALA 326 N 0.00 2.55 -0.11 4.37 0.00 -0.99 0.74 119.26 125.83 3mi6 h ALA 326 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3mi6 h ALA 326 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3mi6 h ALA 326 CO 0.00 -0.76 0.00 0.72 0.00 0.00 0.00 179.25 179.21 3mi6 n HIS 327 N -4.36 0.14 -3.40 0.00 8.25 -1.26 -5.00 115.22 109.58 3mi6 n HIS 327 Ca 0.14 -0.43 -0.37 0.00 -0.26 0.00 0.00 57.72 56.80 3mi6 n HIS 327 Cb 0.73 -0.04 -0.06 0.00 1.12 0.00 0.00 29.99 31.74 3mi6 n HIS 327 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 3mi6 s GLU 328 N -0.91 4.30 0.27 -0.41 2.12 0.25 -5.02 118.70 119.30 3mi6 s GLU 328 Ca 0.08 0.31 -0.30 0.00 0.36 0.00 0.00 54.97 55.41 3mi6 s GLU 328 Cb 0.04 -3.43 -0.13 0.00 0.26 0.00 0.00 34.13 30.87 3mi6 s GLU 328 CO 0.05 0.19 1.30 0.39 -0.54 0.00 0.00 175.26 176.66 3mi6 n GLU 329 N 3.62 1.91 -3.51 4.30 1.02 -1.26 -4.95 120.64 121.78 3mi6 n GLU 329 Ca -0.09 0.68 -0.35 0.00 -0.02 0.00 0.00 57.16 57.38 3mi6 n GLU 329 Cb 0.52 -2.26 -0.05 0.00 -0.02 0.00 0.00 31.44 29.62 3mi6 n GLU 329 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3mi6 s ARG 330 N -1.00 3.82 0.58 3.49 3.00 -1.26 -5.07 118.95 122.51 3mi6 s ARG 330 Ca 0.63 0.26 -0.15 0.00 0.00 0.00 0.00 55.73 56.47 3mi6 s ARG 330 Cb -0.65 -2.96 -0.05 0.00 0.00 0.00 0.00 34.95 31.29 3mi6 s ARG 330 CO 0.55 0.53 1.03 -1.25 0.00 0.00 0.00 175.30 176.15 3mi6 s PRO 331 N -1.97 3.55 -0.63 3.54 0.04 -1.26 -4.96 135.00 133.32 3mi6 s PRO 331 Ca 0.35 1.04 -0.25 0.00 0.04 0.00 0.00 61.00 62.18 3mi6 s PRO 331 Cb -0.14 -2.07 0.04 0.00 0.04 0.00 0.00 34.50 32.37 3mi6 s PRO 331 CO 0.19 -0.61 1.09 0.08 0.04 0.00 0.00 177.00 177.79 3mi6 s VAL 332 N -2.65 4.12 0.33 -0.36 1.01 -1.26 -4.81 120.40 116.78 3mi6 s VAL 332 Ca 0.60 0.29 0.01 0.00 0.00 0.00 0.00 61.98 62.89 3mi6 s VAL 332 Cb -0.13 -4.71 -0.03 0.00 0.00 0.00 0.00 36.38 31.51 3mi6 s VAL 332 CO 0.38 -1.44 0.52 -1.48 0.00 0.00 0.00 175.10 173.08 3mi6 s LEU 333 N 4.66 4.06 0.09 3.92 0.05 -1.25 -0.71 118.68 129.49 3mi6 s LEU 333 Ca 0.32 0.37 0.09 0.00 0.05 0.00 0.00 54.13 54.97 3mi6 s LEU 333 Cb -0.11 -3.23 -0.04 0.00 -2.05 0.00 0.00 46.19 40.77 3mi6 s LEU 333 CO 0.17 -0.27 -0.23 -0.51 -0.55 0.00 0.00 176.35 174.96 3mi6 s ILE 334 N -2.27 2.46 0.05 1.48 2.07 -1.26 -0.65 121.20 123.09 3mi6 s ILE 334 Ca 0.39 -1.50 0.06 0.00 -1.41 0.00 0.00 60.65 58.19 3mi6 s ILE 334 Cb -0.09 -2.06 -0.03 0.00 0.13 0.00 0.00 42.46 40.41 3mi6 s ILE 334 CO 0.35 0.21 -0.17 0.21 -1.91 0.00 0.00 174.94 173.63 3mi6 s ASN 335 N -1.76 1.97 0.00 4.50 3.84 0.24 0.20 114.94 123.94 3mi6 s ASN 335 Ca 0.14 -0.52 0.22 0.00 0.21 0.00 0.00 52.86 52.91 3mi6 s ASN 335 Cb -0.10 -0.13 0.35 0.00 -0.55 0.00 0.00 41.25 40.82 3mi6 s ASN 335 CO 0.06 0.05 1.33 -0.46 -2.79 0.00 0.00 177.10 175.29 3mi6 n ASN 336 N 1.69 3.27 0.12 -4.21 6.94 -1.22 -4.22 115.26 117.64 3mi6 n ASN 336 Ca -0.18 -1.96 -0.05 0.00 -0.02 0.00 0.00 54.58 52.36 3mi6 n ASN 336 Cb 0.54 -0.18 -0.03 0.00 -2.36 0.00 0.00 39.78 37.75 3mi6 n ASN 336 CO 0.00 0.00 0.00 -0.25 -1.03 0.00 0.00 177.26 175.98 3mi6 h TRP 337 N 4.31 -0.38 0.00 -2.53 -0.00 -1.90 -1.29 115.95 114.16 3mi6 h TRP 337 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.89 3mi6 h TRP 337 Cb 0.95 0.14 0.00 0.00 -0.00 0.00 0.00 29.16 30.25 3mi6 h TRP 337 CO 0.18 -0.20 0.00 0.93 -0.00 0.00 0.00 178.44 179.35 3mi6 h GLU 338 N -0.33 0.00 -0.11 2.65 5.08 -1.86 0.91 114.58 120.91 3mi6 h GLU 338 Ca -0.03 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 3mi6 h GLU 338 Cb 0.27 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 3mi6 h GLU 338 CO 0.02 0.00 -0.13 0.00 -1.00 0.00 0.00 179.01 177.91 3mi6 h ALA 339 N 2.22 0.17 0.00 3.43 0.00 -1.66 -3.41 119.26 120.00 3mi6 h ALA 339 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3mi6 h ALA 339 Cb 0.50 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3mi6 h ALA 339 CO 0.00 0.03 -0.51 0.25 0.00 0.00 0.00 179.25 179.03 3mi6 n THR 340 N -4.60 0.00 -3.50 0.00 -2.24 -0.51 -4.55 114.28 98.88 3mi6 n THR 340 Ca -0.07 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 3mi6 n THR 340 Cb 0.35 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.31 3mi6 n THR 340 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 3mi6 n TYR 341 N -1.10 0.00 0.32 4.78 4.01 0.31 -3.16 117.16 122.32 3mi6 n TYR 341 Ca 0.00 0.00 0.16 0.00 -0.16 0.00 0.00 57.90 57.90 3mi6 n TYR 341 Cb 0.17 0.05 0.66 0.00 -0.31 0.00 0.00 39.34 39.92 3mi6 n TYR 341 CO 0.00 0.00 0.00 0.74 -0.46 0.00 0.00 176.86 177.14 3mi6 h PHE 342 N 0.00 0.00 -1.40 -0.72 0.04 -1.86 -3.41 116.94 109.60 3mi6 h PHE 342 Ca 0.00 0.00 -0.64 0.00 2.80 0.00 0.00 57.97 60.13 3mi6 h PHE 342 Cb 0.00 0.00 -0.12 0.00 2.20 0.00 0.00 35.95 38.03 3mi6 h PHE 342 CO 0.00 0.00 1.47 0.34 -0.60 0.00 0.00 178.31 179.52 3mi6 s ASP 343 N -5.11 6.62 0.30 2.17 2.15 -1.19 -4.91 116.67 116.71 3mi6 s ASP 343 Ca 0.01 -1.83 -0.19 0.00 0.43 0.00 0.00 52.55 50.98 3mi6 s ASP 343 Cb 0.09 -2.53 0.05 0.00 -0.30 0.00 0.00 42.92 40.24 3mi6 s ASP 343 CO 0.47 -1.32 0.84 0.72 -0.17 0.00 0.00 175.17 175.71 3mi6 s PHE 344 N 4.19 0.03 0.30 -5.34 -0.12 -1.26 -4.87 117.98 110.90 3mi6 s PHE 344 Ca 0.44 -0.57 -0.19 0.00 -0.05 0.00 0.00 56.93 56.56 3mi6 s PHE 344 Cb -0.00 0.77 0.06 0.00 -0.63 0.00 0.00 43.02 43.21 3mi6 s PHE 344 CO -0.06 -1.31 0.87 0.54 -0.05 0.00 0.00 175.22 175.21 3mi6 s ASN 345 N -3.09 -0.03 0.67 1.98 2.20 -1.26 -4.81 114.94 110.59 3mi6 s ASN 345 Ca 0.16 -0.91 0.39 0.00 -0.94 0.00 0.00 52.86 51.56 3mi6 s ASN 345 Cb -0.04 0.71 2.12 0.00 -2.00 0.00 0.00 41.25 42.04 3mi6 s ASN 345 CO 0.08 -1.40 2.20 -0.08 -2.94 0.00 0.00 177.10 174.97 3mi6 h GLU 346 N 2.00 0.00 0.29 3.55 4.81 -0.14 -1.63 114.58 123.46 3mi6 h GLU 346 Ca -0.29 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.92 3mi6 h GLU 346 Cb 1.24 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.62 3mi6 h GLU 346 CO 0.37 0.00 -0.14 0.00 -0.73 0.00 0.00 179.01 178.51 3mi6 h ALA 347 N 1.74 -0.54 0.00 2.92 0.00 -1.96 -3.28 119.26 118.14 3mi6 h ALA 347 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3mi6 h ALA 347 Cb 0.26 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3mi6 h ALA 347 CO -0.00 -0.51 0.00 1.17 0.00 0.00 0.00 179.25 179.91 3mi6 n LYS 348 N -4.06 0.10 -0.63 0.00 4.81 -1.01 -3.39 118.16 113.99 3mi6 n LYS 348 Ca -0.05 0.35 -0.09 0.00 -0.87 0.00 0.00 58.31 57.65 3mi6 n LYS 348 Cb 0.15 -1.70 0.03 0.00 0.02 0.00 0.00 35.03 33.53 3mi6 n LYS 348 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 3mi6 n LEU 349 N -1.89 5.50 0.00 3.14 4.77 -0.64 -3.60 117.00 124.27 3mi6 n LEU 349 Ca 0.03 -2.71 0.00 0.00 -0.03 0.00 0.00 56.01 53.30 3mi6 n LEU 349 Cb 0.20 -0.96 0.00 0.00 -2.33 0.00 0.00 43.42 40.32 3mi6 n LEU 349 CO 0.17 1.01 0.00 0.35 -1.33 0.00 0.00 177.39 177.59 3mi6 n THR 351 N 0.64 0.00 0.17 -5.08 -2.24 -1.22 -2.85 114.28 103.70 3mi6 n THR 351 Ca 0.17 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.97 3mi6 n THR 351 Cb 0.61 0.00 0.31 0.00 -2.10 0.00 0.00 70.33 69.15 3mi6 n THR 351 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 3mi6 h ILE 352 N 0.00 1.24 -0.11 2.28 2.04 -1.90 -2.50 117.51 118.57 3mi6 h ILE 352 Ca 0.00 -1.56 -0.08 0.00 1.00 0.00 0.00 64.86 64.22 3mi6 h ILE 352 Cb 0.00 1.86 0.00 0.00 -0.74 0.00 0.00 36.82 37.94 3mi6 h ILE 352 CO 0.00 0.44 -0.23 0.58 0.00 0.00 0.00 178.15 178.93 3mi6 h VAL 353 N 0.00 1.39 -0.23 1.67 2.07 -1.85 -1.47 116.25 117.83 3mi6 h VAL 353 Ca -0.00 -1.53 -0.07 0.00 0.82 0.00 0.00 66.70 65.92 3mi6 h VAL 353 Cb 0.83 2.12 -0.01 0.00 -1.52 0.00 0.00 31.29 32.70 3mi6 h VAL 353 CO 0.06 0.44 -0.14 0.78 0.02 0.00 0.00 177.57 178.73 3mi6 h ASN 354 N -0.09 0.37 0.16 0.57 -0.26 -1.86 -2.76 115.58 111.71 3mi6 h ASN 354 Ca 0.00 -0.09 -0.21 0.00 -0.56 0.00 0.00 56.30 55.43 3mi6 h ASN 354 Cb 0.83 -0.10 0.00 0.00 -1.06 0.00 0.00 38.32 38.00 3mi6 h ASN 354 CO 0.05 0.55 -0.83 -0.61 -1.06 0.00 0.00 177.43 175.52 3mi6 h GLN 355 N 0.36 0.53 -0.16 0.81 5.75 -1.47 -3.22 115.11 117.72 3mi6 h GLN 355 Ca 0.07 -0.48 0.05 0.00 -0.15 0.00 0.00 58.65 58.13 3mi6 h GLN 355 Cb 0.47 0.12 -0.05 0.00 1.07 0.00 0.00 27.48 29.08 3mi6 h GLN 355 CO 0.03 1.11 -0.19 0.00 -2.65 0.00 0.00 178.83 177.13 3mi6 h ALA 356 N 0.74 -0.12 -0.97 3.38 0.00 -1.00 -2.08 119.26 119.21 3mi6 h ALA 356 Ca -0.06 0.05 0.19 0.00 0.00 0.00 0.00 54.91 55.10 3mi6 h ALA 356 Cb 1.45 0.39 -0.09 0.00 0.00 0.00 0.00 17.79 19.54 3mi6 h ALA 356 CO 0.15 -0.64 0.61 -0.22 0.00 0.00 0.00 179.25 179.15 3mi6 h LYS 357 N -0.23 0.63 -0.06 0.00 1.63 -1.50 -1.44 116.57 115.59 3mi6 h LYS 357 Ca 0.11 -0.04 -0.10 0.00 -0.85 0.00 0.00 60.65 59.77 3mi6 h LYS 357 Cb 0.39 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 31.87 3mi6 h LYS 357 CO -0.29 0.42 -0.42 0.00 -3.45 0.00 0.00 179.45 175.71 3mi6 h ARG 358 N 0.65 0.13 0.00 1.90 3.08 -1.40 -2.63 114.38 116.11 3mi6 h ARG 358 Ca 0.53 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.52 3mi6 h ARG 358 Cb 0.98 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.03 3mi6 h ARG 358 CO -0.29 0.53 -0.18 1.28 -1.07 0.00 0.00 179.97 180.24 3mi6 n LEU 359 N -4.03 0.51 0.00 3.04 4.77 -0.56 -4.92 117.00 115.80 3mi6 n LEU 359 Ca -0.02 0.42 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 3mi6 n LEU 359 Cb 0.47 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 3mi6 n LEU 359 CO 0.41 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 3mi6 n GLY 360 N 1.40 0.25 3.39 -0.72 0.00 -0.99 -4.55 105.19 103.96 3mi6 n GLY 360 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 3mi6 n GLY 360 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3mi6 n ILE 361 N -2.00 1.10 -1.58 -0.61 5.41 -1.10 -4.97 119.36 115.60 3mi6 n ILE 361 Ca 0.00 -0.38 0.06 0.00 1.00 0.00 0.00 62.75 63.43 3mi6 n ILE 361 Cb 0.00 -0.57 0.10 0.00 -0.71 0.00 0.00 39.64 38.45 3mi6 n ILE 361 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 3mi6 n GLU 362 N -0.38 0.81 -3.78 0.38 1.02 0.11 -4.60 120.64 114.21 3mi6 n GLU 362 Ca 0.08 -2.16 -0.14 0.00 -0.02 0.00 0.00 57.16 54.92 3mi6 n GLU 362 Cb 0.51 -1.06 -0.15 0.00 -0.02 0.00 0.00 31.44 30.72 3mi6 n GLU 362 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 3mi6 s PHE 364 N -1.77 -0.06 -0.19 -0.32 2.19 -0.52 -1.33 117.98 115.98 3mi6 s PHE 364 Ca 0.24 0.26 -0.04 0.00 0.33 0.00 0.00 56.93 57.72 3mi6 s PHE 364 Cb 0.22 -0.12 -0.02 0.00 -1.31 0.00 0.00 43.02 41.80 3mi6 s PHE 364 CO -0.02 -0.10 -0.04 0.08 1.83 0.00 0.00 175.22 176.97 3mi6 s VAL 365 N 0.85 3.57 -0.37 3.12 1.01 0.13 -1.60 120.40 127.12 3mi6 s VAL 365 Ca -0.07 -0.45 -0.21 0.00 0.00 0.00 0.00 61.98 61.25 3mi6 s VAL 365 Cb -0.09 -2.59 0.01 0.00 0.00 0.00 0.00 36.38 33.70 3mi6 s VAL 365 CO -0.03 0.45 0.69 -0.22 0.00 0.00 0.00 175.10 175.99 3mi6 s LEU 366 N 0.98 4.23 0.00 3.92 2.96 -0.61 -3.38 118.68 126.78 3mi6 s LEU 366 Ca 0.00 0.18 0.00 0.00 -0.22 0.00 0.00 54.13 54.09 3mi6 s LEU 366 Cb -0.15 -2.87 0.00 0.00 0.50 0.00 0.00 46.19 43.68 3mi6 s LEU 366 CO 0.01 -0.66 0.00 -0.67 -1.32 0.00 0.00 176.35 173.71 3mi6 n ASP 367 N 6.20 0.00 -4.67 3.68 2.03 -1.26 -2.07 116.55 120.46 3mi6 n ASP 367 Ca 0.00 0.00 -0.44 0.00 0.52 0.00 0.00 54.79 54.87 3mi6 n ASP 367 Cb 0.48 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.87 3mi6 n ASP 367 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 3mi6 n ASP 368 N 0.00 2.50 0.00 1.67 -0.08 -1.26 -4.03 116.55 115.35 3mi6 n ASP 368 Ca 0.00 1.18 0.00 0.00 -1.51 0.00 0.00 54.79 54.46 3mi6 n ASP 368 Cb 0.00 -1.43 0.00 0.00 2.34 0.00 0.00 41.12 42.03 3mi6 n ASP 368 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3mi6 n GLY 369 N 1.38 1.41 0.13 0.27 0.00 -1.26 -4.72 105.19 102.39 3mi6 n GLY 369 Ca 0.08 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.25 3mi6 n GLY 369 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 3mi6 n TRP 370 N 0.00 0.00 -4.49 1.61 4.27 -1.26 -4.57 117.44 113.00 3mi6 n TRP 370 Ca 0.00 0.00 -0.24 0.00 -3.89 0.00 0.00 57.50 53.37 3mi6 n TRP 370 Cb 0.00 -0.13 -0.10 0.00 -1.36 0.00 0.00 31.31 29.72 3mi6 n TRP 370 CO 0.00 0.00 0.00 -0.59 -2.29 0.00 0.00 177.69 174.81 3mi6 s PHE 371 N -2.33 2.28 0.00 -2.67 -0.12 -1.26 -1.44 117.98 112.44 3mi6 s PHE 371 Ca 0.34 -0.44 0.00 0.00 -0.05 0.00 0.00 56.93 56.78 3mi6 s PHE 371 Cb 0.21 -1.15 0.00 0.00 -0.63 0.00 0.00 43.02 41.45 3mi6 s PHE 371 CO 0.44 0.62 0.00 0.41 -0.05 0.00 0.00 175.22 176.63 3mi6 n GLY 372 N -0.67 2.77 1.64 1.99 0.00 -0.63 -1.34 105.19 108.95 3mi6 n GLY 372 Ca -0.05 0.32 -0.04 0.00 0.00 0.00 0.00 46.02 46.25 3mi6 n GLY 372 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3mi6 n HIS 373 N 10.22 1.01 -2.28 1.61 1.44 -1.26 -4.31 115.22 121.64 3mi6 n HIS 373 Ca 0.00 -1.61 -0.41 0.00 -2.01 0.00 0.00 57.72 53.70 3mi6 n HIS 373 Cb 0.00 -0.25 -0.03 0.00 0.12 0.00 0.00 29.99 29.83 3mi6 n HIS 373 CO 0.00 0.00 0.00 0.50 -2.81 0.00 0.00 176.34 174.03 3mi6 s ARG 374 N -2.74 3.07 0.00 -1.40 3.52 -0.45 -4.58 118.95 116.37 3mi6 s ARG 374 Ca 0.38 0.44 0.00 0.00 -0.13 0.00 0.00 55.73 56.42 3mi6 s ARG 374 Cb 0.38 -4.22 0.00 0.00 -1.56 0.00 0.00 34.95 29.54 3mi6 s ARG 374 CO -0.06 -2.23 0.00 -0.25 -0.81 0.00 0.00 175.30 171.96 3mi6 n ASP 375 N 10.60 0.32 -4.61 -2.12 8.00 -1.26 -4.60 116.55 122.87 3mi6 n ASP 375 Ca 0.14 -0.28 -0.24 0.00 0.71 0.00 0.00 54.79 55.13 3mi6 n ASP 375 Cb 0.50 0.62 -0.08 0.00 -0.02 0.00 0.00 41.12 42.13 3mi6 n ASP 375 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3mi6 s ASP 376 N -0.68 4.24 0.00 -2.24 -1.08 -1.26 -4.79 116.67 110.86 3mi6 s ASP 376 Ca 0.00 -0.83 0.00 0.00 -0.52 0.00 0.00 52.55 51.20 3mi6 s ASP 376 Cb 0.00 -0.63 0.00 0.00 -1.46 0.00 0.00 42.92 40.83 3mi6 s ASP 376 CO 0.00 -0.08 0.61 -0.90 0.52 0.00 0.00 175.17 175.32 3mi6 n ASP 377 N -0.87 0.73 -0.09 -0.34 5.75 -1.26 -4.06 116.55 116.41 3mi6 n ASP 377 Ca -0.05 -1.94 0.02 0.00 -0.01 0.00 0.00 54.79 52.81 3mi6 n ASP 377 Cb 0.60 -0.36 -0.01 0.00 -1.03 0.00 0.00 41.12 40.32 3mi6 n ASP 377 