#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3flz s ARG 5 N 0.00 4.28 0.98 3.44 3.52 -1.26 -5.02 118.95 124.88 3flz s ARG 5 Ca 0.00 2.07 -0.12 0.00 -0.13 0.00 0.00 55.73 57.55 3flz s ARG 5 Cb 0.00 -3.47 0.18 0.00 -1.56 0.00 0.00 34.95 30.10 3flz s ARG 5 CO 0.00 -0.56 1.08 -1.25 -0.81 0.00 0.00 175.30 173.77 3flz s PRO 6 N 2.00 0.60 0.03 5.12 0.04 -1.26 -5.02 135.00 136.52 3flz s PRO 6 Ca 0.66 0.75 -0.27 0.00 0.04 0.00 0.00 61.00 62.18 3flz s PRO 6 Cb -0.35 -1.74 -0.05 0.00 0.04 0.00 0.00 34.50 32.41 3flz s PRO 6 CO 0.29 -2.68 0.84 0.99 0.04 0.00 0.00 177.00 176.48 3flz s THR 7 N -2.86 4.75 0.09 1.26 2.01 -1.26 -5.00 115.64 114.63 3flz s THR 7 Ca 0.65 1.79 0.02 0.00 0.31 0.00 0.00 61.69 64.46 3flz s THR 7 Cb -0.20 -4.19 -0.04 0.00 0.01 0.00 0.00 72.50 68.08 3flz s THR 7 CO 0.58 0.30 0.15 -0.36 -0.69 0.00 0.00 174.62 174.60 3flz s PHE 8 N 0.30 3.33 0.09 4.92 0.40 -1.26 -1.52 117.98 124.24 3flz s PHE 8 Ca 0.43 0.13 0.06 0.00 -0.60 0.00 0.00 56.93 56.95 3flz s PHE 8 Cb -0.21 -1.66 -0.03 0.00 0.51 0.00 0.00 43.02 41.62 3flz s PHE 8 CO 0.25 0.55 -0.15 1.52 0.70 0.00 0.00 175.22 178.09 3flz s TYR 9 N -1.50 1.32 0.11 0.36 -0.85 -0.49 -4.91 117.35 111.39 3flz s TYR 9 Ca 0.32 -0.50 0.02 0.00 -0.52 0.00 0.00 57.07 56.40 3flz s TYR 9 Cb -0.12 -0.72 -0.04 0.00 0.38 0.00 0.00 41.96 41.46 3flz s TYR 9 CO 0.25 0.10 0.17 1.03 -1.52 0.00 0.00 175.55 175.57 3flz s ARG 10 N -2.11 3.15 -0.30 -3.49 0.52 -1.26 -2.27 118.95 113.20 3flz s ARG 10 Ca 0.03 -0.64 -0.15 0.00 -0.52 0.00 0.00 55.73 54.45 3flz s ARG 10 Cb -0.08 -2.84 0.15 0.00 0.52 0.00 0.00 34.95 32.70 3flz s ARG 10 CO 0.03 0.55 0.94 -1.14 0.02 0.00 0.00 175.30 175.70 3flz s GLN 11 N -2.74 0.36 -0.29 3.54 0.74 -0.35 -4.98 119.66 115.94 3flz s GLN 11 Ca 0.32 0.80 -0.29 0.00 0.05 0.00 0.00 55.36 56.24 3flz s GLN 11 Cb -0.12 0.35 0.01 0.00 1.10 0.00 0.00 33.01 34.36 3flz s GLN 11 CO 0.25 -0.11 1.05 -2.00 -0.55 0.00 0.00 175.29 173.94 3flz s GLU 12 N 2.09 4.13 0.02 1.67 2.12 -1.26 -0.22 118.70 127.25 3flz s GLU 12 Ca -0.05 1.15 0.02 0.00 0.36 0.00 0.00 54.97 56.45 3flz s GLU 12 Cb -0.06 -3.70 -0.02 0.00 0.26 0.00 0.00 34.13 30.62 3flz s GLU 12 CO -0.17 -0.80 -0.07 -0.51 -0.54 0.00 0.00 175.26 173.17 3flz s LEU 13 N 3.47 2.14 0.00 2.70 1.43 -0.20 -4.95 118.68 123.27 3flz s LEU 13 Ca 0.44 -0.34 0.00 0.00 -1.03 0.00 0.00 54.13 53.20 3flz s LEU 13 Cb -0.13 -0.26 0.00 0.00 0.03 0.00 0.00 46.19 45.82 3flz s LEU 13 CO 0.12 -0.06 0.00 0.59 0.23 0.00 0.00 176.35 177.23 3flz n ASN 14 N 2.16 0.00 0.00 2.29 5.03 -1.26 -2.31 115.26 121.17 3flz n ASN 14 Ca -0.18 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.27 3flz n ASN 14 Cb 0.56 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.32 3flz n ASN 14 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3flz n LYS 15 N 0.00 0.97 -3.31 