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 3mi6 n THR 378 N -0.11 0.00 -4.00 2.12 -2.24 -1.26 -4.65 114.28 104.13 3mi6 n THR 378 Ca 0.00 -0.44 -0.08 0.00 -2.27 0.00 0.00 64.05 61.26 3mi6 n THR 378 Cb 0.18 1.05 -0.09 0.00 -2.10 0.00 0.00 70.33 69.36 3mi6 n THR 378 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3mi6 s THR 379 N -1.00 0.18 0.00 4.28 -4.23 -1.26 -4.66 115.64 108.95 3mi6 s THR 379 Ca 0.04 -1.44 0.00 0.00 -1.18 0.00 0.00 61.69 59.10 3mi6 s THR 379 Cb 0.04 -1.23 0.00 0.00 1.34 0.00 0.00 72.50 72.65 3mi6 s THR 379 CO 0.13 -0.80 0.00 -1.20 -0.54 0.00 0.00 174.62 172.22 3mi6 n SER 380 N 0.36 0.00 -4.67 3.99 7.64 -0.62 -4.62 113.62 115.70 3mi6 n SER 380 Ca -0.16 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.30 3mi6 n SER 380 Cb 0.60 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.77 3mi6 n SER 380 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3mi6 s LEU 381 N 0.00 4.37 0.00 -3.43 1.43 -1.26 -1.40 118.68 118.38 3mi6 s LEU 381 Ca 0.00 2.44 0.00 0.00 -1.03 0.00 0.00 54.13 55.54 3mi6 s LEU 381 Cb 0.00 -3.55 0.00 0.00 0.03 0.00 0.00 46.19 42.67 3mi6 s LEU 381 CO 0.00 -0.94 0.00 0.61 0.23 0.00 0.00 176.35 176.25 3mi6 n GLY 382 N 4.17 2.33 2.98 -3.19 0.00 -1.26 -1.34 105.19 108.86 3mi6 n GLY 382 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 3mi6 n GLY 382 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3mi6 n ASP 383 N 0.00 5.54 -3.84 1.61 9.92 -0.50 -4.76 116.55 124.53 3mi6 n ASP 383 Ca 0.00 -3.19 -0.42 0.00 -0.53 0.00 0.00 54.79 50.64 3mi6 n ASP 383 Cb 0.00 -1.42 0.00 0.00 -0.64 0.00 0.00 41.12 39.07 3mi6 n ASP 383 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 3mi6 n TRP 384 N 3.15 3.28 -3.84 1.24 7.02 -1.26 -3.16 117.44 123.86 3mi6 n TRP 384 Ca 0.35 -2.88 -0.10 0.00 -1.02 0.00 0.00 57.50 53.85 3mi6 n TRP 384 Cb 0.36 -2.23 -0.06 0.00 -2.42 0.00 0.00 31.31 26.96 3mi6 n TRP 384 CO 0.00 0.00 0.00 -0.59 -2.02 0.00 0.00 177.69 175.08 3mi6 s PHE 385 N 1.70 0.14 0.56 -5.99 -0.12 -1.26 -5.02 117.98 107.98 3mi6 s PHE 385 Ca 0.43 -0.50 -0.20 0.00 -0.05 0.00 0.00 56.93 56.61 3mi6 s PHE 385 Cb 0.11 0.12 -0.06 0.00 -0.63 0.00 0.00 43.02 42.55 3mi6 s PHE 385 CO -0.03 -0.75 0.94 0.28 -0.05 0.00 0.00 175.22 175.60 3mi6 n VAL 386 N -0.23 3.28 -3.21 -2.49 0.31 -1.26 -1.60 118.33 113.12 3mi6 n VAL 386 Ca -0.10 -0.50 -0.45 0.00 -0.01 0.00 0.00 64.34 63.28 3mi6 n VAL 386 Cb 0.63 -1.12 -0.05 0.00 -0.91 0.00 0.00 33.84 32.38 3mi6 n VAL 386 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3mi6 s ASP 387 N -1.12 6.19 0.00 4.52 2.15 -0.52 -4.03 116.67 123.86 3mi6 s ASP 387 Ca 0.72 -1.54 0.16 0.00 0.43 0.00 0.00 52.55 52.32 3mi6 s ASP 387 Cb -0.45 -2.26 0.81 0.00 -0.30 0.00 0.00 42.92 40.72 3mi6 s ASP 387 CO 0.50 -0.97 1.47 0.00 -0.17 0.00 0.00 175.17 175.99 3mi6 n GLN 388 N 5.82 0.22 -0.11 4.34 6.02 -1.26 -1.57 117.38 130.84 3mi6 n GLN 388 Ca -0.11 0.14 -0.13 0.00 -0.01 0.00 0.00 57.00 56.89 3mi6 n GLN 388 Cb 0.42 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.15 3mi6 n GLN 388 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3mi6 h ARG 389 N 0.00 0.79 -0.01 -1.09 3.08 -1.92 -3.20 114.38 112.04 3mi6 h ARG 389 Ca 0.00 -0.39 0.00 0.00 0.07 0.00 0.00 59.98 59.66 3mi6 h ARG 389 Cb 0.16 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.21 3mi6 h ARG 389 CO 0.00 1.02 -0.43 1.63 -1.07 0.00 0.00 179.97 181.12 3mi6 n LYS 390 N -4.22 1.83 -3.20 0.04 5.02 -0.71 -4.62 118.16 112.30 3mi6 n LYS 390 Ca -0.03 -0.57 -0.22 0.00 -2.02 0.00 0.00 58.31 55.47 3mi6 n LYS 390 Cb 0.47 -1.24 -0.06 0.00 -0.02 0.00 0.00 35.03 34.18 3mi6 n LYS 390 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3mi6 n PHE 391 N -0.48 0.10 -0.31 2.13 3.72 -0.61 0.66 117.46 122.66 3mi6 n PHE 391 Ca 0.05 -3.68 0.30 0.00 -0.05 0.00 0.00 57.45 54.08 3mi6 n PHE 391 Cb 0.30 -0.38 0.56 0.00 -0.94 0.00 0.00 39.48 39.01 3mi6 n PHE 391 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 3mi6 n PRO 392 N 1.02 -0.06 -1.21 -1.08 -0.02 -1.21 0.14 135.00 132.58 3mi6 n PRO 392 Ca 0.23 1.36 -0.21 0.00 -2.02 0.00 0.00 63.50 62.85 3mi6 n PRO 392 Cb 0.56 -2.42 0.15 0.00 -0.02 0.00 0.00 33.50 31.77 3mi6 n PRO 392 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3mi6 n ASP 393 N -5.23 4.46 -0.40 2.55 8.00 -1.26 -4.98 116.55 119.70 3mi6 n ASP 393 Ca 0.36 -3.72 0.00 0.00 0.71 0.00 0.00 54.79 52.14 3mi6 n ASP 393 Cb 1.23 -0.77 0.00 0.00 -0.02 0.00 0.00 41.12 41.55 3mi6 n ASP 393 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3mi6 n GLY 394 N -1.05 0.07 0.09 0.44 0.00 0.37 -3.90 105.19 101.22 3mi6 n GLY 394 Ca 0.52 -0.92 -0.11 0.00 0.00 0.00 0.00 46.02 45.51 3mi6 n GLY 394 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3mi6 n ILE 395 N -0.79 1.62 -0.36 -0.61 2.08 -1.26 -3.96 119.36 116.07 3mi6 n ILE 395 Ca 0.00 -0.78 0.31 0.00 0.56 0.00 0.00 62.75 62.84 3mi6 n ILE 395 Cb 0.00 -1.10 0.62 0.00 -0.75 0.00 0.00 39.64 38.42 3mi6 n ILE 395 CO 0.00 0.00 0.00 1.05 0.56 0.00 0.00 176.55 178.16 3mi6 h GLU 396 N 0.01 0.19 0.38 0.38 9.09 -1.82 -0.06 114.58 122.75 3mi6 h GLU 396 Ca -0.34 -0.01 -0.02 0.00 0.05 0.00 0.00 59.36 59.04 3mi6 h GLU 396 Cb 2.04 -0.04 0.00 0.00 -1.65 0.00 0.00 28.75 29.10 3mi6 h GLU 396 CO 0.07 0.13 -0.18 1.25 0.05 0.00 0.00 179.01 180.33 3mi6 h HIS 397 N 0.20 -0.47 -0.39 2.06 2.76 -1.69 -2.92 115.15 114.69 3mi6 h HIS 397 Ca 0.64 -0.01 0.07 0.00 -2.20 0.00 0.00 60.37 58.87 3mi6 h HIS 397 Cb 2.04 0.16 -0.07 0.00 1.55 0.00 0.00 27.41 31.08 3mi6 h HIS 397 CO -0.00 -0.29 -0.05 0.35 -1.30 0.00 0.00 177.93 176.64 3mi6 h PHE 398 N -0.96 -0.11 -0.04 5.26 3.57 -1.61 -1.11 116.94 121.95 3mi6 h PHE 398 Ca -0.05 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.49 3mi6 h PHE 398 Cb 0.39 0.11 -0.00 0.00 2.79 0.00 0.00 35.95 39.23 3mi6 h PHE 398 CO 0.02 -0.12 0.05 0.66 -2.23 0.00 0.00 178.31 176.69 3mi6 h SER 399 N 0.05 0.00 0.16 0.41 4.64 -1.12 -1.74 113.55 115.94 3mi6 h SER 399 Ca 0.19 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.29 3mi6 h SER 399 Cb 0.28 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.40 3mi6 h SER 399 CO -0.36 0.00 -0.98 -0.61 -0.87 0.00 0.00 176.83 174.02 3mi6 h GLN 400 N 0.00 0.38 -0.63 4.77 4.15 -1.02 -2.44 115.11 120.33 3mi6 h GLN 400 Ca 0.02 -0.62 0.15 0.00 0.77 0.00 0.00 58.65 58.97 3mi6 h GLN 400 Cb 0.11 0.23 -0.03 0.00 0.21 0.00 0.00 27.48 28.00 3mi6 h GLN 400 CO -0.00 1.29 0.43 0.00 -1.93 0.00 0.00 178.83 178.62 3mi6 h ALA 401 N 0.13 2.34 0.11 3.38 0.00 -0.68 -0.32 119.26 124.21 3mi6 h ALA 401 Ca -0.17 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.59 3mi6 h ALA 401 Cb 1.76 -0.00 0.02 0.00 0.00 0.00 0.00 17.79 19.56 3mi6 h ALA 401 CO 0.18 -0.51 -0.63 0.28 0.00 0.00 0.00 179.25 178.57 3mi6 h VAL 402 N 0.18 1.58 -0.26 0.00 2.07 -1.56 -3.16 116.25 115.11 3mi6 h VAL 402 Ca 0.30 -2.50 0.07 0.00 0.82 0.00 0.00 66.70 65.40 3mi6 h VAL 402 Cb 0.94 3.25 -0.01 0.00 -1.52 0.00 0.00 31.29 33.95 3mi6 h VAL 402 CO -0.05 0.69 0.26 0.45 0.02 0.00 0.00 177.57 178.94 3mi6 h HIS 403 N -0.52 0.00 0.00 1.57 -0.00 -0.58 -1.17 115.15 114.45 3mi6 h HIS 403 Ca -0.11 0.00 -0.18 0.00 -0.00 0.00 0.00 60.37 60.08 3mi6 h HIS 403 Cb 1.50 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 28.88 3mi6 h HIS 403 CO 0.22 0.00 -1.38 1.96 -0.00 0.00 0.00 177.93 178.72 3mi6 h GLN 404 N 0.00 0.00 0.00 2.45 4.20 -1.39 -3.22 115.11 117.14 3mi6 h GLN 404 Ca 0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.83 3mi6 h GLN 404 Cb 0.63 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.41 3mi6 h GLN 404 CO -0.00 0.33 0.00 1.04 -0.67 0.00 0.00 178.83 179.52 3mi6 n GLN 405 N -2.93 0.49 -0.39 1.46 1.13 -0.45 -5.13 117.38 111.56 3mi6 n GLN 405 Ca -0.10 0.03 0.00 0.00 -1.94 0.00 0.00 57.00 54.99 3mi6 n GLN 405 Cb 0.85 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.70 3mi6 n GLN 405 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3mi6 n GLY 406 N 0.12 0.71 3.56 1.08 0.00 -1.16 -4.97 105.19 104.53 3mi6 n GLY 406 Ca 0.12 -0.42 -0.27 0.00 0.00 0.00 0.00 46.02 45.45 3mi6 n GLY 406 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mi6 s LYS 408 N -1.22 2.02 -0.04 1.61 1.02 -0.44 -5.00 119.74 117.69 3mi6 s LYS 408 Ca 0.00 -1.24 0.04 0.00 0.02 0.00 0.00 55.97 54.79 3mi6 s LYS 408 Cb 0.00 -2.16 -0.00 0.00 -0.52 0.00 0.00 37.83 35.15 3mi6 s LYS 408 CO 0.00 0.45 -0.16 0.12 -0.92 0.00 0.00 175.35 174.84 3mi6 s PHE 409 N -1.58 1.62 0.07 3.18 5.36 -1.26 -1.44 117.98 123.93 3mi6 s PHE 409 Ca 0.23 -0.46 0.02 0.00 -0.96 0.00 0.00 56.93 55.76 3mi6 s PHE 409 Cb -0.09 -1.10 -0.04 0.00 -0.34 0.00 0.00 43.02 41.46 3mi6 s PHE 409 CO 0.14 -0.16 -0.07 0.20 -1.46 0.00 0.00 175.22 173.88 3mi6 s GLY 410 N 0.07 0.65 0.18 13.12 0.00 -0.63 0.70 107.32 121.41 3mi6 s GLY 410 Ca -0.04 -1.13 -0.01 0.00 0.00 0.00 0.00 44.72 43.54 3mi6 s GLY 410 CO 0.02 -1.22 0.11 0.48 0.00 0.00 0.00 173.10 172.49 3mi6 s LEU 411 N -2.52 1.34 -0.07 0.66 0.05 -1.03 -1.57 118.68 115.54 3mi6 s LEU 411 Ca 0.04 -1.33 -0.12 0.00 0.05 0.00 0.00 54.13 52.76 3mi6 s LEU 411 Cb 0.00 0.36 -0.05 0.00 -2.05 0.00 0.00 46.19 44.45 3mi6 s LEU 411 CO -0.03 -0.81 0.31 0.86 -0.55 0.00 0.00 176.35 176.13 3mi6 s TRP 412 N -4.13 3.64 0.05 3.48 -0.00 -0.88 -0.56 118.94 120.54 3mi6 s TRP 412 Ca 0.34 0.78 0.01 0.00 -0.00 0.00 0.00 56.10 57.24 3mi6 s TRP 412 Cb 0.07 -2.20 -0.03 0.00 -0.00 0.00 0.00 33.47 31.31 3mi6 s TRP 412 CO 0.09 0.59 -0.05 -0.06 -0.00 0.00 0.00 176.95 177.52 3mi6 s PHE 413 N -0.74 0.55 -0.42 5.86 0.08 0.74 -4.92 117.98 119.13 3mi6 s PHE 413 Ca 0.20 -0.73 0.10 0.00 0.12 0.00 0.00 56.93 56.63 3mi6 s PHE 413 Cb -0.15 -0.35 0.35 0.00 -0.57 0.00 0.00 43.02 42.30 3mi6 s PHE 413 CO 0.09 -0.20 0.78 -1.91 -0.10 0.00 0.00 175.22 173.88 3mi6 n GLU 414 N 0.89 1.48 -0.32 0.44 2.13 -1.26 -0.44 120.64 123.56 3mi6 n GLU 414 Ca -0.19 -3.71 0.19 0.00 0.66 0.00 0.00 57.16 54.10 3mi6 n GLU 414 Cb 0.57 -1.83 0.39 0.00 0.27 0.00 0.00 31.44 30.85 3mi6 n GLU 414 CO 0.00 0.00 0.00 -1.35 -0.41 0.00 0.00 177.13 175.37 3mi6 h PRO 415 N 3.00 0.35 -2.02 5.31 0.11 -1.97 -3.45 132.00 133.32 3mi6 h PRO 415 Ca 0.11 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.17 3mi6 h PRO 415 Cb 0.87 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.89 3mi6 h PRO 415 CO 0.57 0.23 -0.04 0.39 -0.21 0.00 0.00 178.00 178.94 3mi6 n GLU 416 N -5.06 0.99 0.00 1.05 1.02 -1.26 -4.88 120.64 112.51 3mi6 n GLU 416 Ca 0.27 -0.13 0.00 0.00 -0.02 0.00 0.00 57.16 57.28 3mi6 n GLU 416 Cb 0.82 -1.20 0.00 0.00 -0.02 0.00 0.00 31.44 31.04 3mi6 n GLU 416 CO 0.00 0.00 0.00 1.55 1.18 0.00 0.00 177.13 179.86 3mi6 n VAL 418 N 1.72 0.00 -3.28 2.62 3.14 0.10 0.14 118.33 122.78 3mi6 n VAL 418 Ca 0.06 0.00 -0.39 0.00 -2.96 0.00 0.00 64.34 61.05 3mi6 n VAL 418 Cb 0.49 0.00 -0.06 0.00 -1.06 0.00 0.00 33.84 33.21 3mi6 n VAL 418 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 3mi6 s SER 419 N 0.00 6.96 0.26 6.55 0.01 -0.45 -1.92 113.70 125.10 3mi6 s SER 419 Ca 0.00 1.14 -0.02 0.00 1.31 0.00 0.00 55.95 58.38 3mi6 s SER 419 Cb 0.00 -2.34 0.49 0.00 0.21 0.00 0.00 66.02 64.38 3mi6 s SER 419 CO 0.00 0.18 1.77 0.58 0.41 0.00 0.00 173.24 176.19 3mi6 h VAL 420 N 3.92 0.78 -1.58 3.43 2.07 -1.86 -3.16 116.25 119.85 3mi6 h VAL 420 Ca -0.47 -0.23 -0.70 0.00 0.82 0.00 0.00 66.70 66.12 3mi6 h VAL 420 Cb 1.21 0.06 -0.13 0.00 -1.52 0.00 0.00 31.29 30.90 3mi6 h VAL 420 CO 0.67 0.12 1.70 -0.62 0.02 0.00 0.00 177.57 179.46 3mi6 s ASP 421 N -5.47 6.93 0.12 0.57 2.15 -1.26 -4.73 116.67 114.98 3mi6 s ASP 421 Ca -0.12 -2.65 -0.25 0.00 0.43 0.00 0.00 52.55 49.95 3mi6 s ASP 421 Cb 0.21 -2.48 0.07 0.00 -0.30 0.00 0.00 42.92 40.42 3mi6 s ASP 421 CO 0.78 -0.97 0.86 -0.94 -0.17 0.00 0.00 175.17 174.73 3mi6 s SER 422 N 3.55 -0.29 0.53 -0.34 1.04 -1.19 -1.59 113.70 115.40 3mi6 s SER 422 Ca 0.47 -0.25 0.33 0.00 0.48 0.00 0.00 55.95 56.98 3mi6 s SER 422 Cb 0.00 0.50 1.37 0.00 0.10 0.00 0.00 66.02 67.99 3mi6 s SER 422 CO 0.03 -0.87 1.97 -2.24 0.98 0.00 0.00 173.24 173.11 3mi6 h ASP 423 N 2.00 0.00 0.28 7.02 -0.00 -1.91 -3.01 116.42 120.80 3mi6 h ASP 423 Ca -0.24 0.00 -0.24 0.00 -0.00 0.00 0.00 57.03 56.55 3mi6 h ASP 423 Cb 1.25 0.00 0.01 0.00 -0.00 0.00 0.00 39.33 40.58 3mi6 h ASP 423 CO 0.28 0.00 -1.00 -0.07 -0.00 0.00 0.00 179.24 178.46 3mi6 h LEU 424 N 0.00 0.62 -0.01 0.15 3.38 -1.89 -2.80 115.31 114.76 3mi6 h LEU 424 Ca 0.00 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 57.46 3mi6 h LEU 424 Cb 0.48 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.04 3mi6 h LEU 424 CO 0.00 1.32 0.00 0.00 0.09 0.00 0.00 178.44 179.85 3mi6 n TYR 425 N -3.76 0.03 -0.04 1.13 9.36 -1.14 -0.24 117.16 122.51 3mi6 n TYR 425 Ca -0.08 0.01 -0.03 0.00 3.32 0.00 0.00 57.90 61.12 3mi6 n TYR 425 Cb 0.86 -0.52 -0.14 0.00 -0.63 0.00 0.00 39.34 38.92 3mi6 n TYR 425 CO 0.00 0.00 0.00 1.04 0.22 0.00 0.00 176.86 178.12 3mi6 n GLN 426 N -1.53 0.66 -0.00 2.98 6.02 -1.21 -3.62 117.38 120.68 3mi6 n GLN 426 Ca 0.06 0.04 -0.13 0.00 -0.01 0.00 0.00 57.00 56.97 3mi6 n GLN 426 Cb 0.30 -1.62 -0.14 0.00 1.02 0.00 0.00 30.24 29.80 3mi6 n GLN 426 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 3mi6 h GLN 427 N 0.00 0.09 -1.14 -1.09 1.08 -1.24 -3.43 115.11 109.39 3mi6 h GLN 427 Ca -0.31 -0.16 -0.37 0.00 -1.45 0.00 0.00 58.65 56.36 3mi6 h GLN 427 Cb 1.79 0.06 -0.33 0.00 -0.05 0.00 0.00 27.48 28.95 3mi6 h GLN 427 CO 0.03 0.76 -0.97 0.72 -0.95 0.00 0.00 178.83 178.42 3mi6 n HIS 428 N -3.21 -0.36 0.17 2.96 8.25 0.67 -4.94 115.22 118.76 3mi6 n HIS 428 Ca -0.20 -3.01 0.11 0.00 -0.26 0.00 0.00 57.72 54.36 3mi6 n HIS 428 Cb 1.05 0.17 0.59 0.00 1.12 0.00 0.00 29.99 32.92 3mi6 n HIS 428 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 3mi6 n PRO 429 N 0.09 0.14 -0.00 -0.41 -0.02 -1.24 -0.51 135.00 133.05 3mi6 n PRO 429 Ca 0.14 0.64 0.15 0.00 -2.02 0.00 0.00 63.50 62.40 3mi6 n PRO 429 Cb 0.74 -1.98 0.84 0.00 -0.02 0.00 0.00 33.50 33.08 3mi6 n PRO 429 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3mi6 n ASP 430 N -2.26 0.19 -0.19 2.55 3.85 -1.26 -3.26 116.55 116.17 3mi6 n ASP 430 Ca -0.01 -1.13 0.12 0.00 -0.71 0.00 0.00 54.79 53.05 3mi6 n ASP 430 Cb 0.05 -0.00 0.13 0.00 -1.35 0.00 0.00 41.12 39.95 3mi6 n ASP 430 CO 0.00 0.00 0.00 0.79 -1.01 0.00 0.00 177.20 176.98 3mi6 n TRP 431 N -0.82 0.00 -2.35 2.11 7.02 0.34 -4.87 117.44 118.87 3mi6 n TRP 431 Ca 0.22 0.00 -0.41 0.00 -1.02 0.00 0.00 57.50 56.29 3mi6 n TRP 431 Cb 0.13 -0.09 -0.03 0.00 -2.42 0.00 0.00 31.31 28.90 3mi6 n TRP 431 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 3mi6 s LEU 432 N -2.74 4.44 -0.11 -0.99 1.02 -1.20 -1.48 118.68 117.63 3mi6 s LEU 432 Ca 0.16 2.26 -0.30 0.00 0.02 0.00 0.00 54.13 56.28 3mi6 s LEU 432 Cb 0.18 -3.61 -0.03 0.00 0.02 0.00 0.00 46.19 42.75 3mi6 s LEU 432 CO 0.66 -0.40 1.38 -0.63 0.02 0.00 0.00 176.35 177.38 3mi6 s ILE 433 N -0.03 4.02 -0.28 -0.59 1.01 -0.82 -4.85 121.20 119.67 3mi6 s ILE 433 Ca 0.53 1.27 -0.16 0.00 0.00 0.00 0.00 60.65 62.29 3mi6 s ILE 433 Cb -0.33 -3.82 0.10 0.00 0.01 0.00 0.00 42.46 38.42 3mi6 s ILE 433 CO 0.37 -0.09 0.78 -2.28 0.00 0.00 0.00 174.94 173.72 3mi6 s HIS 434 N 3.43 -0.90 0.38 3.97 2.46 -1.15 -4.80 115.29 118.68 3mi6 s HIS 434 Ca 0.61 1.81 -0.25 0.00 0.47 0.00 0.00 55.06 57.70 3mi6 s HIS 434 Cb -0.26 0.53 -0.09 0.00 -0.13 0.00 0.00 32.58 32.63 3mi6 s HIS 434 CO 0.20 -0.44 1.06 0.00 -2.47 0.00 0.00 174.74 173.09 3mi6 s ALA 435 N 1.50 3.14 0.01 1.58 0.00 -1.06 -4.53 121.76 122.39 3mi6 s ALA 435 Ca -0.09 0.74 -0.02 0.00 0.00 0.00 0.00 51.96 52.59 3mi6 s ALA 435 Cb -0.05 -3.29 -0.01 0.00 0.00 0.00 0.00 23.12 19.78 3mi6 s ALA 435 CO -0.18 -0.22 1.04 -1.35 0.00 0.00 0.00 175.76 175.05 3mi6 h PRO 436 N 2.71 -0.02 -0.64 0.00 0.11 -1.97 -3.01 132.00 129.18 3mi6 h PRO 436 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3mi6 h PRO 436 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3mi6 h PRO 436 CO 0.63 -0.01 0.00 1.63 -0.21 0.00 0.00 178.00 180.04 3mi6 n LYS 437 N -2.94 3.28 -3.19 1.05 4.01 -1.26 -4.98 118.16 114.13 3mi6 n LYS 437 Ca -0.00 -2.46 -0.33 0.00 -0.51 0.00 0.00 58.31 55.02 3mi6 n LYS 437 Cb 0.02 -1.78 -0.06 0.00 -0.51 0.00 0.00 35.03 32.70 3mi6 n LYS 437 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 3mi6 s SER 438 N -0.85 6.77 -0.41 4.39 1.04 -1.14 -5.03 113.70 118.47 3mi6 s SER 438 Ca 0.44 1.22 -0.25 0.00 0.48 0.00 0.00 55.95 57.84 3mi6 s SER 438 Cb 0.28 -2.35 0.02 0.00 0.10 0.00 0.00 66.02 64.07 3mi6 s SER 438 CO 0.22 -0.16 0.91 -0.89 0.98 0.00 0.00 173.24 174.30 3mi6 s THR 439 N -1.92 4.55 0.35 2.02 2.01 -1.26 -4.88 115.64 116.51 3mi6 s THR 439 Ca 0.52 0.94 -0.26 0.00 0.31 0.00 0.00 61.69 63.20 3mi6 s THR 439 Cb -0.11 -4.37 -0.13 0.00 0.01 0.00 0.00 72.50 67.91 3mi6 s THR 439 CO 0.18 -0.67 0.95 -2.65 -0.69 0.00 0.00 174.62 171.75 3mi6 n PRO 440 N 6.93 1.25 -3.99 4.92 -0.02 -1.26 -5.00 135.00 137.83 3mi6 n PRO 440 Ca 0.06 0.44 -0.34 0.00 -2.02 0.00 0.00 63.50 61.65 3mi6 n PRO 440 Cb 0.48 -1.86 -0.15 0.00 -0.02 0.00 0.00 33.50 31.95 3mi6 n PRO 440 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3mi6 s THR 441 N -1.18 2.68 0.48 3.45 2.01 -1.26 -5.11 115.64 116.71 3mi6 s THR 441 Ca 0.61 -1.12 -0.19 0.00 0.31 0.00 0.00 61.69 61.30 3mi6 s THR 441 Cb -0.64 -2.37 -0.09 0.00 0.01 0.00 0.00 72.50 69.41 3mi6 s THR 441 CO 0.59 0.19 1.00 -2.16 -0.69 0.00 0.00 174.62 173.55 3mi6 s PRO 442 N 1.29 3.94 -0.06 4.92 0.04 -1.26 -4.86 135.00 139.00 3mi6 s PRO 442 Ca -0.01 1.17 -0.01 0.00 0.04 0.00 0.00 61.00 62.19 3mi6 s PRO 442 Cb -0.17 -2.13 0.03 0.00 0.04 0.00 0.00 34.50 32.27 3mi6 s PRO 442 CO -0.05 -0.29 0.02 0.20 0.04 0.00 0.00 177.00 176.91 3mi6 s GLY 443 N -2.38 0.36 -1.60 0.56 0.00 -1.14 -4.75 107.32 98.36 3mi6 s GLY 443 Ca 0.63 0.01 -0.11 0.00 0.00 0.00 0.00 44.72 45.26 3mi6 s GLY 443 CO 0.22 1.15 0.55 -2.13 0.00 0.00 0.00 173.10 172.88 3mi6 n ARG 444 N 5.06 -2.70 -3.96 2.90 0.63 -1.26 -2.26 116.66 115.08 3mi6 n ARG 444 Ca -0.08 0.32 -0.25 0.00 -0.92 0.00 0.00 57.85 56.92 3mi6 n ARG 444 Cb 0.50 -4.68 -0.02 0.00 0.45 0.00 0.00 32.46 28.71 3mi6 n ARG 444 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 3mi6 n HIS 445 N -4.39 -1.65 -3.82 -0.14 8.25 -1.26 -4.77 115.22 107.44 3mi6 n HIS 445 Ca -0.10 0.75 -0.08 0.00 -0.26 0.00 0.00 57.72 58.03 3mi6 n HIS 445 Cb 0.58 -3.74 -0.03 0.00 1.12 0.00 0.00 29.99 27.92 3mi6 n HIS 445 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 3mi6 s GLN 446 N -6.56 1.64 0.32 -0.41 -2.07 -0.96 -4.70 119.66 106.93 3mi6 s GLN 446 Ca 0.01 -0.96 0.03 0.00 -1.82 0.00 0.00 55.36 52.62 3mi6 s GLN 446 Cb -0.01 0.57 -0.04 0.00 -1.09 0.00 0.00 33.01 32.44 3mi6 s GLN 446 CO 0.89 -0.73 0.11 -0.06 -1.32 0.00 0.00 175.29 174.18 3mi6 s PHE 447 N -3.91 1.71 -0.04 9.60 0.40 -0.81 -2.89 117.98 122.04 3mi6 s PHE 447 Ca 0.12 -1.20 0.03 0.00 -0.60 0.00 0.00 56.93 55.27 3mi6 s PHE 447 Cb -0.04 -1.03 -0.03 0.00 0.51 0.00 0.00 43.02 42.43 3mi6 s PHE 447 CO 0.04 -0.30 -0.10 0.54 0.70 0.00 0.00 175.22 176.10 3mi6 s VAL 448 N -3.49 3.39 0.55 -0.44 0.11 -1.26 -0.72 120.40 118.54 3mi6 s VAL 448 Ca 0.34 -0.68 -0.19 0.00 -2.93 0.00 0.00 61.98 58.52 3mi6 s VAL 448 Cb 0.06 -2.39 -0.05 0.00 -1.53 0.00 0.00 36.38 32.47 3mi6 s VAL 448 CO 0.15 0.53 1.12 -0.76 -3.33 0.00 0.00 175.10 172.82 3mi6 s LEU 449 N -0.96 3.71 0.63 2.54 1.43 0.38 -1.94 118.68 124.46 3mi6 s LEU 449 Ca 0.13 2.13 -0.09 0.00 -1.03 0.00 0.00 54.13 55.28 3mi6 s LEU 449 Cb -0.11 -4.57 0.00 0.00 0.03 0.00 0.00 46.19 41.54 3mi6 s LEU 449 CO 0.03 -1.24 0.98 -0.62 0.23 0.00 0.00 176.35 175.74 3mi6 s ASP 450 N -1.91 5.64 0.00 2.29 -1.08 -0.55 -4.76 116.67 116.30 3mi6 s ASP 450 Ca 0.71 0.96 0.00 0.00 -0.52 0.00 0.00 52.55 53.71 3mi6 s ASP 450 Cb -0.23 -1.90 0.00 0.00 -1.46 0.00 0.00 42.92 39.33 3mi6 s ASP 450 CO 0.28 -1.12 0.00 0.00 0.52 0.00 0.00 175.17 174.85 3mi6 n ALA 452 N -2.75 0.00 -2.58 3.66 0.00 -1.26 -4.78 120.51 112.80 3mi6 n ALA 452 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.07 3mi6 n ALA 452 Cb 0.57 -0.10 -0.06 0.00 0.00 0.00 0.00 19.45 19.86 3mi6 n ALA 452 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3mi6 s ARG 453 N 0.00 3.71 0.23 0.00 0.52 -1.26 -4.96 118.95 117.19 3mi6 s ARG 453 Ca 0.00 0.21 -0.07 0.00 -0.52 0.00 0.00 55.73 55.35 3mi6 s ARG 453 Cb 0.00 -3.82 0.30 0.00 0.52 0.00 0.00 34.95 31.95 3mi6 s ARG 453 CO 0.00 -0.84 1.84 -1.35 0.02 0.00 0.00 175.30 174.97 3mi6 h PRO 454 N 8.51 0.87 -0.74 3.54 0.11 -2.00 -1.42 132.00 140.88 3mi6 h PRO 454 Ca -0.25 -0.05 0.14 0.00 0.11 0.00 0.00 66.00 65.95 3mi6 h PRO 454 Cb 1.10 -0.20 -0.10 0.00 0.11 0.00 0.00 31.00 31.92 3mi6 h PRO 454 CO 0.89 0.58 0.28 1.05 -0.21 0.00 0.00 178.00 180.59 3mi6 h GLU 455 N 0.90 0.40 -0.61 1.05 9.09 -1.96 0.10 114.58 123.55 3mi6 h GLU 455 Ca 0.35 -0.02 -0.04 0.00 0.05 0.00 0.00 59.36 59.70 3mi6 h GLU 455 Cb 0.15 -0.09 -0.03 0.00 -1.65 0.00 0.00 28.75 27.14 3mi6 h GLU 455 CO -0.17 0.27 0.23 0.28 0.05 0.00 0.00 179.01 179.67 3mi6 h VAL 456 N 0.41 1.22 -0.51 -1.06 2.07 -1.58 0.10 116.25 116.90 3mi6 h VAL 456 Ca 0.41 -0.71 -0.10 0.00 0.82 0.00 0.00 66.70 67.12 3mi6 h VAL 456 Cb 0.62 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 3mi6 h VAL 456 CO -0.41 0.28 -0.06 0.58 0.02 0.00 0.00 177.57 177.97 3mi6 h VAL 457 N 0.88 1.26 -0.53 2.57 2.07 -0.50 -2.16 116.25 119.83 3mi6 h VAL 457 Ca 0.21 -1.17 -0.09 0.00 0.82 0.00 0.00 66.70 66.47 3mi6 h VAL 457 Cb 0.19 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 3mi6 h VAL 457 CO -0.02 0.41 -0.02 0.44 0.02 0.00 0.00 177.57 178.40 3mi6 h ASP 458 N 0.83 0.94 -0.71 0.57 3.32 -0.31 0.72 116.42 121.79 3mi6 h ASP 458 Ca 0.14 -0.32 -0.04 0.00 0.02 0.00 0.00 57.03 56.83 3mi6 h ASP 458 Cb 0.58 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 3mi6 h ASP 458 CO 0.04 1.03 0.27 0.22 -1.72 0.00 0.00 179.24 179.08 3mi6 h TYR 459 N 0.83 1.08 -0.35 4.55 3.20 -0.91 -1.88 116.97 123.49 3mi6 h TYR 459 Ca 0.15 -0.09 -0.16 0.00 3.14 0.00 0.00 58.73 61.77 3mi6 h TYR 459 Cb 0.56 -0.32 -0.00 0.00 1.54 0.00 0.00 36.73 38.50 3mi6 h TYR 459 CO 0.04 0.84 -0.40 -0.07 -1.64 0.00 0.00 178.16 176.93 3mi6 h LEU 460 N 1.01 0.97 -1.81 2.82 3.38 -1.15 -2.51 115.31 118.02 3mi6 h LEU 460 Ca 0.23 -0.48 -0.00 0.00 0.09 0.00 0.00 57.88 57.72 3mi6 h LEU 460 Cb 0.22 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3mi6 h LEU 460 CO -0.02 1.25 0.07 0.15 0.09 0.00 0.00 178.44 179.99 3mi6 h PHE 461 N 0.70 0.19 -0.10 1.13 3.57 -0.70 -2.81 116.94 118.93 3mi6 h PHE 461 Ca 0.05 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.50 3mi6 h PHE 461 Cb 1.00 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.68 3mi6 h PHE 461 CO 0.07 0.14 -0.14 -0.22 -2.23 0.00 0.00 178.31 175.93 3mi6 h LYS 462 N 0.20 0.27 -0.07 1.11 1.63 -1.14 -0.72 116.57 117.84 3mi6 h LYS 462 Ca 0.05 -0.16 0.00 0.00 -0.85 0.00 0.00 60.65 59.70 3mi6 h LYS 462 Cb 0.02 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 31.66 3mi6 h LYS 462 CO -0.01 0.72 0.00 1.28 -3.45 0.00 0.00 179.45 177.99 3mi6 n LEU 463 N -4.60 0.07 0.00 5.20 4.77 -0.96 -1.13 117.00 120.35 3mi6 n LEU 463 Ca -0.07 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 3mi6 n LEU 463 Cb 0.36 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 3mi6 n LEU 463 CO 0.38 0.02 0.00 -1.20 -1.33 0.00 0.00 177.39 175.26 3mi6 n SER 465 N -0.04 0.00 -0.36 -1.43 7.64 -0.28 -4.66 113.62 114.49 3mi6 n SER 465 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 3mi6 n SER 465 Cb 0.02 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 3mi6 n SER 465 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3mi6 n GLN 466 N 0.00 0.00 0.00 1.43 6.02 -0.28 -1.51 117.38 123.04 3mi6 n GLN 466 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3mi6 n GLN 466 Cb 0.00 -0.87 0.00 0.00 1.02 0.00 0.00 30.24 30.39 3mi6 n GLN 466 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 3mi6 n ILE 468 N 0.14 0.00 -0.03 5.09 5.41 -1.26 -0.11 119.36 128.59 3mi6 n ILE 468 Ca 0.00 0.00 -0.15 0.00 1.00 0.00 0.00 62.75 63.60 3mi6 n ILE 468 Cb 0.00 0.00 -0.09 0.00 -0.71 0.00 0.00 39.64 38.84 3mi6 n ILE 468 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 3mi6 h GLU 469 N 0.00 0.39 -0.78 0.38 5.08 -1.68 -1.42 114.58 116.56 3mi6 h GLU 469 Ca 0.00 -0.30 0.11 0.00 -1.00 0.00 0.00 59.36 58.17 3mi6 h GLU 469 Cb 0.00 0.06 -0.08 0.00 0.50 0.00 0.00 28.75 29.23 3mi6 h GLU 469 CO 0.00 0.93 0.40 1.03 -1.00 0.00 0.00 179.01 180.37 3mi6 h SER 470 N -0.06 0.51 -0.02 1.42 0.87 -0.75 -3.10 113.55 112.42 3mi6 h SER 470 Ca -0.02 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 3mi6 h SER 470 Cb 0.98 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.93 3mi6 h SER 470 CO 0.07 0.26 -0.11 0.00 -0.53 0.00 0.00 176.83 176.52 3mi6 n ALA 471 N -2.42 2.70 -3.42 6.23 0.00 -1.24 -4.62 120.51 117.73 3mi6 n ALA 471 Ca 0.14 -0.58 -0.25 0.00 0.00 0.00 0.00 53.44 52.75 3mi6 n ALA 471 Cb 0.33 -0.51 0.04 0.00 0.00 0.00 0.00 19.45 19.32 3mi6 n ALA 471 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3mi6 n ASN 472 N 0.48 -5.68 -4.56 0.00 3.02 -0.55 -4.84 115.26 103.13 3mi6 n ASN 472 Ca 0.08 -0.48 -0.45 0.00 -0.03 0.00 0.00 54.58 53.70 3mi6 n ASN 472 Cb 0.35 -4.54 -0.02 0.00 -0.61 0.00 0.00 39.78 34.96 3mi6 n ASN 472 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3mi6 n LEU 473 N -4.44 1.28 -0.00 3.41 4.77 -1.11 -4.86 117.00 116.05 3mi6 n LEU 473 Ca -0.03 1.17 0.08 0.00 -0.03 0.00 0.00 56.01 57.20 3mi6 n LEU 473 Cb 0.57 -1.23 -0.11 0.00 -2.33 0.00 0.00 43.42 40.33 3mi6 n LEU 473 CO 0.59 -1.65 -0.18 0.47 -1.33 0.00 0.00 177.39 175.29 3mi6 n ASP 474 N 1.41 0.84 -3.50 -1.43 8.00 0.22 -4.81 116.55 117.28 3mi6 n ASP 474 Ca 0.11 -0.72 -0.15 0.00 0.71 0.00 0.00 54.79 54.74 3mi6 n ASP 474 Cb 0.30 1.17 -0.05 0.00 -0.02 0.00 0.00 41.12 42.52 3mi6 n ASP 474 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3mi6 s TYR 475 N -2.75 -0.59 -0.07 1.24 6.14 -1.12 -1.90 117.35 118.30 3mi6 s TYR 475 Ca 0.04 0.83 -0.03 0.00 0.64 0.00 0.00 57.07 58.54 3mi6 s TYR 475 Cb 0.13 0.46 0.04 0.00 0.42 0.00 0.00 41.96 43.01 3mi6 s TYR 475 CO 0.71 -0.65 0.15 0.42 0.64 0.00 0.00 175.55 176.83 3mi6 s ILE 476 N -1.97 -0.08 -0.26 3.14 1.01 -0.36 -2.46 121.20 120.22 3mi6 s ILE 476 Ca -0.06 0.20 -0.13 0.00 0.00 0.00 0.00 60.65 60.66 3mi6 s ILE 476 Cb -0.00 -0.26 -0.04 0.00 0.01 0.00 0.00 42.46 42.17 3mi6 s ILE 476 CO 0.02 0.08 0.29 -0.75 0.00 0.00 0.00 174.94 174.59 3mi6 s LYS 477 N 1.33 4.02 -0.57 2.79 2.20 0.28 -1.17 119.74 128.62 3mi6 s LYS 477 Ca -0.08 -0.10 -0.03 0.00 -0.36 0.00 0.00 55.97 55.40 3mi6 s LYS 477 Cb -0.12 -3.63 0.15 0.00 -1.51 0.00 0.00 37.83 32.72 3mi6 s LYS 477 CO -0.06 -0.18 0.38 -0.46 -0.36 0.00 0.00 175.35 174.67 3mi6 s TRP 478 N 1.78 3.46 0.00 4.03 -0.11 -0.34 -0.19 118.94 127.57 3mi6 s TRP 478 Ca 0.12 -2.60 0.00 0.00 1.22 0.00 0.00 56.10 54.84 3mi6 s TRP 478 Cb -0.15 -3.23 0.00 0.00 -1.50 0.00 0.00 33.47 28.59 3mi6 s TRP 478 CO 0.09 -0.88 0.00 -3.47 -4.62 0.00 0.00 176.95 168.07 3mi6 n ASP 479 N 3.82 0.00 -0.05 5.86 -0.08 0.42 -1.68 116.55 124.84 3mi6 n ASP 479 Ca 0.05 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.33 3mi6 n ASP 479 Cb 0.39 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.85 3mi6 n ASP 479 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 3mi6 n ASN 481 N 0.00 0.00 -4.03 1.67 4.13 -1.26 -4.48 115.26 111.29 3mi6 n ASN 481 Ca 0.00 -0.56 -0.10 0.00 1.68 0.00 0.00 54.58 55.60 3mi6 n ASN 481 Cb 0.00 0.00 -0.07 0.00 -1.54 0.00 0.00 39.78 38.17 3mi6 n ASN 481 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3mi6 s ARG 482 N 0.00 1.37 -0.23 3.52 1.70 -1.26 -4.77 118.95 119.28 3mi6 s ARG 482 Ca 0.00 -1.32 -0.09 0.00 -0.47 0.00 0.00 55.73 53.86 3mi6 s ARG 482 Cb 0.00 0.40 -0.04 0.00 -0.57 0.00 0.00 34.95 34.74 3mi6 s ARG 482 CO 0.00 -0.53 0.10 0.71 -1.08 0.00 0.00 175.30 174.50 3mi6 s TYR 483 N -4.04 3.20 0.72 5.89 2.02 -1.26 -5.09 117.35 118.80 3mi6 s TYR 483 Ca 0.25 -0.05 -0.16 0.00 -0.37 0.00 0.00 57.07 56.74 3mi6 s TYR 483 Cb 0.02 -2.22 -0.05 0.00 -0.40 0.00 0.00 41.96 39.31 3mi6 s TYR 483 CO 0.07 -0.08 0.40 0.00 -1.57 0.00 0.00 175.55 174.37 3mi6 n ALA 484 N 4.38 -1.87 -3.09 3.71 0.00 -1.26 -4.98 120.51 117.40 3mi6 n ALA 484 Ca -0.16 -0.25 -0.12 0.00 0.00 0.00 0.00 53.44 52.91 3mi6 n ALA 484 Cb 0.52 -1.78 -0.11 0.00 0.00 0.00 0.00 19.45 18.08 3mi6 n ALA 484 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3mi6 s THR 485 N -1.93 0.05 0.22 0.00 2.01 -1.26 -5.02 115.64 109.71 3mi6 s THR 485 Ca 0.63 -0.44 0.00 0.00 0.31 0.00 0.00 61.69 62.19 3mi6 s THR 485 Cb -0.35 -0.37 0.00 0.00 0.01 0.00 0.00 72.50 71.79 3mi6 s THR 485 CO 0.60 -0.24 0.00 -0.62 -0.69 0.00 0.00 174.62 173.67 3mi6 n GLU 486 N 1.99 -1.43 0.00 4.92 4.71 -1.26 -4.78 120.64 124.79 3mi6 n GLU 486 Ca -0.19 1.07 0.00 0.00 -0.01 0.00 0.00 57.16 58.03 3mi6 n GLU 486 Cb 0.57 -1.98 0.00 0.00 -1.01 0.00 0.00 31.44 29.01 3mi6 n GLU 486 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 3mi6 n PHE 488 N -3.04 0.00 -4.66 -0.32 -0.00 -1.26 -2.57 117.46 105.61 3mi6 n PHE 488 Ca -0.02 0.00 -0.25 0.00 -0.00 0.00 0.00 57.45 57.19 3mi6 n PHE 488 Cb 0.58 0.00 -0.16 0.00 -0.00 0.00 0.00 39.48 39.90 3mi6 n PHE 488 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 3mi6 s SER 489 N 0.00 1.85 0.41 -2.13 0.15 -1.26 -2.92 113.70 109.80 3mi6 s SER 489 Ca 0.00 -0.31 0.22 0.00 0.70 0.00 0.00 55.95 56.57 3mi6 s SER 489 Cb 0.00 -0.70 0.43 0.00 -1.71 0.00 0.00 66.02 64.04 3mi6 s SER 489 CO 0.00 0.08 1.63 0.77 1.20 0.00 0.00 173.24 176.92 3mi6 h SER 490 N 6.65 0.00 0.21 5.45 4.64 -1.90 -3.15 113.55 125.44 3mi6 h SER 490 Ca -0.31 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 60.92 3mi6 h SER 490 Cb 1.18 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 3mi6 h SER 490 CO 0.48 0.14 -0.34 -0.09 -0.87 0.00 0.00 176.83 176.14 3mi6 h ARG 491 N 0.00 0.21 -6.45 4.77 2.43 -1.95 -3.44 114.38 109.94 3mi6 h ARG 491 Ca -0.00 -0.08 -0.54 0.00 -0.81 0.00 0.00 59.98 58.55 3mi6 h ARG 491 Cb 1.02 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.53 3mi6 h ARG 491 CO 0.02 0.53 0.06 -0.51 -1.51 0.00 0.00 179.97 178.55 3mi6 s LEU 492 N -8.35 4.42 1.14 3.80 1.43 -1.19 -5.07 118.68 114.85 3mi6 s LEU 492 Ca -0.04 1.36 -0.16 0.00 -1.03 0.00 0.00 54.13 54.25 3mi6 s LEU 492 Cb 0.14 -3.35 0.17 0.00 0.03 0.00 0.00 46.19 43.18 3mi6 s LEU 492 CO 0.76 0.12 0.37 0.41 0.23 0.00 0.00 176.35 178.24 3mi6 n THR 493 N 1.07 0.00 -0.01 5.49 -1.04 -1.26 -4.83 114.28 113.69 3mi6 n THR 493 Ca -0.05 -0.35 -0.08 0.00 -2.04 0.00 0.00 64.05 61.52 3mi6 n THR 493 Cb 0.51 -0.74 0.08 0.00 -1.82 0.00 0.00 70.33 68.35 3mi6 n THR 493 CO 0.00 0.00 0.00 -1.28 -0.64 0.00 0.00 175.07 173.15 3mi6 h SER 494 N -2.29 0.63 0.57 8.00 0.87 -1.97 -2.38 113.55 116.98 3mi6 h SER 494 Ca -0.56 -0.30 0.00 0.00 -1.23 0.00 0.00 61.79 59.69 3mi6 h SER 494 Cb 1.35 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 63.13 3mi6 h SER 494 CO 0.42 1.00 0.00 0.47 -0.53 0.00 0.00 176.83 178.19 3mi6 n ASP 495 N -4.00 0.29 -0.46 6.23 9.92 -1.26 -3.28 116.55 123.98 3mi6 n ASP 495 Ca -0.02 0.57 0.10 0.00 -0.53 0.00 0.00 54.79 54.91 3mi6 n ASP 495 Cb 0.55 -0.63 -0.00 0.00 -0.64 0.00 0.00 41.12 40.40 3mi6 n ASP 495 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3mi6 n GLN 496 N -1.82 1.44 -0.35 -1.24 6.02 -0.90 -4.61 117.38 115.92 3mi6 n GLN 496 Ca 0.03 -0.95 0.03 0.00 -0.01 0.00 0.00 57.00 56.10 3mi6 n GLN 496 Cb 0.19 -1.39 0.19 0.00 1.02 0.00 0.00 30.24 30.25 3mi6 n GLN 496 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 3mi6 h GLN 497 N 2.24 1.11 0.00 -1.09 1.08 -1.53 0.25 115.11 117.16 3mi6 h GLN 497 Ca 0.00 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.13 3mi6 h GLN 497 Cb 0.67 -0.25 0.00 0.00 -0.05 0.00 0.00 27.48 27.85 3mi6 h GLN 497 CO 0.00 0.73 0.00 1.28 -0.95 0.00 0.00 178.83 179.89 3mi6 n LEU 498 N -4.49 0.00 -0.18 1.46 4.77 -1.26 -1.27 117.00 116.02 3mi6 n LEU 498 Ca 0.15 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.25 3mi6 n LEU 498 Cb 0.18 0.00 0.24 0.00 -2.33 0.00 0.00 43.42 41.51 3mi6 n LEU 498 CO 0.32 0.00 0.48 -0.62 -1.33 0.00 0.00 177.39 176.24 3mi6 n GLU 499 N -0.96 0.56 0.26 3.23 1.02 0.86 -1.98 120.64 123.62 3mi6 n GLU 499 Ca 0.10 -0.37 -0.14 0.00 -0.02 0.00 0.00 57.16 56.73 3mi6 n GLU 499 Cb 0.05 -1.49 -0.08 0.00 -0.02 0.00 0.00 31.44 29.90 3mi6 n GLU 499 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3mi6 h LEU 500 N 0.90 -0.56 -0.86 -4.62 5.85 -1.26 -1.90 115.31 112.86 3mi6 h LEU 500 Ca 0.00 -0.07 0.19 0.00 0.84 0.00 0.00 57.88 58.84 3mi6 h LEU 500 Cb 0.54 0.15 -0.12 0.00 0.37 0.00 0.00 40.66 41.60 3mi6 h LEU 500 CO 0.00 -0.22 0.36 -0.65 -0.34 0.00 0.00 178.44 177.59 3mi6 h PRO 501 N -0.94 0.41 0.04 5.25 0.11 -1.81 0.54 132.00 135.59 3mi6 h PRO 501 Ca -0.07 -0.02 -0.22 0.00 0.11 0.00 0.00 66.00 65.79 3mi6 h PRO 501 Cb 0.60 -0.09 0.02 0.00 0.11 0.00 0.00 31.00 31.64 3mi6 h PRO 501 CO 0.11 0.27 -0.90 1.25 -0.21 0.00 0.00 178.00 178.52 3mi6 h HIS 502 N 0.42 0.83 -0.32 0.65 -0.00 -1.86 -2.57 115.15 112.30 3mi6 h HIS 502 Ca 0.51 -0.48 0.00 0.00 -0.00 0.00 0.00 60.37 60.41 3mi6 h HIS 502 Cb 0.91 -0.08 -0.02 0.00 -0.00 0.00 0.00 27.41 28.22 3mi6 h HIS 502 CO -0.15 1.32 0.21 0.00 -0.00 0.00 0.00 177.93 179.31 3mi6 h ARG 503 N 0.11 0.42 0.45 5.26 3.08 -0.97 -0.12 114.38 122.62 3mi6 h ARG 503 Ca -0.12 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 59.88 3mi6 h ARG 503 Cb 1.59 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.55 3mi6 h ARG 503 CO 0.17 0.28 -0.22 -0.92 -1.07 0.00 0.00 179.97 178.21 3mi6 h TYR 504 N 0.43 -0.56 -0.72 3.04 5.03 -0.82 -1.50 116.97 121.87 3mi6 h TYR 504 Ca 0.12 -0.01 0.07 0.00 2.58 0.00 0.00 58.73 61.48 3mi6 h TYR 504 Cb -0.05 0.19 -0.06 0.00 1.55 0.00 0.00 36.73 38.36 3mi6 h TYR 504 CO 0.00 -0.26 0.40 0.82 -1.32 0.00 0.00 178.16 177.80 3mi6 h ILE 505 N -0.80 0.96 -0.72 1.81 1.08 -1.17 0.13 117.51 118.81 3mi6 h ILE 505 Ca -0.06 -0.25 0.14 0.00 -0.39 0.00 0.00 64.86 64.29 3mi6 h ILE 505 Cb 0.55 0.17 -0.05 0.00 -3.07 0.00 0.00 36.82 34.42 3mi6 h ILE 505 CO 0.10 0.13 0.48 -0.07 -0.69 0.00 0.00 178.15 178.11 3mi6 h LEU 506 N 0.73 0.39 -0.17 1.44 3.38 -0.93 0.64 115.31 120.79 3mi6 h LEU 506 Ca 0.32 0.02 -0.11 0.00 0.09 0.00 0.00 57.88 58.20 3mi6 h LEU 506 Cb 0.22 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.91 3mi6 h LEU 506 CO -0.20 0.21 -0.32 1.23 0.09 0.00 0.00 178.44 179.46 3mi6 h GLY 507 N 0.42 0.57 -0.07 0.83 0.00 0.26 0.16 103.07 105.24 3mi6 h GLY 507 Ca 0.35 -0.67 0.10 0.00 0.00 0.00 0.00 47.33 47.12 3mi6 h GLY 507 CO -0.11 0.60 -0.16 -2.08 0.00 0.00 0.00 176.54 174.79 3mi6 h VAL 508 N 0.17 0.44 -0.43 4.60 2.07 -0.31 -2.12 116.25 120.67 3mi6 h VAL 508 Ca 0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.52 3mi6 h VAL 508 Cb 0.91 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 3mi6 h VAL 508 CO 0.07 0.00 0.22 1.88 0.02 0.00 0.00 177.57 179.76 3mi6 h TYR 509 N -0.03 0.60 -0.73 1.57 0.05 -0.41 -1.83 116.97 116.19 3mi6 h TYR 509 Ca 0.25 -0.02 0.16 0.00 0.05 0.00 0.00 58.73 59.16 3mi6 h TYR 509 Cb 0.41 -0.19 -0.13 0.00 1.01 0.00 0.00 36.73 37.83 3mi6 h TYR 509 CO -0.46 0.48 -0.07 1.96 -1.05 0.00 0.00 178.16 179.03 3mi6 h GLN 510 N 0.55 0.06 0.34 4.88 1.08 -0.44 0.80 115.11 122.38 3mi6 h GLN 510 Ca 0.15 -0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.33 3mi6 h GLN 510 Cb 0.09 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.51 3mi6 h GLN 510 CO -0.02 0.04 -0.16 1.25 -0.95 0.00 0.00 178.83 178.99 3mi6 h LEU 511 N 0.06 -0.38 -0.67 1.46 6.46 -0.74 0.16 115.31 121.66 3mi6 h LEU 511 Ca 0.38 -0.10 0.07 0.00 -0.12 0.00 0.00 57.88 58.11 3mi6 h LEU 511 Cb 0.64 0.10 -0.06 0.00 -0.73 0.00 0.00 40.66 40.61 3mi6 h LEU 511 CO -0.68 -0.12 0.35 1.88 -0.62 0.00 0.00 178.44 179.25 3mi6 h TYR 512 N -0.65 0.64 0.21 1.25 -1.99 -1.08 -1.00 116.97 114.35 3mi6 h TYR 512 Ca -0.05 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.70 3mi6 h TYR 512 Cb 0.46 -0.19 0.00 0.00 2.00 0.00 0.00 36.73 39.00 3mi6 h TYR 512 CO -0.01 0.28 -0.10 0.00 -0.00 0.00 0.00 178.16 178.34 3mi6 h ALA 513 N 1.37 -0.28 -0.54 3.88 0.00 0.11 -1.54 119.26 122.27 3mi6 h ALA 513 Ca 0.31 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 55.03 3mi6 h ALA 513 Cb 0.25 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3mi6 h ALA 513 CO -0.21 -0.62 -0.06 0.00 0.00 0.00 0.00 179.25 178.36 3mi6 h ARG 514 N -0.34 0.97 -0.25 0.00 3.08 -0.42 -0.68 114.38 116.74 3mi6 h ARG 514 Ca -0.03 -0.32 -0.01 0.00 0.07 0.00 0.00 59.98 59.69 3mi6 h ARG 514 Cb 0.26 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 3mi6 h ARG 514 CO 0.05 0.99 0.12 -0.07 -1.07 0.00 0.00 179.97 179.98 3mi6 h LEU 515 N 0.88 0.32 -1.13 3.04 3.38 -1.13 -1.97 115.31 118.70 3mi6 h LEU 515 Ca 0.15 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 3mi6 h LEU 515 Cb 0.60 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 3mi6 h LEU 515 CO 0.04 0.36 -0.39 0.71 0.09 0.00 0.00 178.44 179.24 3mi6 h THR 516 N 0.27 1.09 -0.16 0.22 1.35 -1.05 0.41 112.91 115.02 3mi6 h THR 516 Ca 0.08 -1.44 -0.02 0.00 -0.55 0.00 0.00 66.41 64.49 3mi6 h THR 516 Cb 0.12 1.82 -0.01 0.00 -1.73 0.00 0.00 68.15 68.35 3mi6 h THR 516 CO -0.01 0.38 0.01 1.56 -0.25 0.00 0.00 175.52 177.21 3mi6 h GLN 517 N 0.00 0.28 0.00 4.72 1.08 -1.03 -2.91 115.11 117.24 3mi6 h GLN 517 Ca -0.00 -0.08 -0.15 0.00 -1.45 0.00 0.00 58.65 56.96 3mi6 h GLN 517 Cb 0.79 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 28.17 3mi6 h GLN 517 CO 0.05 0.48 -0.71 0.00 -0.95 0.00 0.00 178.83 177.70 3mi6 h ALA 518 N 0.79 0.81 -2.06 3.87 0.00 -1.13 -3.37 119.26 118.16 3mi6 h ALA 518 Ca 0.05 -0.65 -0.56 0.00 0.00 0.00 0.00 54.91 53.75 3mi6 h ALA 518 Cb 0.35 -0.11 -0.40 0.00 0.00 0.00 0.00 17.79 17.62 3mi6 h ALA 518 CO 0.01 0.89 -0.97 0.66 0.00 0.00 0.00 179.25 179.83 3mi6 n TYR 519 N -3.67 0.94 0.00 0.00 4.01 0.11 -4.95 117.16 113.62 3mi6 n TYR 519 Ca -0.01 -3.77 0.00 0.00 -0.16 0.00 0.00 57.90 53.96 3mi6 n TYR 519 Cb 0.70 -0.42 0.00 0.00 -0.31 0.00 0.00 39.34 39.31 3mi6 n TYR 519 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 3mi6 n PRO 520 N 1.00 0.00 0.00 -0.72 -0.02 -1.10 -1.25 135.00 132.91 3mi6 n PRO 520 Ca 0.24 0.40 0.09 0.00 -2.02 0.00 0.00 63.50 62.21 3mi6 n PRO 520 Cb 0.51 -1.59 0.04 0.00 -0.02 0.00 0.00 33.50 32.44 3mi6 n PRO 520 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3mi6 n ASN 521 N -1.39 2.12 -4.68 2.55 3.02 -1.26 -4.90 115.26 110.71 3mi6 n ASN 521 Ca 0.00 -1.56 -0.40 0.00 -0.03 0.00 0.00 54.58 52.59 3mi6 n ASN 521 Cb 0.09 0.23 -0.05 0.00 -0.61 0.00 0.00 39.78 39.44 3mi6 n ASN 521 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3mi6 s VAL 522 N -1.75 5.00 -0.13 2.41 1.01 -0.38 -4.91 120.40 121.65 3mi6 s VAL 522 Ca 0.18 1.36 -0.28 0.00 0.00 0.00 0.00 61.98 63.23 3mi6 s VAL 522 Cb 0.14 -4.01 -0.01 0.00 0.00 0.00 0.00 36.38 32.50 3mi6 s VAL 522 CO 0.33 0.13 0.97 -0.22 0.00 0.00 0.00 175.10 176.31 3mi6 s LEU 523 N 1.64 4.22 -0.13 3.92 2.96 -0.80 -4.93 118.68 125.56 3mi6 s LEU 523 Ca 0.33 1.43 -0.07 0.00 -0.22 0.00 0.00 54.13 55.61 3mi6 s LEU 523 Cb -0.16 -3.48 -0.04 0.00 0.50 0.00 0.00 46.19 43.01 3mi6 s LEU 523 CO 0.13 -0.46 0.13 -0.36 -1.32 0.00 0.00 176.35 174.47 3mi6 s PHE 524 N 2.16 3.54 -0.24 5.38 0.40 -1.26 -1.22 117.98 126.73 3mi6 s PHE 524 Ca 0.45 0.48 -0.01 0.00 -0.60 0.00 0.00 56.93 57.26 3mi6 s PHE 524 Cb -0.17 -1.95 0.03 0.00 0.51 0.00 0.00 43.02 41.43 3mi6 s PHE 524 CO 0.15 0.66 -0.09 -2.00 0.70 0.00 0.00 175.22 174.65 3mi6 s GLU 525 N -0.85 2.78 0.53 0.44 2.12 -0.32 -3.92 118.70 119.47 3mi6 s GLU 525 Ca 0.14 -1.01 -0.22 0.00 0.36 0.00 0.00 54.97 54.25 3mi6 s GLU 525 Cb -0.12 -2.92 -0.05 0.00 0.26 0.00 0.00 34.13 31.30 3mi6 s GLU 525 CO 0.03 -0.40 1.27 0.45 -0.54 0.00 0.00 175.26 176.08 3mi6 s SER 526 N 1.29 5.52 -0.17 -1.70 0.15 -0.91 -1.20 113.70 116.68 3mi6 s SER 526 Ca -0.00 2.56 -0.23 0.00 0.70 0.00 0.00 55.95 58.97 3mi6 s SER 526 Cb -0.17 -2.62 0.06 0.00 -1.71 0.00 0.00 66.02 61.59 3mi6 s SER 526 CO -0.06 -1.38 0.61 0.00 1.20 0.00 0.00 173.24 173.62 3mi6 s ALA 528 N -0.18 -0.94 -1.60 0.00 0.00 -1.26 -3.99 121.76 113.79 3mi6 s ALA 528 Ca -0.04 -0.98 -0.10 0.00 0.00 0.00 0.00 51.96 50.85 3mi6 s ALA 528 Cb -0.03 -2.32 0.09 0.00 0.00 0.00 0.00 23.12 20.86 3mi6 s ALA 528 CO 0.03 -2.15 0.48 0.43 0.00 0.00 0.00 175.76 174.55 3mi6 n SER 529 N 3.29 -1.28 -1.77 0.00 7.64 -1.26 -1.02 113.62 119.22 3mi6 n SER 529 Ca 0.19 -1.10 -0.02 0.00 1.01 0.00 0.00 58.87 58.95 3mi6 n SER 529 Cb 0.52 -2.46 0.01 0.00 -1.01 0.00 0.00 64.21 61.27 3mi6 n SER 529 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3mi6 n GLY 530 N -1.79 0.57 2.32 0.23 0.00 -1.26 -4.22 105.19 101.04 3mi6 n GLY 530 Ca -0.13 -0.14 -0.08 0.00 0.00 0.00 0.00 46.02 45.67 3mi6 n GLY 530 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mi6 n GLY 531 N -1.45 -0.07 1.74 -0.02 0.00 -0.63 -3.47 105.19 101.29 3mi6 n GLY 531 Ca -0.01 0.04 0.07 0.00 0.00 0.00 0.00 46.02 46.12 3mi6 n GLY 531 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mi6 n GLY 532 N -1.27 2.81 2.60 -0.02 0.00 -0.19 -4.15 105.19 104.97 3mi6 n GLY 532 Ca -0.07 -0.85 -0.02 0.00 0.00 0.00 0.00 46.02 45.08 3mi6 n GLY 532 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mi6 n ARG 533 N 0.73 1.36 -2.67 1.61 1.74 -1.25 -4.04 116.66 114.15 3mi6 n ARG 533 Ca 0.26 -1.85 -0.43 0.00 -0.77 0.00 0.00 57.85 55.07 3mi6 n ARG 533 Cb 1.06 -0.13 -0.01 0.00 -1.02 0.00 0.00 32.46 32.36 3mi6 n ARG 533 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 3mi6 s PHE 534 N -0.96 2.85 0.12 -1.55 2.19 -1.26 -4.92 117.98 114.46 3mi6 s PHE 534 Ca 0.14 -1.41 -0.11 0.00 0.33 0.00 0.00 56.93 55.88 3mi6 s PHE 534 Cb 0.39 -4.61 0.01 0.00 -1.31 0.00 0.00 43.02 37.49 3mi6 s PHE 534 CO -0.10 -1.75 0.28 0.16 1.83 0.00 0.00 175.22 175.64 3mi6 s ASP 535 N 4.20 -0.00 0.56 6.13 1.47 -1.26 -4.89 116.67 122.88 3mi6 s ASP 535 Ca 0.47 -0.63 0.33 0.00 1.18 0.00 0.00 52.55 53.91 3mi6 s ASP 535 Cb 0.01 0.41 1.66 0.00 -0.34 0.00 0.00 42.92 44.66 3mi6 s ASP 535 CO -0.01 -0.82 2.12 -0.07 0.68 0.00 0.00 175.17 177.06 3mi6 h LEU 536 N 2.57 0.00 -6.51 2.11 3.38 -1.82 -3.46 115.31 111.58 3mi6 h LEU 536 Ca -0.33 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.45 3mi6 h LEU 536 Cb 1.22 0.00 0.05 0.00 0.09 0.00 0.00 40.66 42.02 3mi6 h LEU 536 CO 0.51 0.06 1.00 0.61 0.09 0.00 0.00 178.44 180.71 3mi6 n GLY 537 N -0.57 1.06 0.01 0.83 0.00 -1.26 -4.77 105.19 100.48 3mi6 n GLY 537 Ca -0.01 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.71 3mi6 n GLY 537 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3mi6 n TYR 540 N 5.96 0.00 -0.06 1.61 4.19 -1.26 -4.81 117.16 122.79 3mi6 n TYR 540 Ca 0.15 0.00 -0.20 0.00 3.31 0.00 0.00 57.90 61.15 3mi6 n TYR 540 Cb 0.15 0.00 -0.13 0.00 0.49 0.00 0.00 39.34 39.85 3mi6 n TYR 540 CO 0.00 0.00 0.00 1.88 0.91 0.00 0.00 176.86 179.65 3mi6 h TYR 541 N 0.00 0.15 -3.53 2.98 0.05 -1.88 -2.20 116.97 112.55 3mi6 h TYR 541 Ca 0.00 -0.11 -0.67 0.00 0.05 0.00 0.00 58.73 58.00 3mi6 h TYR 541 Cb 0.00 -0.01 -0.36 0.00 1.01 0.00 0.00 36.73 37.38 3mi6 h TYR 541 CO 0.00 1.45 -0.81 0.00 -1.05 0.00 0.00 178.16 177.74 3mi6 s ALA 542 N -2.38 2.50 -2.00 3.88 0.00 -1.26 -4.78 121.76 117.72 3mi6 s ALA 542 Ca -0.24 -1.54 0.10 0.00 0.00 0.00 0.00 51.96 50.28 3mi6 s ALA 542 Cb 0.04 -1.46 0.59 0.00 0.00 0.00 0.00 23.12 22.29 3mi6 s ALA 542 CO 0.67 -0.85 1.30 -0.35 0.00 0.00 0.00 175.76 176.53 3mi6 n PRO 543 N 4.53 0.91 -3.67 0.00 -0.04 -1.25 -4.71 135.00 130.76 3mi6 n PRO 543 Ca -0.17 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.18 3mi6 n PRO 543 Cb 0.45 -1.17 -0.05 0.00 -0.04 0.00 0.00 33.50 32.69 3mi6 n PRO 543 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 3mi6 s GLN 544 N -2.00 0.99 0.04 0.54 -2.07 -1.26 -5.01 119.66 110.89 3mi6 s GLN 544 Ca 0.15 -0.64 0.03 0.00 -1.82 0.00 0.00 55.36 53.07 3mi6 s GLN 544 Cb 0.07 0.44 -0.02 0.00 -1.09 0.00 0.00 33.01 32.40 3mi6 s GLN 544 CO 0.11 -0.37 -0.09 0.00 -1.32 0.00 0.00 175.29 173.63 3mi6 s ALA 545 N -3.43 0.66 -0.80 2.60 0.00 -1.26 -2.15 121.76 117.39 3mi6 s ALA 545 Ca 0.01 -0.75 -0.25 0.00 0.00 0.00 0.00 51.96 50.97 3mi6 s ALA 545 Cb 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 23.12 23.11 3mi6 s ALA 545 CO -0.09 0.03 1.84 -0.46 0.00 0.00 0.00 175.76 177.08 3mi6 s TRP 546 N -1.23 1.83 0.12 0.00 -0.00 -0.33 -1.09 118.94 118.24 3mi6 s TRP 546 Ca -0.07 0.54 -0.22 0.00 -0.00 0.00 0.00 56.10 56.34 3mi6 s TRP 546 Cb -0.09 -4.14 -0.04 0.00 -0.00 0.00 0.00 33.47 29.19 3mi6 s TRP 546 CO 0.01 -1.98 1.12 2.41 -0.00 0.00 0.00 176.95 178.50 3mi6 n THR 547 N 7.48 -0.49 -3.52 5.86 -1.04 -1.25 -1.60 114.28 119.71 3mi6 n THR 547 Ca 0.30 1.75 -0.17 0.00 -2.04 0.00 0.00 64.05 63.89 3mi6 n THR 547 Cb 0.49 -2.17 -0.06 0.00 -1.82 0.00 0.00 70.33 66.77 3mi6 n THR 547 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 3mi6 s SER 548 N -5.36 -0.63 0.32 8.00 0.15 -1.23 -3.73 113.70 111.23 3mi6 s SER 548 Ca -0.09 0.65 0.26 0.00 0.70 0.00 0.00 55.95 57.48 3mi6 s SER 548 Cb 0.08 0.53 0.93 0.00 -1.71 0.00 0.00 66.02 65.86 3mi6 s SER 548 CO 0.45 -0.62 1.77 0.44 1.20 0.00 0.00 173.24 176.48 3mi6 h ASP 549 N 2.98 0.00 -2.98 5.45 3.32 -1.74 -3.42 116.42 120.03 3mi6 h ASP 549 Ca -0.28 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.21 3mi6 h ASP 549 Cb 1.15 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.66 3mi6 h ASP 549 CO 0.39 0.00 1.08 -0.62 -1.72 0.00 0.00 179.24 178.37 3mi6 s ASP 550 N -4.85 6.43 0.00 6.45 -1.08 -1.26 -4.86 116.67 117.50 3mi6 s ASP 550 Ca 0.06 1.31 0.12 0.00 -0.52 0.00 0.00 52.55 53.52 3mi6 s ASP 550 Cb 0.10 -2.54 0.20 0.00 -1.46 0.00 0.00 42.92 39.22 3mi6 s ASP 550 CO 0.51 -1.27 1.06 0.35 0.52 0.00 0.00 175.17 176.34 3mi6 n THR 551 N 6.55 0.40 -1.96 1.71 -2.24 -1.26 -4.72 114.28 112.75 3mi6 n THR 551 Ca 0.17 -0.70 -0.42 0.00 -2.27 0.00 0.00 64.05 60.83 3mi6 n THR 551 Cb 0.46 0.96 -0.03 0.00 -2.10 0.00 0.00 70.33 69.62 3mi6 n THR 551 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3mi6 s ASP 552 N -1.03 6.63 0.31 3.42 2.15 -1.26 -4.57 116.67 122.31 3mi6 s ASP 552 Ca 0.19 2.50 0.06 0.00 0.43 0.00 0.00 52.55 55.74 3mi6 s ASP 552 Cb 0.12 -2.58 0.74 0.00 -0.30 0.00 0.00 42.92 40.91 3mi6 s ASP 552 CO 0.17 -0.83 1.78 0.00 -0.17 0.00 0.00 175.17 176.11 3mi6 h ALA 553 N 7.59 1.68 0.17 3.66 0.00 -1.93 0.37 119.26 130.79 3mi6 h ALA 553 Ca -0.42 0.08 -0.31 0.00 0.00 0.00 0.00 54.91 54.25 3mi6 h ALA 553 Cb 1.20 -0.09 0.03 0.00 0.00 0.00 0.00 17.79 18.94 3mi6 h ALA 553 CO 0.92 -0.05 -1.33 0.00 0.00 0.00 0.00 179.25 178.78 3mi6 h ALA 554 N 1.64 -0.06 -0.05 0.00 0.00 -1.96 -2.11 119.26 116.71 3mi6 h ALA 554 Ca 0.58 -0.80 -0.10 0.00 0.00 0.00 0.00 54.91 54.59 3mi6 h ALA 554 Cb 0.90 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 3mi6 h ALA 554 CO -0.38 0.69 -0.42 0.93 0.00 0.00 0.00 179.25 180.08 3mi6 h GLU 555 N 0.24 0.11 -0.19 0.00 4.39 -1.86 -2.96 114.58 114.31 3mi6 h GLU 555 Ca -0.21 -0.05 -0.14 0.00 0.34 0.00 0.00 59.36 59.30 3mi6 h GLU 555 Cb 2.01 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.65 3mi6 h GLU 555 CO 0.25 0.51 -0.46 0.00 -1.16 0.00 0.00 179.01 178.15 3mi6 h ARG 556 N 0.10 0.48 -0.73 2.33 2.47 -0.25 -2.52 114.38 116.26 3mi6 h ARG 556 Ca 0.01 -0.26 0.16 0.00 -1.26 0.00 0.00 59.98 58.63 3mi6 h ARG 556 Cb 0.78 0.01 -0.12 0.00 -1.65 0.00 0.00 29.97 28.99 3mi6 h ARG 556 CO 0.06 0.84 0.06 -0.07 0.56 0.00 0.00 179.97 181.42 3mi6 h LEU 557 N 0.38 -0.23 -0.41 3.04 4.07 -1.21 0.34 115.31 121.30 3mi6 h LEU 557 Ca 0.02 0.18 -0.16 0.00 0.08 0.00 0.00 57.88 58.00 3mi6 h LEU 557 Cb 0.96 0.29 -0.02 0.00 1.08 0.00 0.00 40.66 42.97 3mi6 h LEU 557 CO 0.08 -0.13 -0.77 -0.07 -1.08 0.00 0.00 178.44 176.47 3mi6 h LEU 558 N 0.15 0.00 0.13 1.67 4.07 -1.47 -1.94 115.31 117.92 3mi6 h LEU 558 Ca 0.40 0.00 -0.21 0.00 0.08 0.00 0.00 57.88 58.15 3mi6 h LEU 558 Cb 0.70 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.45 3mi6 h LEU 558 CO -0.60 0.77 -0.96 0.40 -1.08 0.00 0.00 178.44 176.97 3mi6 h ILE 559 N 0.00 1.39 -0.29 1.22 2.04 -1.01 -1.66 117.51 119.21 3mi6 h ILE 559 Ca -0.01 -2.50 -0.14 0.00 1.00 0.00 0.00 64.86 63.22 3mi6 h ILE 559 Cb 1.39 3.07 -0.01 0.00 -0.74 0.00 0.00 36.82 40.53 3mi6 h ILE 559 CO 0.10 0.70 -0.39 1.56 0.00 0.00 0.00 178.15 180.13 3mi6 h GLN 560 N -0.38 0.67 -0.59 2.37 4.20 -0.41 -0.27 115.11 120.69 3mi6 h GLN 560 Ca -0.18 -0.34 -0.06 0.00 0.06 0.00 0.00 58.65 58.13 3mi6 h GLN 560 Cb 1.66 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.42 3mi6 h GLN 560 CO 0.12 0.94 0.16 0.35 -0.67 0.00 0.00 178.83 179.73 3mi6 h PHE 561 N 0.55 0.99 -0.19 2.96 3.04 -1.42 -0.43 116.94 122.44 3mi6 h PHE 561 Ca 0.05 -0.11 -0.11 0.00 3.98 0.00 0.00 57.97 61.78 3mi6 h PHE 561 Cb 0.91 -0.28 -0.01 0.00 2.56 0.00 0.00 35.95 39.13 3mi6 h PHE 561 CO 0.04 0.83 -0.35 0.78 -2.02 0.00 0.00 178.31 177.59 3mi6 h GLY 562 N 0.85 0.44 1.80 2.40 0.00 -1.06 -3.25 103.07 104.25 3mi6 h GLY 562 Ca 0.19 -0.40 -0.24 0.00 0.00 0.00 0.00 47.33 46.87 3mi6 h GLY 562 CO -0.00 0.36 -1.13 -0.84 0.00 0.00 0.00 176.54 174.94 3mi6 h THR 563 N 0.35 1.60 -0.03 4.70 2.02 -0.61 -3.05 112.91 117.88 3mi6 h THR 563 Ca 0.04 -3.23 0.01 0.00 0.77 0.00 0.00 66.41 64.00 3mi6 h THR 563 Cb 0.79 2.90 -0.00 0.00 -1.74 0.00 0.00 68.15 70.09 3mi6 h THR 563 CO 0.06 0.93 0.14 0.77 0.37 0.00 0.00 175.52 177.80 3mi6 h SER 564 N 0.04 0.00 -0.32 4.18 4.64 -1.12 0.06 113.55 121.04 3mi6 h SER 564 Ca -0.08 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.29 3mi6 h SER 564 Cb 1.87 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.92 3mi6 h SER 564 CO 0.17 0.00 0.06 1.88 -0.87 0.00 0.00 176.83 178.06 3mi6 h TYR 565 N 0.00 0.09 0.00 4.77 -1.99 -1.66 -3.29 116.97 114.88 3mi6 h TYR 565 Ca 0.02 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.77 3mi6 h TYR 565 Cb 0.30 0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.04 3mi6 h TYR 565 CO 0.00 0.01 -1.41 0.41 -0.00 0.00 0.00 178.16 177.17 3mi6 n GLY 566 N -1.22 -0.80 2.88 3.88 0.00 -0.46 -4.50 105.19 104.97 3mi6 n GLY 566 Ca 0.01 -0.48 -0.13 0.00 0.00 0.00 0.00 46.02 45.42 3mi6 n GLY 566 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3mi6 s TYR 567 N -3.04 -0.04 0.56 1.61 2.02 -0.12 -4.89 117.35 113.44 3mi6 s TYR 567 Ca -0.01 0.18 -0.20 0.00 -0.37 0.00 0.00 57.07 56.67 3mi6 s TYR 567 Cb 0.13 -0.07 -0.04 0.00 -0.40 0.00 0.00 41.96 41.57 3mi6 s TYR 567 CO 0.77 -0.06 1.25 -2.14 -1.57 0.00 0.00 175.55 173.79 3mi6 s PRO 568 N 0.50 3.14 0.59 -1.71 0.02 -1.26 -3.88 135.00 132.39 3mi6 s PRO 568 Ca -0.04 1.94 0.28 0.00 0.02 0.00 0.00 61.00 63.21 3mi6 s PRO 568 Cb -0.06 -2.10 1.61 0.00 0.02 0.00 0.00 34.50 33.97 3mi6 s PRO 568 CO -0.02 -1.11 2.06 -0.56 -0.33 0.00 0.00 177.00 177.04 3mi6 h GLN 569 N 1.24 0.00 -4.67 5.54 -0.00 -1.88 -3.49 115.11 111.84 3mi6 h GLN 569 Ca -0.50 0.00 -0.32 0.00 -0.00 0.00 0.00 58.65 57.83 3mi6 h GLN 569 Cb 1.29 0.00 0.08 0.00 -0.00 0.00 0.00 27.48 28.85 3mi6 h GLN 569 CO 0.56 0.00 1.07 0.00 -0.00 0.00 0.00 178.83 180.46 3mi6 n ALA 570 N -2.35 0.71 -2.38 0.06 0.00 -1.17 -4.01 120.51 111.37 3mi6 n ALA 570 Ca 0.03 -1.52 -0.29 0.00 0.00 0.00 0.00 53.44 51.66 3mi6 n ALA 570 Cb 0.40 -2.68 -0.14 0.00 0.00 0.00 0.00 19.45 17.03 3mi6 n ALA 570 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3mi6 s GLY 573 N 5.55 1.46 -0.15 0.00 0.00 -0.25 -4.70 107.32 109.24 3mi6 s GLY 573 Ca 0.37 -1.35 -0.06 0.00 0.00 0.00 0.00 44.72 43.68 3mi6 s GLY 573 CO 0.19 -1.29 0.31 0.00 0.00 0.00 0.00 173.10 172.31 3mi6 s ALA 574 N -0.94 -0.75 -0.07 3.20 0.00 -0.88 -3.92 121.76 118.39 3mi6 s ALA 574 Ca 0.12 1.13 0.04 0.00 0.00 0.00 0.00 51.96 53.25 3mi6 s ALA 574 Cb -0.10 -1.09 -0.02 0.00 0.00 0.00 0.00 23.12 21.91 3mi6 s ALA 574 CO 0.04 -0.64 -0.19 -1.01 0.00 0.00 0.00 175.76 173.96 3mi6 s HIS 575 N 2.39 2.61 -0.00 0.00 3.76 -1.26 -2.09 115.29 120.70 3mi6 s HIS 575 Ca -0.01 -0.55 -0.30 0.00 -0.15 0.00 0.00 55.06 54.05 3mi6 s HIS 575 Cb -0.12 -1.67 -0.06 0.00 1.11 0.00 0.00 32.58 31.84 3mi6 s HIS 575 CO -0.10 -0.11 1.42 0.08 -0.85 0.00 0.00 174.74 175.18 3mi6 s VAL 576 N -0.18 3.68 0.41 -0.90 1.01 -0.47 -4.89 120.40 119.06 3mi6 s VAL 576 Ca -0.02 1.06 0.04 0.00 0.00 0.00 0.00 61.98 63.06 3mi6 s VAL 576 Cb -0.14 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 3mi6 s VAL 576 CO 0.03 -0.01 0.06 -0.94 0.00 0.00 0.00 175.10 174.25 3mi6 s SER 577 N 1.95 3.14 0.53 3.32 1.04 -1.26 -1.67 113.70 120.74 3mi6 s SER 577 Ca 0.64 -1.54 -0.19 0.00 0.48 0.00 0.00 55.95 55.35 3mi6 s SER 577 Cb -0.32 0.20 -0.07 0.00 0.10 0.00 0.00 66.02 65.94 3mi6 s SER 577 CO 0.27 -0.74 1.06 0.00 0.98 0.00 0.00 173.24 174.80 3mi6 s ALA 578 N -3.09 2.81 0.03 5.32 0.00 -1.26 -4.98 121.76 120.59 3mi6 s ALA 578 Ca 0.25 0.56 0.07 0.00 0.00 0.00 0.00 51.96 52.84 3mi6 s ALA 578 Cb 0.05 -3.26 -0.02 0.00 0.00 0.00 0.00 23.12 19.89 3mi6 s ALA 578 CO 0.13 -0.53 -0.19 0.08 0.00 0.00 0.00 175.76 175.24 3mi6 s VAL 579 N -2.11 1.53 0.20 0.00 1.01 -1.26 -3.41 120.40 116.37 3mi6 s VAL 579 Ca 0.67 -1.06 -0.31 0.00 0.00 0.00 0.00 61.98 61.29 3mi6 s VAL 579 Cb -0.17 -1.32 -0.10 0.00 0.00 0.00 0.00 36.38 34.79 3mi6 s VAL 579 CO 0.26 0.24 1.44 -2.16 0.00 0.00 0.00 175.10 174.89 3mi6 s PRO 580 N -0.96 4.28 -0.13 2.72 0.04 -1.26 -5.07 135.00 134.62 3mi6 s PRO 580 Ca 0.07 2.25 -0.40 0.00 0.04 0.00 0.00 61.00 62.95 3mi6 s PRO 580 Cb -0.08 -3.15 -0.19 0.00 0.04 0.00 0.00 34.50 31.12 3mi6 s PRO 580 CO 0.01 -0.44 1.16 -1.71 0.04 0.00 0.00 177.00 176.06 3mi6 n ASN 581 N 2.99 0.32 0.09 6.66 2.85 -0.21 -4.76 115.26 123.20 3mi6 n ASN 581 Ca 0.09 1.11 0.04 0.00 -0.11 0.00 0.00 54.58 55.71 3mi6 n ASN 581 Cb 0.40 -0.87 0.44 0.00 1.24 0.00 0.00 39.78 41.00 3mi6 n ASN 581 CO 0.00 0.00 0.00 0.44 -2.11 0.00 0.00 177.26 175.59 3mi6 h ASP 582 N 3.39 0.29 1.11 1.20 3.32 -1.92 -0.13 116.42 123.68 3mi6 h ASP 582 Ca -0.47 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.55 3mi6 h ASP 582 Cb 1.35 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.82 3mi6 h ASP 582 CO 0.71 0.31 -0.11 0.00 -1.72 0.00 0.00 179.24 178.43 3mi6 n GLN 583 N -4.39 0.12 -0.30 3.56 3.00 -1.26 -5.10 117.38 113.01 3mi6 n GLN 583 Ca 0.00 0.09 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 3mi6 n GLN 583 Cb 0.16 -1.63 0.00 0.00 0.00 0.00 0.00 30.24 28.77 3mi6 n GLN 583 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3mi6 n GLY 585 N 1.42 0.91 3.79 1.08 0.00 -0.06 -5.17 105.19 107.15 3mi6 n GLY 585 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 3mi6 n GLY 585 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3mi6 s ARG 586 N 0.00 4.49 -0.25 1.61 3.52 -1.26 -4.54 118.95 122.53 3mi6 s ARG 586 Ca 0.00 1.26 -0.08 0.00 -0.13 0.00 0.00 55.73 56.78 3mi6 s ARG 586 Cb 0.00 -2.68 -0.03 0.00 -1.56 0.00 0.00 34.95 30.68 3mi6 s ARG 586 CO 0.00 0.22 0.08 0.42 -0.81 0.00 0.00 175.30 175.21 3mi6 s ILE 587 N -1.73 4.42 0.26 4.11 1.01 -1.26 -1.04 121.20 126.98 3mi6 s ILE 587 Ca 0.52 -0.13 0.11 0.00 0.00 0.00 0.00 60.65 61.15 3mi6 s ILE 587 Cb -0.17 -3.07 -0.05 0.00 0.01 0.00 0.00 42.46 39.19 3mi6 s ILE 587 CO 0.21 0.34 -0.16 -0.89 0.00 0.00 0.00 174.94 174.44 3mi6 s THR 588 N 1.58 2.70 0.40 2.92 2.01 -1.26 -4.99 115.64 118.99 3mi6 s THR 588 Ca 0.06 -2.24 -0.25 0.00 0.31 0.00 0.00 61.69 59.57 3mi6 s THR 588 Cb -0.15 -2.41 -0.08 0.00 0.01 0.00 0.00 72.50 69.87 3mi6 s THR 588 CO 0.04 -0.36 1.15 -0.94 -0.69 0.00 0.00 174.62 173.83 3mi6 s SER 589 N -3.44 6.55 0.50 3.53 1.04 -1.26 -4.92 113.70 115.70 3mi6 s SER 589 Ca 0.29 2.30 0.17 0.00 0.48 0.00 0.00 55.95 59.19 3mi6 s SER 589 Cb -0.06 -2.61 1.22 0.00 0.10 0.00 0.00 66.02 64.68 3mi6 s SER 589 CO 0.16 -0.66 2.08 0.25 0.98 0.00 0.00 173.24 176.05 3mi6 h LEU 590 N 2.61 0.10 -0.40 2.42 5.85 -1.99 -1.80 115.31 122.10 3mi6 h LEU 590 Ca -0.49 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.22 3mi6 h LEU 590 Cb 1.23 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.22 3mi6 h LEU 590 CO 0.62 0.07 0.21 0.50 -0.34 0.00 0.00 178.44 179.50 3mi6 h LYS 591 N 0.12 0.56 -0.04 1.25 3.64 -1.99 -2.44 116.57 117.66 3mi6 h LYS 591 Ca 0.12 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 3mi6 h LYS 591 Cb 0.33 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.04 3mi6 h LYS 591 CO -0.01 0.47 -0.06 1.15 -2.27 0.00 0.00 179.45 178.72 3mi6 h THR 592 N 0.51 1.40 -0.86 1.00 2.02 -1.70 -1.04 112.91 114.24 3mi6 h THR 592 Ca 0.14 -1.28 0.13 0.00 0.77 0.00 0.00 66.41 66.17 3mi6 h THR 592 Cb 0.08 2.15 -0.09 0.00 -1.74 0.00 0.00 68.15 68.56 3mi6 h THR 592 CO -0.02 0.35 0.47 0.03 0.37 0.00 0.00 175.52 176.72 3mi6 h ARG 593 N -0.36 0.70 0.73 6.66 3.08 -1.36 -0.51 114.38 123.32 3mi6 h ARG 593 Ca 0.01 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 3mi6 h ARG 593 Cb 0.59 -0.16 0.01 0.00 0.08 0.00 0.00 29.97 30.49 3mi6 h ARG 593 CO 0.01 0.46 -0.35 0.78 -1.07 0.00 0.00 179.97 179.81 3mi6 h GLY 594 N 0.72 -1.03 -0.41 0.04 0.00 -1.45 -2.90 103.07 98.04 3mi6 h GLY 594 Ca 0.45 0.38 0.33 0.00 0.00 0.00 0.00 47.33 48.49 3mi6 h GLY 594 CO -0.31 -0.37 0.80 0.00 0.00 0.00 0.00 176.54 176.65 3mi6 h ALA 595 N -1.31 2.74 -0.05 3.60 0.00 -0.72 0.48 119.26 124.01 3mi6 h ALA 595 Ca -0.10 0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.66 3mi6 h ALA 595 Cb 0.75 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 3mi6 h ALA 595 CO 0.17 -1.15 -0.69 0.28 0.00 0.00 0.00 179.25 177.85 3mi6 h VAL 596 N 0.17 1.42 0.00 0.00 2.07 -1.11 -3.25 116.25 115.55 3mi6 h VAL 596 Ca 0.62 -2.19 0.00 0.00 0.82 0.00 0.00 66.70 65.95 3mi6 h VAL 596 Cb 2.04 2.15 0.00 0.00 -1.52 0.00 0.00 31.29 33.96 3mi6 h VAL 596 CO -0.17 0.64 -0.05 0.00 0.02 0.00 0.00 177.57 178.01 3mi6 n ALA 597 N -2.47 2.35 0.01 1.67 0.00 0.16 -3.66 120.51 118.58 3mi6 n ALA 597 Ca -0.03 -0.06 -0.01 0.00 0.00 0.00 0.00 53.44 53.35 3mi6 n ALA 597 Cb 0.68 -1.45 0.27 0.00 0.00 0.00 0.00 19.45 18.95 3mi6 n ALA 597 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 3mi6 h PHE 598 N 0.00 0.52 -0.88 0.00 0.04 -1.42 -3.24 116.94 111.96 3mi6 h PHE 598 Ca 0.00 -0.07 -0.65 0.00 2.80 0.00 0.00 57.97 60.05 3mi6 h PHE 598 Cb 0.69 -0.14 -0.11 0.00 2.20 0.00 0.00 35.95 38.59 3mi6 h PHE 598 CO 0.00 0.58 2.12 1.19 -0.60 0.00 0.00 178.31 181.60 3mi6 n PHE 599 N -4.23 2.24 -2.43 -0.55 3.01 -1.24 -4.68 117.46 109.58 3mi6 n PHE 599 Ca 0.01 -2.63 0.00 0.00 1.01 0.00 0.00 57.45 55.84 3mi6 n PHE 599 Cb 0.30 -1.85 0.00 0.00 -0.01 0.00 0.00 39.48 37.92 3mi6 n PHE 599 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3mi6 n GLY 600 N 1.91 -0.60 3.35 1.37 0.00 -1.22 -4.83 105.19 105.17 3mi6 n GLY 600 Ca 0.62 -0.57 -0.46 0.00 0.00 0.00 0.00 46.02 45.61 3mi6 n GLY 600 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3mi6 s ASP 601 N -4.00 6.54 0.52 1.61 1.01 -1.26 -4.64 116.67 116.46 3mi6 s ASP 601 Ca 0.00 -2.22 -0.20 0.00 0.71 0.00 0.00 52.55 50.84 3mi6 s ASP 601 Cb 0.00 -2.25 -0.08 0.00 1.01 0.00 0.00 42.92 41.59 3mi6 s ASP 601 CO 0.00 -0.79 0.78 -0.11 0.21 0.00 0.00 175.17 175.25 3mi6 n LEU 602 N 5.00 2.00 -3.61 1.23 7.94 -1.25 -2.07 117.00 126.24 3mi6 n LEU 602 Ca 0.06 0.85 -0.03 0.00 -1.11 0.00 0.00 56.01 55.78 3mi6 n LEU 602 Cb 0.45 -1.27 -0.01 0.00 0.53 0.00 0.00 43.42 43.11 3mi6 n LEU 602 CO 0.44 -2.29 0.94 -0.83 -1.11 0.00 0.00 177.39 174.54 3mi6 s GLY 603 N -1.06 -0.35 0.03 -3.96 0.00 -0.89 -3.82 107.32 97.28 3mi6 s GLY 603 Ca 0.69 1.08 0.07 0.00 0.00 0.00 0.00 44.72 46.56 3mi6 s GLY 603 CO 0.53 0.32 -0.21 -0.19 0.00 0.00 0.00 173.10 173.56 3mi6 s TYR 604 N -2.63 1.83 -0.37 1.90 2.02 0.18 -1.36 117.35 118.92 3mi6 s TYR 604 Ca 0.10 -0.37 0.13 0.00 -0.37 0.00 0.00 57.07 56.57 3mi6 s TYR 604 Cb 0.01 -1.12 0.39 0.00 -0.40 0.00 0.00 41.96 40.84 3mi6 s TYR 604 CO -0.04 0.06 0.92 -1.91 -1.57 0.00 0.00 175.55 173.01 3mi6 n GLU 605 N 2.04 1.06 -3.88 -0.62 2.13 -0.67 -0.59 120.64 120.11 3mi6 n GLU 605 Ca -0.17 -2.98 -0.09 0.00 0.66 0.00 0.00 57.16 54.58 3mi6 n GLU 605 Cb 0.53 -1.28 -0.05 0.00 0.27 0.00 0.00 31.44 30.91 3mi6 n GLU 605 CO 0.00 0.00 0.00 -0.48 -0.41 0.00 0.00 177.13 176.24 3mi6 s LEU 606 N -2.73 0.31 -0.51 4.31 2.34 -1.26 -4.14 118.68 116.99 3mi6 s LEU 606 Ca 0.31 -0.72 -0.28 0.00 0.06 0.00 0.00 54.13 53.50 3mi6 s LEU 606 Cb 0.39 1.86 0.01 0.00 -0.56 0.00 0.00 46.19 47.89 3mi6 s LEU 606 CO -0.04 -1.07 1.41 -0.62 -1.06 0.00 0.00 176.35 174.97 3mi6 s ASP 607 N -2.95 6.20 0.12 1.48 2.15 -1.26 -4.81 116.67 117.60 3mi6 s ASP 607 Ca 0.16 0.45 0.26 0.00 0.43 0.00 0.00 52.55 53.85 3mi6 s ASP 607 Cb -0.00 -2.54 0.71 0.00 -0.30 0.00 0.00 42.92 40.79 3mi6 s ASP 607 CO 0.03 -1.62 1.63 2.30 -0.17 0.00 0.00 175.17 177.34 3mi6 n ILE 608 N 6.93 0.36 0.20 4.11 -5.35 -1.26 -3.15 119.36 121.20 3mi6 n ILE 608 Ca 0.14 -0.20 0.06 0.00 -0.27 0.00 0.00 62.75 62.47 3mi6 n ILE 608 Cb 0.49 -0.35 0.42 0.00 -1.74 0.00 0.00 39.64 38.46 3mi6 n ILE 608 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 3mi6 h THR 609 N 0.00 0.96 -0.36 7.28 1.35 -1.91 -3.48 112.91 116.75 3mi6 h THR 609 Ca 0.00 -1.27 -0.71 0.00 -0.55 0.00 0.00 66.41 63.88 3mi6 h THR 609 Cb 0.67 1.75 -0.05 0.00 -1.73 0.00 0.00 68.15 68.79 3mi6 h THR 609 CO 0.00 0.33 3.09 0.29 -0.25 0.00 0.00 175.52 178.98 3mi6 n LYS 610 N -3.73 3.42 -4.25 4.72 5.02 -1.19 -5.12 118.16 117.03 3mi6 n LYS 610 Ca -0.01 -2.73 -0.24 0.00 -2.02 0.00 0.00 58.31 53.31 3mi6 n LYS 610 Cb 0.43 -3.01 -0.07 0.00 -0.02 0.00 0.00 35.03 32.35 3mi6 n LYS 610 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3mi6 s ALA 612 N 1.95 3.20 0.55 7.82 0.00 -1.26 -5.12 121.76 128.90 3mi6 s ALA 612 Ca 0.53 -1.54 0.23 0.00 0.00 0.00 0.00 51.96 51.18 3mi6 s ALA 612 Cb 0.15 -0.89 1.49 0.00 0.00 0.00 0.00 23.12 23.87 3mi6 s ALA 612 CO -0.07 0.34 2.14 -1.35 0.00 0.00 0.00 175.76 176.82 3mi6 h PRO 613 N 2.13 0.00 -0.14 0.00 0.11 -2.00 -1.37 132.00 130.74 3mi6 h PRO 613 Ca -0.46 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.42 3mi6 h PRO 613 Cb 1.23 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.35 3mi6 h PRO 613 CO 0.59 0.00 -0.81 1.79 -0.21 0.00 0.00 178.00 179.37 3mi6 h THR 614 N 0.00 1.27 -0.02 -1.15 1.35 -2.04 -2.62 112.91 109.71 3mi6 h THR 614 Ca 0.06 -2.00 -0.00 0.00 -0.55 0.00 0.00 66.41 63.92 3mi6 h THR 614 Cb 0.28 2.02 -0.00 0.00 -1.73 0.00 0.00 68.15 68.71 3mi6 h THR 614 CO -0.00 0.63 -0.00 -0.33 -0.25 0.00 0.00 175.52 175.57 3mi6 h GLU 615 N 0.53 0.04 -0.93 4.72 5.08 -1.90 -2.72 114.58 119.39 3mi6 h GLU 615 Ca -0.06 -0.01 0.24 0.00 -1.00 0.00 0.00 59.36 58.53 3mi6 h GLU 615 Cb 1.44 -0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.56 3mi6 h GLU 615 CO 0.17 0.40 0.44 1.25 -1.00 0.00 0.00 179.01 180.27 3mi6 h LEU 616 N -0.33 0.39 -0.77 1.33 5.85 -1.32 0.35 115.31 120.80 3mi6 h LEU 616 Ca 0.00 0.16 -0.09 0.00 0.84 0.00 0.00 57.88 58.80 3mi6 h LEU 616 Cb 0.39 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 3mi6 h LEU 616 CO 0.00 -0.02 -0.43 -0.78 -0.34 0.00 0.00 178.44 176.87 3mi6 h ASP 617 N 0.40 0.00 -0.08 1.25 3.58 -1.33 -2.33 116.42 117.91 3mi6 h ASP 617 Ca 0.61 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 58.01 3mi6 h ASP 617 Cb 1.20 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.25 3mi6 h ASP 617 CO -0.55 0.43 -0.14 -0.61 -2.88 0.00 0.00 179.24 175.50 3mi6 h GLN 618 N 0.00 0.23 -0.50 0.28 4.15 -0.63 -1.37 115.11 117.27 3mi6 h GLN 618 Ca -0.00 -0.14 0.10 0.00 0.77 0.00 0.00 58.65 59.37 3mi6 h GLN 618 Cb 1.00 0.02 -0.10 0.00 0.21 0.00 0.00 27.48 28.61 3mi6 h GLN 618 CO 0.06 0.72 -0.13 0.28 -1.93 0.00 0.00 178.83 177.82 3mi6 h VAL 619 N -0.23 0.49 -0.84 2.39 2.07 -1.35 0.44 116.25 119.23 3mi6 h VAL 619 Ca 0.01 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.60 3mi6 h VAL 619 Cb 0.70 0.49 -0.06 0.00 -1.52 0.00 0.00 31.29 30.90 3mi6 h VAL 619 CO 0.03 0.00 0.51 0.50 0.02 0.00 0.00 177.57 178.63 3mi6 h LYS 620 N -0.01 0.87 -0.26 1.57 3.64 -1.20 -0.51 116.57 120.68 3mi6 h LYS 620 Ca 0.24 -0.05 -0.12 0.00 -1.27 0.00 0.00 60.65 59.45 3mi6 h LYS 620 Cb 0.37 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 3mi6 h LYS 620 CO -0.52 0.58 -0.34 0.87 -2.27 0.00 0.00 179.45 177.77 3mi6 h LYS 621 N 0.90 0.55 -0.39 1.90 1.57 -0.47 -2.70 116.57 117.92 3mi6 h LYS 621 Ca 0.38 -0.25 -0.04 0.00 -1.87 0.00 0.00 60.65 58.87 3mi6 h LYS 621 Cb 0.24 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 3mi6 h LYS 621 CO -0.20 0.82 0.08 1.96 -0.57 0.00 0.00 179.45 181.54 3mi6 h GLN 622 N 0.47 0.63 -0.32 3.15 4.20 0.44 -1.14 115.11 122.54 3mi6 h GLN 622 Ca 0.05 -0.16 -0.08 0.00 0.06 0.00 0.00 58.65 58.52 3mi6 h GLN 622 Cb 0.81 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.50 3mi6 h GLN 622 CO 0.07 0.67 -0.15 0.28 -0.67 0.00 0.00 178.83 179.02 3mi6 h VAL 623 N 0.49 1.25 -0.14 -0.54 2.07 -1.13 0.27 116.25 118.52 3mi6 h VAL 623 Ca 0.12 -1.13 -0.12 0.00 0.82 0.00 0.00 66.70 66.40 3mi6 h VAL 623 Cb 0.33 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 3mi6 h VAL 623 CO 0.00 0.37 -0.37 0.00 0.02 0.00 0.00 177.57 177.59 3mi6 h ALA 624 N 1.32 0.23 -0.38 1.67 0.00 -1.31 -0.89 119.26 119.90 3mi6 h ALA 624 Ca 0.09 -0.45 0.03 0.00 0.00 0.00 0.00 54.91 54.58 3mi6 h ALA 624 Cb 0.57 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 3mi6 h ALA 624 CO 0.04 0.31 0.20 0.35 0.00 0.00 0.00 179.25 180.14 3mi6 h PHE 625 N 0.10 0.37 -0.19 0.00 3.57 -1.06 0.24 116.94 119.96 3mi6 h PHE 625 Ca -0.01 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.52 3mi6 h PHE 625 Cb 0.99 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.60 3mi6 h PHE 625 CO 0.10 0.20 0.08 -0.92 -2.23 0.00 0.00 178.31 175.54 3mi6 h TYR 626 N 0.40 0.15 -0.90 0.41 3.20 -0.92 -1.93 116.97 117.38 3mi6 h TYR 626 Ca 0.16 0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.07 3mi6 h TYR 626 Cb 0.05 -0.04 -0.05 0.00 1.54 0.00 0.00 36.73 38.23 3mi6 h TYR 626 CO -0.09 0.08 0.59 0.87 -1.64 0.00 0.00 178.16 177.97 3mi6 h LYS 627 N 0.18 1.09 -0.87 1.82 1.57 -0.68 -0.12 116.57 119.56 3mi6 h LYS 627 Ca 0.08 -0.07 0.03 0.00 -1.87 0.00 0.00 60.65 58.82 3mi6 h LYS 627 Cb 0.03 -0.25 -0.05 0.00 0.08 0.00 0.00 32.23 32.05 3mi6 h LYS 627 CO -0.07 0.72 0.56 0.00 -0.57 0.00 0.00 179.45 180.10 3mi6 n TYR 629 N -4.53 0.80 0.05 0.00 4.01 -0.87 -4.81 117.16 111.81 3mi6 n TYR 629 Ca 0.11 -1.59 -0.13 0.00 -0.16 0.00 0.00 57.90 56.13 3mi6 n TYR 629 Cb 0.07 -0.43 -0.02 0.00 -0.31 0.00 0.00 39.34 38.65 3mi6 n TYR 629 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 3mi6 h ARG 630 N 1.00 0.48 -0.59 -0.72 2.43 -0.87 -0.99 114.38 115.12 3mi6 h ARG 630 Ca 0.17 -0.44 0.01 0.00 -0.81 0.00 0.00 59.98 58.91 3mi6 h ARG 630 Cb 1.49 0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 31.12 3mi6 h ARG 630 CO 0.29 1.08 0.39 0.37 -1.51 0.00 0.00 179.97 180.59 3mi6 h GLN 631 N 0.30 0.74 0.12 0.20 5.75 -1.85 -1.15 115.11 119.22 3mi6 h GLN 631 Ca -0.06 -0.04 -0.20 0.00 -0.15 0.00 0.00 58.65 58.20 3mi6 h GLN 631 Cb 1.43 -0.17 0.02 0.00 1.07 0.00 0.00 27.48 29.84 3mi6 h GLN 631 CO 0.15 0.49 -0.87 1.25 -2.65 0.00 0.00 178.83 177.20 3mi6 h LEU 632 N 0.77 0.56 0.11 -2.39 5.85 -1.83 -2.48 115.31 115.89 3mi6 h LEU 632 Ca 0.22 -0.90 -0.01 0.00 0.84 0.00 0.00 57.88 58.04 3mi6 h LEU 632 Cb -0.04 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 40.81 3mi6 h LEU 632 CO -0.05 1.41 -0.05 -0.26 -0.34 0.00 0.00 178.44 179.14 3mi6 h PHE 633 N -0.21 -0.14 0.05 1.25 0.04 -1.07 -1.13 116.94 115.74 3mi6 h PHE 633 Ca -0.14 -0.00 -0.25 0.00 2.80 0.00 0.00 57.97 60.37 3mi6 h PHE 633 Cb 1.65 0.05 0.02 0.00 2.20 0.00 0.00 35.95 39.87 3mi6 h PHE 633 CO 0.17 -0.07 -1.01 1.96 -0.60 0.00 0.00 178.31 178.76 3mi6 h GLN 634 N -0.17 0.60 -0.01 1.51 4.20 -1.34 -3.38 115.11 116.52 3mi6 h GLN 634 Ca -0.02 -0.71 0.00 0.00 0.06 0.00 0.00 58.65 57.99 3mi6 h GLN 634 Cb 0.13 0.22 0.00 0.00 0.30 0.00 0.00 27.48 28.13 3mi6 h GLN 634 CO 0.02 1.30 -0.10 1.19 -0.67 0.00 0.00 178.83 180.57 3mi6 n PHE 635 N -3.93 0.00 -1.57 2.96 3.72 -0.94 -3.07 117.46 114.64 3mi6 n PHE 635 Ca -0.12 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 56.91 3mi6 n PHE 635 Cb 0.87 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 39.48 3mi6 n PHE 635 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3mi6 n GLY 636 N 0.66 -0.30 3.69 1.37 0.00 -0.43 -4.87 105.19 105.32 3mi6 n GLY 636 Ca 0.03 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 3mi6 n GLY 636 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3mi6 s LYS 637 N -2.96 4.16 -0.15 1.61 2.20 0.17 -4.71 119.74 120.06 3mi6 s LYS 637 Ca 0.76 2.50 -0.12 0.00 -0.36 0.00 0.00 55.97 58.75 3mi6 s LYS 637 Cb -0.39 -3.64 -0.05 0.00 -1.51 0.00 0.00 37.83 32.24 3mi6 s LYS 637 CO 0.47 -0.81 0.23 0.12 -0.36 0.00 0.00 175.35 175.00 3mi6 s PHE 638 N 2.83 3.49 -0.11 4.03 2.19 -1.26 -1.53 117.98 127.61 3mi6 s PHE 638 Ca 0.79 0.54 0.02 0.00 0.33 0.00 0.00 56.93 58.61 3mi6 s PHE 638 Cb -0.43 -2.23 0.01 0.00 -1.31 0.00 0.00 43.02 39.06 3mi6 s PHE 638 CO 0.35 0.35 -0.18 0.71 1.83 0.00 0.00 175.22 178.28 3mi6 s TYR 639 N 0.11 2.21 0.23 10.12 2.02 0.21 -4.84 117.35 127.42 3mi6 s TYR 639 Ca 0.14 -1.03 -0.26 0.00 -0.37 0.00 0.00 57.07 55.55 3mi6 s TYR 639 Cb -0.13 -1.55 -0.09 0.00 -0.40 0.00 0.00 41.96 39.80 3mi6 s TYR 639 CO 0.03 -0.49 0.86 1.03 -1.57 0.00 0.00 175.55 175.40 3mi6 s ARG 640 N 0.82 4.62 0.00 -0.62 0.52 -1.26 -0.81 118.95 122.22 3mi6 s ARG 640 Ca -0.09 1.26 0.00 0.00 -0.52 0.00 0.00 55.73 56.38 3mi6 s ARG 640 Cb -0.16 -3.11 0.00 0.00 0.52 0.00 0.00 34.95 32.20 3mi6 s ARG 640 CO 0.00 0.47 0.00 -0.89 0.02 0.00 0.00 175.30 174.90 3mi6 n ILE 641 N 1.21 0.00 -2.54 1.52 5.41 0.82 -4.94 119.36 120.84 3mi6 n ILE 641 Ca -0.02 0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.30 3mi6 n ILE 641 Cb 0.49 0.00 -0.03 0.00 -0.71 0.00 0.00 39.64 39.39 3mi6 n ILE 641 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 3mi6 s ASP 642 N 1.00 7.14 -0.11 4.38 1.01 -1.01 -4.88 116.67 124.20 3mi6 s ASP 642 Ca 0.00 1.75 -0.09 0.00 0.71 0.00 0.00 52.55 54.92 3mi6 s ASP 642 Cb 0.00 -2.56 -0.04 0.00 1.01 0.00 0.00 42.92 41.32 3mi6 s ASP 642 CO 0.00 -0.50 0.19 -0.55 0.21 0.00 0.00 175.17 174.52 3mi6 s SER 643 N 1.28 6.45 0.17 0.27 0.15 -1.26 -1.34 113.70 119.42 3mi6 s SER 643 Ca 0.54 0.53 0.24 0.00 0.70 0.00 0.00 55.95 57.96 3mi6 s SER 643 Cb -0.23 -2.11 0.91 0.00 -1.71 0.00 0.00 66.02 62.88 3mi6 s SER 643 CO 0.22 0.36 1.73 -2.65 1.20 0.00 0.00 173.24 174.11 3mi6 n PRO 644 N 2.15 0.17 -0.06 5.44 -0.02 -1.26 -3.07 135.00 138.35 3mi6 n PRO 644 Ca -0.18 0.27 0.12 0.00 -2.02 0.00 0.00 63.50 61.69 3mi6 n PRO 644 Cb 0.54 -1.75 0.22 0.00 -0.02 0.00 0.00 33.50 32.49 3mi6 n PRO 644 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3mi6 n PHE 645 N -2.06 0.16 -4.90 6.00 3.72 -1.26 -4.22 117.46 114.90 3mi6 n PHE 645 Ca 0.04 -0.08 -0.31 0.00 -0.05 0.00 0.00 57.45 57.05 3mi6 n PHE 645 Cb 0.31 0.00 -0.17 0.00 -0.94 0.00 0.00 39.48 38.68 3mi6 n PHE 645 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3mi6 s VAL 646 N -1.84 1.96 0.00 -4.37 1.01 -1.17 -5.00 120.40 110.98 3mi6 s VAL 646 Ca 0.33 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 61.37 3mi6 s VAL 646 Cb 0.21 -1.72 0.00 0.00 0.00 0.00 0.00 36.38 34.87 3mi6 s VAL 646 CO 0.31 0.53 0.00 -0.62 0.00 0.00 0.00 175.10 175.32 3mi6 n GLU 647 N 3.82 0.00 0.25 2.72 4.71 -1.26 -3.07 120.64 127.81 3mi6 n GLU 647 Ca -0.20 0.00 0.17 0.00 -0.01 0.00 0.00 57.16 57.12 3mi6 n GLU 647 Cb 0.52 0.00 0.88 0.00 -1.01 0.00 0.00 31.44 31.83 3mi6 n GLU 647 CO 0.00 0.00 0.00 0.38 0.09 0.00 0.00 177.13 177.60 3mi6 h ASP 648 N 9.15 0.00 -3.24 1.62 3.04 -1.92 -3.45 116.42 121.62 3mi6 h ASP 648 Ca 0.00 0.00 -0.40 0.00 -3.24 0.00 0.00 57.03 53.39 3mi6 h ASP 648 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.29 3mi6 h ASP 648 CO 0.00 0.00 -0.53 0.61 -2.04 0.00 0.00 179.24 177.28 3mi6 n GLY 649 N -1.35 -0.47 0.08 7.15 0.00 -1.17 -4.89 105.19 104.54 3mi6 n GLY 649 Ca -0.01 -0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.94 3mi6 n GLY 649 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 3mi6 h ASN 650 N -0.35 0.00 -3.27 1.61 -0.00 -1.86 -3.43 115.58 108.28 3mi6 h ASN 650 Ca -0.49 0.00 -0.65 0.00 -0.00 0.00 0.00 56.30 55.16 3mi6 h ASN 650 Cb 1.35 0.00 -0.16 0.00 -0.00 0.00 0.00 38.32 39.51 3mi6 h ASN 650 CO 0.56 0.94 -0.61 -0.69 -0.00 0.00 0.00 177.43 177.63 3mi6 s VAL 651 N -2.67 4.39 -0.00 2.57 1.01 -1.26 -1.76 120.40 122.68 3mi6 s VAL 651 Ca -0.03 -0.20 0.07 0.00 0.00 0.00 0.00 61.98 61.83 3mi6 s VAL 651 Cb 0.09 -2.91 -0.02 0.00 0.00 0.00 0.00 36.38 33.54 3mi6 s VAL 651 CO 0.82 0.54 -0.22 -0.89 0.00 0.00 0.00 175.10 175.35 3mi6 s THR 652 N -0.25 1.73 -0.17 3.92 2.01 -0.35 -4.02 115.64 118.51 3mi6 s THR 652 Ca 0.06 -0.99 -0.13 0.00 0.31 0.00 0.00 61.69 60.94 3mi6 s THR 652 Cb -0.12 -1.45 0.05 0.00 0.01 0.00 0.00 72.50 70.99 3mi6 s THR 652 CO 0.02 0.44 0.44 -0.94 -0.69 0.00 0.00 174.62 173.88 3mi6 s SER 653 N -0.65 -0.50 0.30 3.53 1.04 -0.45 -0.11 113.70 116.86 3mi6 s SER 653 Ca 0.08 0.92 0.07 0.00 0.48 0.00 0.00 55.95 57.50 3mi6 s SER 653 Cb -0.09 0.87 -0.02 0.00 0.10 0.00 0.00 66.02 66.88 3mi6 s SER 653 CO -0.00 -0.17 0.24 -2.67 0.98 0.00 0.00 173.24 171.62 3mi6 n TRP 654 N 3.45 -0.63 -3.67 5.02 -0.00 -1.03 -0.12 117.44 120.45 3mi6 n TRP 654 Ca -0.17 -2.50 -0.15 0.00 -0.00 0.00 0.00 57.50 54.68 3mi6 n TRP 654 Cb 0.56 0.24 -0.08 0.00 -0.00 0.00 0.00 31.31 32.03 3mi6 n TRP 654 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 177.69 176.55 3mi6 s GLN 655 N -3.23 0.78 0.04 -2.67 0.74 0.01 -1.66 119.66 113.67 3mi6 s GLN 655 Ca 0.34 0.10 0.09 0.00 0.05 0.00 0.00 55.36 55.94 3mi6 s GLN 655 Cb 0.02 0.36 -0.03 0.00 1.10 0.00 0.00 33.01 34.46 3mi6 s GLN 655 CO 0.24 -0.21 -0.25 0.14 -0.55 0.00 0.00 175.29 174.66 3mi6 s VAL 656 N -1.03 2.02 -0.01 1.34 -7.23 -0.43 -0.62 120.40 114.44 3mi6 s VAL 656 Ca -0.11 -1.33 0.02 0.00 -1.81 0.00 0.00 61.98 58.75 3mi6 s VAL 656 Cb -0.03 -1.73 -0.00 0.00 0.56 0.00 0.00 36.38 35.18 3mi6 s VAL 656 CO 0.06 0.33 -0.07 -0.69 -0.31 0.00 0.00 175.10 174.42 3mi6 s VAL 657 N -0.80 0.57 0.77 1.32 1.01 -0.58 -1.93 120.40 120.76 3mi6 s VAL 657 Ca 0.11 -0.29 -0.12 0.00 0.00 0.00 0.00 61.98 61.68 3mi6 s VAL 657 Cb -0.10 -0.50 0.05 0.00 0.00 0.00 0.00 36.38 35.84 3mi6 s VAL 657 CO 0.02 0.17 1.12 -0.94 0.00 0.00 0.00 175.10 175.48 3mi6 s SER 658 N -0.01 4.85 0.22 3.32 1.04 -0.97 -0.66 113.70 121.49 3mi6 s SER 658 Ca 0.01 1.05 -0.10 0.00 0.48 0.00 0.00 55.95 57.39 3mi6 s SER 658 Cb -0.05 -1.74 0.32 0.00 0.10 0.00 0.00 66.02 64.66 3mi6 s SER 658 CO -0.00 -1.71 1.66 0.44 0.98 0.00 0.00 173.24 174.61 3mi6 h ASP 659 N -0.92 -0.24 0.58 7.02 3.32 -1.95 0.08 116.42 124.32 3mi6 h ASP 659 Ca -0.46 0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.74 3mi6 h ASP 659 Cb 1.28 0.26 0.00 0.00 0.22 0.00 0.00 39.33 41.10 3mi6 h ASP 659 CO 0.63 -0.11 -0.17 -0.90 -1.72 0.00 0.00 179.24 176.98 3mi6 n ASP 660 N -5.27 0.34 -0.19 6.45 5.68 -1.26 -4.92 116.55 117.38 3mi6 n ASP 660 Ca 0.10 -0.18 -0.02 0.00 -0.50 0.00 0.00 54.79 54.18 3mi6 n ASP 660 Cb 0.37 -0.12 -0.01 0.00 -1.14 0.00 0.00 41.12 40.22 3mi6 n ASP 660 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3mi6 n GLN 661 N -1.24 -0.51 0.00 0.11 6.02 0.01 -4.87 117.38 116.90 3mi6 n GLN 661 Ca 0.10 0.38 0.12 0.00 -0.01 0.00 0.00 57.00 57.59 3mi6 n GLN 661 Cb 0.31 -3.94 0.32 0.00 1.02 0.00 0.00 30.24 27.95 3mi6 n GLN 661 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3mi6 n LYS 662 N -2.26 0.00 -3.92 -1.09 5.02 -1.26 -4.63 118.16 110.03 3mi6 n LYS 662 Ca -0.02 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.16 3mi6 n LYS 662 Cb 0.16 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 33.55 3mi6 n LYS 662 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 3mi6 s GLN 663 N -3.00 0.14 0.07 1.97 0.74 -1.26 -0.14 119.66 118.18 3mi6 s GLN 663 Ca 0.12 -0.28 -0.25 0.00 0.05 0.00 0.00 55.36 55.00 3mi6 s GLN 663 Cb 0.18 0.05 0.06 0.00 1.10 0.00 0.00 33.01 34.40 3mi6 s GLN 663 CO 0.67 -0.02 0.60 0.00 -0.55 0.00 0.00 175.29 175.98 3mi6 s ALA 664 N -0.67 -1.56 -0.13 1.58 0.00 0.90 -2.29 121.76 119.60 3mi6 s ALA 664 Ca -0.07 0.75 -0.00 0.00 0.00 0.00 0.00 51.96 52.64 3mi6 s ALA 664 Cb -0.05 0.48 0.03 0.00 0.00 0.00 0.00 23.12 23.59 3mi6 s ALA 664 CO -0.00 -0.58 -0.08 0.42 0.00 0.00 0.00 175.76 175.52 3mi6 s ILE 665 N -2.64 1.15 0.09 0.00 1.01 -0.81 0.97 121.20 120.97 3mi6 s ILE 665 Ca -0.04 -0.44 0.04 0.00 0.00 0.00 0.00 60.65 60.20 3mi6 s ILE 665 Cb -0.01 -1.19 -0.04 0.00 0.01 0.00 0.00 42.46 41.24 3mi6 s ILE 665 CO -0.03 0.32 0.07 0.00 0.00 0.00 0.00 174.94 175.30 3mi6 s ALA 666 N 1.65 3.51 -0.03 9.38 0.00 -0.37 -1.32 121.76 134.59 3mi6 s ALA 666 Ca 0.04 -1.06 0.02 0.00 0.00 0.00 0.00 51.96 50.95 3mi6 s ALA 666 Cb -0.13 -1.38 0.01 0.00 0.00 0.00 0.00 23.12 21.62 3mi6 s ALA 666 CO -0.09 0.70 -0.06 0.00 0.00 0.00 0.00 175.76 176.32 3mi6 s ALA 667 N -1.43 0.65 -0.16 0.00 0.00 -0.66 -0.71 121.76 119.45 3mi6 s ALA 667 Ca 0.29 -0.17 -0.02 0.00 0.00 0.00 0.00 51.96 52.05 3mi6 s ALA 667 Cb -0.12 -0.30 -0.02 0.00 0.00 0.00 0.00 23.12 22.68 3mi6 s ALA 667 CO 0.22 0.07 -0.07 0.50 0.00 0.00 0.00 175.76 176.47 3mi6 s ARG 668 N 0.41 3.50 -0.03 0.00 3.52 -0.73 -2.46 118.95 123.15 3mi6 s ARG 668 Ca -0.05 -0.60 0.07 0.00 -0.13 0.00 0.00 55.73 55.01 3mi6 s ARG 668 Cb -0.09 -2.83 -0.01 0.00 -1.56 0.00 0.00 34.95 30.45 3mi6 s ARG 668 CO 0.00 0.14 -0.24 0.71 -0.81 0.00 0.00 175.30 175.10 3mi6 s TYR 669 N 0.60 2.21 -0.09 5.12 2.02 0.84 -1.63 117.35 126.41 3mi6 s TYR 669 Ca -0.05 -0.51 0.01 0.00 -0.37 0.00 0.00 57.07 56.15 3mi6 s TYR 669 Cb -0.15 -1.44 0.02 0.00 -0.40 0.00 0.00 41.96 40.00 3mi6 s TYR 669 CO 0.03 -0.10 -0.10 -1.14 -1.57 0.00 0.00 175.55 172.66 3mi6 s GLN 670 N -0.39 1.66 -0.06 -0.62 0.74 -0.11 -1.21 119.66 119.66 3mi6 s GLN 670 Ca 0.04 -0.34 -0.20 0.00 0.05 0.00 0.00 55.36 54.91 3mi6 s GLN 670 Cb -0.11 -1.54 -0.15 0.00 1.10 0.00 0.00 33.01 32.31 3mi6 s GLN 670 CO 0.01 -0.14 0.79 -0.07 -0.55 0.00 0.00 175.29 175.33 3mi6 h LEU 671 N 7.64 -0.15 -8.55 3.68 3.38 -1.66 0.70 115.31 120.34 3mi6 h LEU 671 Ca -0.31 -0.38 -0.66 0.00 0.09 0.00 0.00 57.88 56.61 3mi6 h LEU 671 Cb 1.16 0.04 -0.28 0.00 0.09 0.00 0.00 40.66 41.66 3mi6 h LEU 671 CO 0.45 0.44 -0.79 -0.76 0.09 0.00 0.00 178.44 177.87 3mi6 s LEU 672 N -8.87 2.58 0.06 1.67 1.02 -1.26 -1.32 118.68 112.55 3mi6 s LEU 672 Ca -0.12 -0.38 -0.20 0.00 0.02 0.00 0.00 54.13 53.45 3mi6 s LEU 672 Cb 0.00 -1.57 -0.06 0.00 0.02 0.00 0.00 46.19 44.58 3mi6 s LEU 672 CO 0.45 0.16 0.59 0.21 0.02 0.00 0.00 176.35 177.78 3mi6 s ASN 673 N 0.35 7.06 0.20 2.29 2.47 -1.26 -4.98 114.94 121.07 3mi6 s ASN 673 Ca -0.13 1.26 0.11 0.00 0.42 0.00 0.00 52.86 54.52 3mi6 s ASN 673 Cb -0.16 -2.37 -0.04 0.00 -1.45 0.00 0.00 41.25 37.22 3mi6 s ASN 673 CO 0.06 0.23 -0.22 -1.00 -3.72 0.00 0.00 177.10 172.45 3mi6 s HIS 674 N -0.90 2.19 0.63 0.43 3.76 -1.26 -5.00 115.29 115.14 3mi6 s HIS 674 Ca 0.30 -0.38 -0.11 0.00 -0.15 0.00 0.00 55.06 54.72 3mi6 s HIS 674 Cb -0.19 -1.07 -0.02 0.00 1.11 0.00 0.00 32.58 32.41 3mi6 s HIS 674 CO 0.19 0.49 1.02 -1.25 -0.85 0.00 0.00 174.74 174.35 3mi6 s PRO 675 N -2.82 3.38 -1.05 8.40 0.04 -1.26 -4.41 135.00 137.28 3mi6 s PRO 675 Ca 0.21 0.61 -0.20 0.00 0.04 0.00 0.00 61.00 61.66 3mi6 s PRO 675 Cb -0.07 -2.09 0.02 0.00 0.04 0.00 0.00 34.50 32.40 3mi6 s PRO 675 CO 0.10 -0.67 0.66 -1.71 0.04 0.00 0.00 177.00 175.42 3mi6 n ASN 676 N -2.77 -4.57 -4.86 6.66 5.15 -1.26 -4.86 115.26 108.75 3mi6 n ASN 676 Ca 0.06 -1.13 -0.33 0.00 -0.60 0.00 0.00 54.58 52.57 3mi6 n ASN 676 Cb 0.55 -1.83 -0.06 0.00 -0.53 0.00 0.00 39.78 37.91 3mi6 n ASN 676 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3mi6 s ALA 677 N -3.30 3.53 0.69 5.20 0.00 -1.26 -5.06 121.76 121.56 3mi6 s ALA 677 Ca 0.29 -0.16 -0.17 0.00 0.00 0.00 0.00 51.96 51.92 3mi6 s ALA 677 Cb -0.15 -2.53 0.00 0.00 0.00 0.00 0.00 23.12 20.44 3mi6 s ALA 677 CO 0.93 0.46 1.13 -2.30 0.00 0.00 0.00 175.76 175.98 3mi6 n PRO 678 N 0.16 0.76 -1.67 0.00 -0.02 -1.26 -4.94 135.00 128.03 3mi6 n PRO 678 Ca -0.01 0.32 -0.38 0.00 -2.02 0.00 0.00 63.50 61.41 3mi6 n PRO 678 Cb 0.52 -2.36 0.05 0.00 -0.02 0.00 0.00 33.50 31.69 3mi6 n PRO 678 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3mi6 n TYR 679 N -2.26 1.47 -3.36 6.00 4.01 -1.26 -4.97 117.16 116.78 3mi6 n TYR 679 Ca 0.14 0.44 -0.38 0.00 -0.16 0.00 0.00 57.90 57.95 3mi6 n TYR 679 Cb 0.49 -2.23 -0.06 0.00 -0.31 0.00 0.00 39.34 37.22 3mi6 n TYR 679 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 3mi6 s THR 680 N -1.40 5.20 -0.14 -0.72 2.01 -1.25 -5.05 115.64 114.28 3mi6 s THR 680 Ca 0.74 0.88 -0.00 0.00 0.31 0.00 0.00 61.69 63.62 3mi6 s THR 680 Cb -0.43 -3.78 0.03 0.00 0.01 0.00 0.00 72.50 68.33 3mi6 s THR 680 CO 0.48 0.35 -0.09 -0.60 -0.69 0.00 0.00 174.62 174.06 3mi6 s ARG 681 N 0.53 1.75 -0.23 4.92 3.52 -1.26 -2.03 118.95 126.14 3mi6 s ARG 681 Ca 0.24 -0.45 -0.12 0.00 -0.13 0.00 0.00 55.73 55.27 3mi6 s ARG 681 Cb -0.15 -1.90 -0.05 0.00 -1.56 0.00 0.00 34.95 31.30 3mi6 s ARG 681 CO 0.09 -0.32 0.25 0.12 -0.81 0.00 0.00 175.30 174.64 3mi6 s PHE 682 N 1.60 3.32 -0.38 5.12 5.36 0.29 -4.83 117.98 128.46 3mi6 s PHE 682 Ca 0.03 0.35 -0.15 0.00 -0.96 0.00 0.00 56.93 56.20 3mi6 s PHE 682 Cb -0.14 -2.38 0.01 0.00 -0.34 0.00 0.00 43.02 40.17 3mi6 s PHE 682 CO -0.09 0.01 0.32 0.71 -1.46 0.00 0.00 175.22 174.71 3mi6 s TYR 683 N 1.26 3.22 0.49 10.12 1.51 -1.26 -0.72 117.35 131.96 3mi6 s TYR 683 Ca 0.11 -0.37 -0.21 0.00 -1.01 0.00 0.00 57.07 55.60 3mi6 s TYR 683 Cb -0.14 -2.64 -0.07 0.00 -0.11 0.00 0.00 41.96 39.00 3mi6 s TYR 683 CO 0.06 -0.53 1.10 -0.06 -1.11 0.00 0.00 175.55 175.01 3mi6 s PHE 684 N 1.83 2.89 0.31 2.71 0.40 -0.40 -5.05 117.98 120.68 3mi6 s PHE 684 Ca 0.08 1.57 0.10 0.00 -0.60 0.00 0.00 56.93 58.07 3mi6 s PHE 684 Cb -0.18 -3.21 -0.05 0.00 0.51 0.00 0.00 43.02 40.09 3mi6 s PHE 684 CO 0.11 -1.20 -0.05 0.15 0.70 0.00 0.00 175.22 174.94 3mi6 s LYS 685 N -3.05 2.01 0.00 0.44 -0.14 -1.26 -4.82 119.74 112.92 3mi6 s LYS 685 Ca 0.67 -1.70 0.00 0.00 -1.36 0.00 0.00 55.97 53.58 3mi6 s LYS 685 Cb -0.22 -1.92 0.00 0.00 -1.68 0.00 0.00 37.83 34.01 3mi6 s LYS 685 CO 0.26 0.23 0.00 0.41 -0.76 0.00 0.00 175.35 175.49 3mi6 n GLY 686 N -0.85 0.94 3.94 -3.33 0.00 -1.26 -5.01 105.19 99.62 3mi6 n GLY 686 Ca -0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.70 3mi6 n GLY 686 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mi6 s LEU 687 N 0.00 2.77 -0.20 0.99 1.43 -1.26 -4.94 118.68 117.48 3mi6 s LEU 687 Ca 0.00 0.19 -0.18 0.00 -1.03 0.00 0.00 54.13 53.11 3mi6 s LEU 687 Cb 0.00 -2.44 -0.03 0.00 0.03 0.00 0.00 46.19 43.75 3mi6 s LEU 687 CO 0.00 -2.28 0.51 -0.13 0.23 0.00 0.00 176.35 174.69 3mi6 s ARG 688 N -5.58 4.20 0.32 1.70 0.52 -1.26 -4.98 118.95 113.86 3mi6 s ARG 688 Ca 0.69 0.41 0.06 0.00 -0.52 0.00 0.00 55.73 56.37 3mi6 s ARG 688 Cb -0.06 -3.55 0.73 0.00 0.52 0.00 0.00 34.95 32.59 3mi6 s ARG 688 CO 0.49 -0.13 1.82 -1.35 0.02 0.00 0.00 175.30 176.15 3mi6 h PRO 689 N 7.42 0.77 -0.61 3.54 0.11 -1.97 -2.78 132.00 138.47 3mi6 h PRO 689 Ca -0.34 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.72 3mi6 h PRO 689 Cb 1.16 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.09 3mi6 h PRO 689 CO 0.74 0.51 0.00 0.09 -0.21 0.00 0.00 178.00 179.13 3mi6 n ASN 690 N -4.66 3.58 -4.73 -2.05 3.02 -1.26 -2.59 115.26 106.58 3mi6 n ASN 690 Ca 0.21 -1.99 -0.35 0.00 -0.03 0.00 0.00 54.58 52.41 3mi6 n ASN 690 Cb 0.51 -0.40 -0.08 0.00 -0.61 0.00 0.00 39.78 39.19 3mi6 n ASN 690 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3mi6 s GLN 691 N -1.19 4.20 0.28 3.52 2.00 -1.05 -4.92 119.66 122.50 3mi6 s GLN 691 Ca 0.44 -0.16 -0.26 0.00 -2.00 0.00 0.00 55.36 53.37 3mi6 s GLN 691 Cb 0.24 -3.43 -0.09 0.00 0.80 0.00 0.00 33.01 30.52 3mi6 s GLN 691 CO 0.31 0.27 0.91 1.03 -0.50 0.00 0.00 175.29 177.32 3mi6 s ARG 692 N 0.43 4.62 0.13 1.67 0.52 -1.26 -1.26 118.95 123.80 3mi6 s ARG 692 Ca 0.10 1.32 0.04 0.00 -0.52 0.00 0.00 55.73 56.66 3mi6 s ARG 692 Cb -0.11 -2.95 -0.04 0.00 0.52 0.00 0.00 34.95 32.36 3mi6 s ARG 692 CO -0.01 0.37 -0.10 0.71 0.02 0.00 0.00 175.30 176.29 3mi6 s TYR 693 N -1.47 1.17 0.12 -0.53 2.02 0.40 -0.83 117.35 118.23 3mi6 s TYR 693 Ca 0.46 -0.75 0.09 0.00 -0.37 0.00 0.00 57.07 56.50 3mi6 s TYR 693 Cb -0.21 -0.61 -0.04 0.00 -0.40 0.00 0.00 41.96 40.70 3mi6 s TYR 693 CO 0.26 0.03 -0.17 -0.65 -1.57 0.00 0.00 175.55 173.44 3mi6 s GLN 694 N -3.52 1.81 -0.26 -0.62 -0.21 0.59 -0.80 119.66 116.63 3mi6 s GLN 694 Ca 0.13 -1.19 0.00 0.00 0.02 0.00 0.00 55.36 54.32 3mi6 s GLN 694 Cb 0.02 -2.12 0.08 0.00 1.00 0.00 0.00 33.01 31.99 3mi6 s GLN 694 CO -0.00 0.48 0.02 0.42 -2.12 0.00 0.00 175.29 174.08 3mi6 s ILE 695 N -1.20 1.25 0.00 1.08 1.01 -1.26 -1.39 121.20 120.69 3mi6 s ILE 695 Ca 0.19 -1.30 0.00 0.00 0.00 0.00 0.00 60.65 59.54 3mi6 s ILE 695 Cb -0.10 -1.73 0.00 0.00 0.01 0.00 0.00 42.46 40.63 3mi6 s ILE 695 CO 0.11 -0.35 0.00 0.59 0.00 0.00 0.00 174.94 175.28 3mi6 n ASN 696 N 4.74 0.00 -1.98 3.58 3.02 -0.52 -2.79 115.26 121.31 3mi6 n ASN 696 Ca -0.06 0.00 -0.19 0.00 -0.03 0.00 0.00 54.58 54.29 3mi6 n ASN 696 Cb 0.44 0.00 0.13 0.00 -0.61 0.00 0.00 39.78 39.74 3mi6 n ASN 696 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 3mi6 n ASP 697 N -0.03 3.92 -4.65 6.41 5.68 -1.26 -4.90 116.55 121.72 3mi6 n ASP 697 Ca 0.00 -3.28 -0.41 0.00 -0.50 0.00 0.00 54.79 50.60 3mi6 n ASP 697 Cb 0.00 -0.79 -0.04 0.00 -1.14 0.00 0.00 41.12 39.15 3mi6 n ASP 697 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3mi6 s ASP 698 N -0.81 6.83 0.36 -1.12 -1.08 -1.12 -4.98 116.67 114.75 3mi6 s ASP 698 Ca 0.45 1.02 0.03 0.00 -0.52 0.00 0.00 52.55 53.54 3mi6 s ASP 698 Cb 0.38 -2.42 0.68 0.00 -1.46 0.00 0.00 42.92 40.09 3mi6 s ASP 698 CO 0.08 -0.46 2.01 1.55 0.52 0.00 0.00 175.17 178.87 3mi6 h PRO 699 N 7.60 0.76 -7.17 4.34 0.13 -1.91 -3.39 132.00 132.36 3mi6 h PRO 699 Ca -0.25 -0.05 -0.54 0.00 -0.87 0.00 0.00 66.00 64.29 3mi6 h PRO 699 Cb 1.11 -0.17 0.15 0.00 0.13 0.00 0.00 31.00 32.22 3mi6 h PRO 699 CO 0.85 0.51 0.40 -1.12 -0.23 0.00 0.00 178.00 178.42 3mi6 s SER 700 N -6.53 4.28 -0.04 1.44 0.01 -1.26 -5.05 113.70 106.54 3mi6 s SER 700 Ca -0.10 2.37 -0.02 0.00 1.31 0.00 0.00 55.95 59.52 3mi6 s SER 700 Cb 0.17 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.78 3mi6 s SER 700 CO 0.76 -2.21 0.07 0.42 0.41 0.00 0.00 173.24 172.69 3mi6 s THR 701 N -1.94 4.75 -0.07 1.44 -4.23 -1.26 -4.65 115.64 109.69 3mi6 s THR 701 Ca 0.75 -0.29 0.03 0.00 -1.18 0.00 0.00 61.69 60.99 3mi6 s THR 701 Cb -0.30 -3.13 0.01 0.00 1.34 0.00 0.00 72.50 70.43 3mi6 s THR 701 CO 0.44 0.44 -0.14 -0.31 -0.54 0.00 0.00 174.62 174.50 3mi6 s TYR 702 N -1.11 1.63 0.64 3.99 1.51 0.02 -4.91 117.35 119.11 3mi6 s TYR 702 Ca 0.20 -0.59 -0.17 0.00 -1.01 0.00 0.00 57.07 55.50 3mi6 s TYR 702 Cb -0.12 -1.16 -0.01 0.00 -0.11 0.00 0.00 41.96 40.56 3mi6 s TYR 702 CO 0.10 -0.27 1.19 0.71 -1.11 0.00 0.00 175.55 176.17 3mi6 s TYR 703 N 0.52 2.34 0.29 2.71 1.51 -1.26 0.15 117.35 123.60 3mi6 s TYR 703 Ca -0.13 1.54 -0.01 0.00 -1.01 0.00 0.00 57.07 57.46 3mi6 s TYR 703 Cb -0.15 -3.43 0.42 0.00 -0.11 0.00 0.00 41.96 38.69 3mi6 s TYR 703 CO 0.04 -2.23 1.88 0.78 -1.11 0.00 0.00 175.55 174.90 3mi6 h GLY 704 N 0.46 0.98 2.00 0.71 0.00 -1.06 -1.92 103.07 104.23 3mi6 h GLY 704 Ca -0.49 -0.49 -0.04 0.00 0.00 0.00 0.00 47.33 46.31 3mi6 h GLY 704 CO 0.54 0.46 -0.17 1.29 0.00 0.00 0.00 176.54 178.66 3mi6 h ASP 705 N 0.90 0.00 -0.24 0.19 3.04 -1.70 -1.52 116.42 117.09 3mi6 h ASP 705 Ca 0.22 0.00 -0.01 0.00 -3.24 0.00 0.00 57.03 54.00 3mi6 h ASP 705 Cb 0.15 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.43 3mi6 h ASP 705 CO -0.02 0.17 0.12 -0.33 -2.04 0.00 0.00 179.24 177.14 3mi6 h GLU 706 N 0.00 0.34 -0.85 4.15 5.08 -1.65 0.06 114.58 121.71 3mi6 h GLU 706 Ca -0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 3mi6 h GLU 706 Cb 0.44 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.63 3mi6 h GLU 706 CO 0.02 0.33 0.00 1.28 -1.00 0.00 0.00 179.01 179.64 3mi6 n LEU 707 N -4.84 1.06 0.00 1.33 4.77 -0.57 -1.80 117.00 116.94 3mi6 n LEU 707 Ca -0.03 -0.53 0.00 0.00 -0.03 0.00 0.00 56.01 55.42 3mi6 n LEU 707 Cb 0.09 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 40.79 3mi6 n LEU 707 CO 0.35 0.23 0.00 0.59 -1.33 0.00 0.00 177.39 177.23 3mi6 n ASN 709 N 0.21 0.00 0.02 -1.43 3.02 0.01 -1.27 115.26 115.82 3mi6 n ASN 709 Ca 0.00 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 54.57 3mi6 n ASN 709 Cb 0.23 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.31 3mi6 n ASN 709 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3mi6 n ALA 710 N -0.01 2.09 0.00 5.41 0.00 -0.78 -5.08 120.51 122.14 3mi6 n ALA 710 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.87 3mi6 n ALA 710 Cb 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.57 3mi6 n ALA 710 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mi6 n GLY 711 N 1.38 -1.26 3.19 0.00 0.00 -0.75 -4.96 105.19 102.79 3mi6 n GLY 711 Ca -0.10 -1.59 -0.30 0.00 0.00 0.00 0.00 46.02 44.03 3mi6 n GLY 711 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3mi6 s TYR 712 N -1.39 2.31 -0.04 1.61 6.14 0.10 -4.69 117.35 121.38 3mi6 s TYR 712 Ca 0.00 -0.87 -0.30 0.00 0.64 0.00 0.00 57.07 56.54 3mi6 s TYR 712 Cb 0.00 -1.55 -0.02 0.00 0.42 0.00 0.00 41.96 40.80 3mi6 s TYR 712 CO 0.00 -0.34 1.02 0.12 0.64 0.00 0.00 175.55 176.98 3mi6 s PHE 713 N 0.27 3.56 -0.10 4.97 2.19 -1.26 -0.54 117.98 127.07 3mi6 s PHE 713 Ca -0.14 1.61 0.01 0.00 0.33 0.00 0.00 56.93 58.74 3mi6 s PHE 713 Cb -0.16 -3.18 -0.02 0.00 -1.31 0.00 0.00 43.02 38.35 3mi6 s PHE 713 CO 0.07 -0.25 -0.14 0.08 1.83 0.00 0.00 175.22 176.81 3mi6 s VAL 714 N 1.50 3.01 0.53 3.12 1.01 -0.86 -4.97 120.40 123.74 3mi6 s VAL 714 Ca 0.51 -0.70 -0.22 0.00 0.00 0.00 0.00 61.98 61.57 3mi6 s VAL 714 Cb -0.21 -2.23 -0.05 0.00 0.00 0.00 0.00 36.38 33.89 3mi6 s VAL 714 CO 0.24 0.55 1.31 -2.84 0.00 0.00 0.00 175.10 174.36 3mi6 s PRO 715 N -0.04 3.27 0.61 2.72 0.02 -1.26 -3.95 135.00 136.37 3mi6 s PRO 715 Ca -0.03 2.12 -0.19 0.00 0.02 0.00 0.00 61.00 62.92 3mi6 s PRO 715 Cb -0.14 -2.28 -0.03 0.00 0.02 0.00 0.00 34.50 32.07 3mi6 s PRO 715 CO 0.04 -1.05 1.29 0.99 -0.33 0.00 0.00 177.00 177.94 3mi6 s THR 716 N -1.36 2.19 -0.41 0.99 2.01 -1.26 -4.94 115.64 112.85 3mi6 s THR 716 Ca 0.70 0.13 -0.28 0.00 0.31 0.00 0.00 61.69 62.55 3mi6 s THR 716 Cb -0.38 -3.05 0.02 0.00 0.01 0.00 0.00 72.50 69.10 3mi6 s THR 716 CO 0.44 -0.02 1.05 -0.63 -0.69 0.00 0.00 174.62 174.77 3mi6 s ILE 717 N -1.42 4.40 -0.02 1.82 1.01 -1.26 -5.03 121.20 120.69 3mi6 s ILE 717 Ca 0.79 1.27 0.00 0.00 0.00 0.00 0.00 60.65 62.71 3mi6 s ILE 717 Cb -0.36 -4.48 -0.04 0.00 0.01 0.00 0.00 42.46 37.59 3mi6 s ILE 717 CO 0.40 -0.76 0.01 -0.76 0.00 0.00 0.00 174.94 173.83 3mi6 s LEU 718 N 3.95 3.58 0.31 2.97 1.43 -1.26 -4.97 118.68 124.69 3mi6 s LEU 718 Ca 0.44 0.05 -0.29 0.00 -1.03 0.00 0.00 54.13 53.30 3mi6 s LEU 718 Cb -0.10 -2.00 -0.10 0.00 0.03 0.00 0.00 46.19 44.02 3mi6 s LEU 718 CO 0.24 0.31 1.38 0.00 0.23 0.00 0.00 176.35 178.51 3mi6 s ALA 719 N -1.05 3.55 -0.04 4.21 0.00 -1.26 -4.94 121.76 122.24 3mi6 s ALA 719 Ca 0.18 1.34 0.05 0.00 0.00 0.00 0.00 51.96 53.54 3mi6 s ALA 719 Cb -0.12 -3.53 0.08 0.00 0.00 0.00 0.00 23.12 19.56 3mi6 s ALA 719 CO 0.09 -0.75 0.99 -0.40 0.00 0.00 0.00 175.76 175.69 3mi6 n ASP 720 N 1.26 1.76 0.00 0.00 5.75 -1.26 -4.98 116.55 119.07 3mi6 n ASP 720 Ca 0.02 -2.20 0.00 0.00 -0.01 0.00 0.00 54.79 52.60 3mi6 n ASP 720 Cb 0.41 -0.13 0.00 0.00 -1.03 0.00 0.00 41.12 40.36 3mi6 n ASP 720 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3mi6 n GLY 721 N -0.68 2.05 0.02 6.12 0.00 -1.26 -4.77 105.19 106.67 3mi6 n GLY 721 Ca 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.07 3mi6 n GLY 721 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3mi6 h GLN 722 N 0.47 -0.00 -5.88 1.61 1.08 -1.99 -3.49 115.11 106.90 3mi6 h GLN 722 Ca 0.00 0.00 -0.60 0.00 -1.45 0.00 0.00 58.65 56.60 3mi6 h GLN 722 Cb 0.00 0.00 -0.14 0.00 -0.05 0.00 0.00 27.48 27.30 3mi6 h GLN 722 CO 0.00 -0.00 -0.68 -1.83 -0.95 0.00 0.00 178.83 175.37 3mi6 s GLU 723 N -1.26 1.79 0.17 1.46 -1.05 -1.26 -5.12 118.70 113.43 3mi6 s GLU 723 Ca -0.00 -1.92 -0.31 0.00 -0.15 0.00 0.00 54.97 52.59 3mi6 s GLU 723 Cb 0.00 -1.64 -0.09 0.00 -0.44 0.00 0.00 34.13 31.97 3mi6 s GLU 723 CO 0.00 0.12 1.36 0.45 0.95 0.00 0.00 175.26 178.15 3mi6 s SER 724 N -3.59 6.83 0.00 0.83 0.15 -1.26 -4.67 113.70 111.99 3mi6 s SER 724 Ca 0.32 2.41 0.23 0.00 0.70 0.00 0.00 55.95 59.60 3mi6 s SER 724 Cb 0.03 -2.60 0.85 0.00 -1.71 0.00 0.00 66.02 62.59 3mi6 s SER 724 CO 0.16 -0.60 1.61 0.29 1.20 0.00 0.00 173.24 175.90 3mi6 n LYS 725 N 3.16 1.67 -1.56 5.44 4.76 -1.26 -4.89 118.16 125.49 3mi6 n LYS 725 Ca 0.09 -1.00 -0.31 0.00 -2.87 0.00 0.00 58.31 54.21 3mi6 n LYS 725 Cb 0.42 -1.41 0.06 0.00 -1.84 0.00 0.00 35.03 32.26 3mi6 n LYS 725 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3mi6 s ASP 726 N -1.68 5.21 -1.11 4.39 1.01 -1.26 -4.14 116.67 119.09 3mi6 s ASP 726 Ca 0.34 1.57 -0.21 0.00 0.71 0.00 0.00 52.55 54.96 3mi6 s ASP 726 Cb 0.18 -2.42 0.00 0.00 1.01 0.00 0.00 42.92 41.69 3mi6 s ASP 726 CO 0.28 -1.55 0.75 0.49 0.21 0.00 0.00 175.17 175.35 3mi6 n PHE 727 N -3.19 -1.86 -4.19 4.23 3.72 -0.43 -4.85 117.46 110.89 3mi6 n PHE 727 Ca 0.07 0.43 -0.33 0.00 -0.05 0.00 0.00 57.45 57.58 3mi6 n PHE 727 Cb 0.54 -3.27 -0.08 0.00 -0.94 0.00 0.00 39.48 35.73 3mi6 n PHE 727 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 3mi6 s TYR 728 N -3.41 3.17 -0.01 1.38 5.04 0.18 -4.68 117.35 119.00 3mi6 s TYR 728 Ca 0.42 0.13 0.06 0.00 -2.44 0.00 0.00 57.07 55.24 3mi6 s TYR 728 Cb -0.17 -1.69 -0.01 0.00 0.35 0.00 0.00 41.96 40.43 3mi6 s TYR 728 CO 0.88 0.50 -0.19 0.99 -1.34 0.00 0.00 175.55 176.40 3mi6 s THR 729 N -1.15 1.49 -0.17 4.34 2.01 -1.26 -0.94 115.64 119.96 3mi6 s THR 729 Ca 0.21 -0.80 -0.01 0.00 0.31 0.00 0.00 61.69 61.40 3mi6 s THR 729 Cb -0.12 -1.24 0.04 0.00 0.01 0.00 0.00 72.50 71.20 3mi6 s THR 729 CO 0.12 0.42 -0.04 -1.10 -0.69 0.00 0.00 174.62 173.33 3mi6 s GLN 730 N -0.44 1.35 0.18 4.92 -0.21 -0.65 -5.02 119.66 119.79 3mi6 s GLN 730 Ca 0.07 -0.53 -0.04 0.00 0.02 0.00 0.00 55.36 54.88 3mi6 s GLN 730 Cb -0.07 -2.04 -0.05 0.00 1.00 0.00 0.00 33.01 31.85 3mi6 s GLN 730 CO -0.01 -0.46 0.40 -0.51 -2.12 0.00 0.00 175.29 172.59 3mi6 s LEU 731 N 1.64 4.23 -0.27 2.90 1.02 -1.26 -1.78 118.68 125.16 3mi6 s LEU 731 Ca 0.00 0.55 -0.03 0.00 0.02 0.00 0.00 54.13 54.68 3mi6 s LEU 731 Cb -0.16 -3.30 0.09 0.00 0.02 0.00 0.00 46.19 42.84 3mi6 s LEU 731 CO -0.07 -0.00 0.10 -0.36 0.02 0.00 0.00 176.35 176.03 3mi6 s PHE 732 N -1.76 0.89 -0.39 0.29 0.08 0.11 -5.00 117.98 112.21 3mi6 s PHE 732 Ca 0.41 -1.09 -0.23 0.00 0.12 0.00 0.00 56.93 56.13 3mi6 s PHE 732 Cb -0.12 -1.17 0.01 0.00 -0.57 0.00 0.00 43.02 41.18 3mi6 s PHE 732 CO 0.26 -0.77 0.78 0.08 -0.10 0.00 0.00 175.22 175.47 3mi6 s VAL 733 N 1.90 4.72 -0.15 -0.44 1.01 -1.26 -1.23 120.40 124.95 3mi6 s VAL 733 Ca 0.07 0.73 -0.06 0.00 0.00 0.00 0.00 61.98 62.72 3mi6 s VAL 733 Cb -0.17 -4.23 -0.04 0.00 0.00 0.00 0.00 36.38 31.94 3mi6 s VAL 733 CO -0.25 -0.51 0.06 -0.69 0.00 0.00 0.00 175.10 173.71 3mi6 s VAL 734 N 3.14 4.83 -0.03 2.92 1.01 0.27 -1.44 120.40 131.10 3mi6 s VAL 734 Ca 0.30 -0.03 -0.01 0.00 0.00 0.00 0.00 61.98 62.24 3mi6 s VAL 734 Cb -0.13 -3.13 0.03 0.00 0.00 0.00 0.00 36.38 33.16 3mi6 s VAL 734 CO 0.18 0.53 0.06 -0.89 0.00 0.00 0.00 175.10 174.98 3mi6 s THR 735 N -0.22 -0.06 0.67 3.92 2.01 -0.48 -0.07 115.64 121.41 3mi6 s THR 735 Ca 0.08 0.21 -0.17 0.00 0.31 0.00 0.00 61.69 62.11 3mi6 s THR 735 Cb -0.12 -0.12 0.00 0.00 0.01 0.00 0.00 72.50 72.28 3mi6 s THR 735 CO 0.01 0.08 1.26 0.00 -0.69 0.00 0.00 174.62 175.29 3mi6 s ALA 736 N 1.08 2.30 -0.46 7.40 0.00 0.80 -0.30 121.76 132.59 3mi6 s ALA 736 Ca -0.09 1.10 -0.10 0.00 0.00 0.00 0.00 51.96 52.87 3mi6 s ALA 736 Cb -0.12 -3.52 0.10 0.00 0.00 0.00 0.00 23.12 19.57 3mi6 s ALA 736 CO -0.04 -1.66 0.33 0.42 0.00 0.00 0.00 175.76 174.81 3mi6 s ILE 737 N -1.59 4.40 -0.13 0.00 -1.09 -0.01 -4.73 121.20 118.05 3mi6 s ILE 737 Ca 0.80 -1.53 -0.21 0.00 -2.23 0.00 0.00 60.65 57.47 3mi6 s ILE 737 Cb -0.34 -3.78 -0.03 0.00 -1.58 0.00 0.00 42.46 36.72 3mi6 s ILE 737 CO 0.41 -0.65 0.63 -0.76 -1.23 0.00 0.00 174.94 173.34 3mi6 s LEU 738 N 1.44 4.24 -0.29 2.97 1.43 -1.26 -4.57 118.68 122.64 3mi6 s LEU 738 Ca 0.04 0.98 -0.28 0.00 -1.03 0.00 0.00 54.13 53.85 3mi6 s LEU 738 Cb -0.25 -2.94 0.19 0.00 0.03 0.00 0.00 46.19 43.22 3mi6 s LEU 738 CO 0.01 -0.16 1.38 -0.70 0.23 0.00 0.00 176.35 177.12 3mi6 s GLU 739 N 1.23 0.07 0.27 1.70 2.12 -1.26 -5.13 118.70 117.70 3mi6 s GLU 739 Ca 0.32 0.04 -0.30 0.00 0.36 0.00 0.00 54.97 55.39 3mi6 s GLU 739 Cb -0.16 0.03 -0.10 0.00 0.26 0.00 0.00 34.13 34.16 3mi6 s GLU 739 CO 0.13 -0.02 1.39 -1.01 -0.54 0.00 0.00 175.26 175.21 3mi6 s HIS 740 N -0.61 3.04 -0.02 5.30 3.76 -1.26 -5.03 115.29 120.47 3mi6 s HIS 740 Ca 0.08 1.16 -0.11 0.00 -0.15 0.00 0.00 55.06 56.04 3mi6 s HIS 740 Cb -0.03 -3.76 0.02 0.00 1.11 0.00 0.00 32.58 29.92 3mi6 s HIS 740 CO -0.11 -2.36 0.24 -1.58 -0.85 0.00 0.00 174.74 170.08 3mi6 s HIS 741 N -0.34 -0.12 -1.18 1.40 2.46 -1.26 -5.09 115.29 111.16 3mi6 s HIS 741 Ca 0.56 0.20 -0.08 0.00 0.47 0.00 0.00 55.06 56.21 3mi6 s HIS 741 Cb -0.41 0.04 0.23 0.00 -0.13 0.00 0.00 32.58 32.32 3mi6 s HIS 741 CO 0.46 -0.31 1.59 0.72 -2.47 0.00 0.00 174.74 174.74 3mi6 n HIS 742 N 1.64 3.25 0.17 3.88 8.25 -1.26 -5.25 115.22 125.90 3mi6 n HIS 742 Ca -0.20 -2.92 0.01 0.00 -0.26 0.00 0.00 57.72 54.35 3mi6 n HIS 742 Cb 0.56 -1.71 0.08 0.00 1.12 0.00 0.00 29.99 30.04 3mi6 n HIS 742 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70