3.52 4.76 -1.26 -5.10 118.16 117.75 3flz n LYS 15 Ca 0.00 0.00 -0.19 0.00 -2.87 0.00 0.00 58.31 55.25 3flz n LYS 15 Cb 0.00 -0.93 -0.01 0.00 -1.84 0.00 0.00 35.03 32.25 3flz n LYS 15 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 3flz s THR 16 N -1.71 2.80 -0.28 -0.18 -4.23 -0.98 -5.09 115.64 105.96 3flz s THR 16 Ca 0.00 -1.19 -0.19 0.00 -1.18 0.00 0.00 61.69 59.14 3flz s THR 16 Cb 0.00 -2.98 -0.02 0.00 1.34 0.00 0.00 72.50 70.84 3flz s THR 16 CO 0.00 0.00 0.55 -0.63 -0.54 0.00 0.00 174.62 174.00 3flz s ILE 17 N -2.42 5.02 -0.18 2.99 1.01 -1.26 -1.03 121.20 125.33 3flz s ILE 17 Ca 0.51 0.83 -0.18 0.00 0.00 0.00 0.00 60.65 61.81 3flz s ILE 17 Cb -0.06 -3.90 -0.03 0.00 0.01 0.00 0.00 42.46 38.47 3flz s ILE 17 CO 0.30 -0.02 0.50 0.26 0.00 0.00 0.00 174.94 175.99 3flz s TRP 18 N 2.42 3.41 -0.33 3.97 0.52 0.69 -4.90 118.94 124.71 3flz s TRP 18 Ca 0.22 0.80 0.02 0.00 0.02 0.00 0.00 56.10 57.17 3flz s TRP 18 Cb -0.15 -2.64 0.09 0.00 -1.15 0.00 0.00 33.47 29.62 3flz s TRP 18 CO 0.10 -0.03 0.04 -2.00 0.02 0.00 0.00 176.95 175.09 3flz s GLU 19 N 1.35 1.79 0.17 4.98 2.12 -1.26 -1.22 118.70 126.63 3flz s GLU 19 Ca 0.24 -1.72 0.09 0.00 0.36 0.00 0.00 54.97 53.94 3flz s GLU 19 Cb -0.15 -3.22 -0.04 0.00 0.26 0.00 0.00 34.13 30.98 3flz s GLU 19 CO 0.10 -0.87 -0.19 0.14 -0.54 0.00 0.00 175.26 173.89 3flz s VAL 20 N 1.01 1.92 0.57 3.70 -7.23 -0.96 -4.62 120.40 114.79 3flz s VAL 20 Ca 0.06 -1.93 -0.20 0.00 -1.81 0.00 0.00 61.98 58.09 3flz s VAL 20 Cb -0.20 -1.89 -0.05 0.00 0.56 0.00 0.00 36.38 34.81 3flz s VAL 20 CO -0.06 -0.27 1.18 -2.65 -0.31 0.00 0.00 175.10 172.98 3flz n PRO 21 N 0.30 1.27 -0.15 4.82 -0.02 -1.26 -1.40 135.00 138.56 3flz n PRO 21 Ca -0.13 0.48 0.20 0.00 -2.02 0.00 0.00 63.50 62.03 3flz n PRO 21 Cb 0.57 -2.38 0.60 0.00 -0.02 0.00 0.00 33.50 32.27 3flz n PRO 21 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3flz h GLU 22 N 0.93 0.22 -0.76 -0.52 5.08 -1.62 -2.10 114.58 115.81 3flz h GLU 22 Ca -0.49 -0.01 0.22 0.00 -1.00 0.00 0.00 59.36 58.07 3flz h GLU 22 Cb 1.34 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.51 3flz h GLU 22 CO 0.54 0.14 0.56 0.07 -1.00 0.00 0.00 179.01 179.32 3flz h ARG 23 N 0.22 0.00 -5.24 2.33 0.11 -1.90 -3.38 114.38 106.52 3flz h ARG 23 Ca 0.38 0.00 -0.63 0.00 0.10 0.00 0.00 59.98 59.83 3flz h ARG 23 Cb 1.16 0.00 -0.14 0.00 1.11 0.00 0.00 29.97 32.09 3flz h ARG 23 CO -0.08 0.00 -0.10 0.71 0.10 0.00 0.00 179.97 180.60 3flz s TYR 24 N -4.96 3.22 0.31 4.08 1.51 -0.79 -0.69 117.35 120.02 3flz s TYR 24 Ca -0.05 0.36 0.05 0.00 -1.01 0.00 0.00 57.07 56.43 3flz s TYR 24 Cb 0.21 -2.77 -0.06 0.00 -0.11 0.00 0.00 41.96 39.23 3flz s TYR 24 CO 0.75 -0.38 0.00 -0.65 -1.11 0.00 0.00 175.55 174.16 3flz s GLN 25 N 2.27 1.61 -1.29 -0.62 -1.52 -0.44 -4.88 119.66 114.80 3flz s GLN 25 Ca 0.18 -1.86 -0.03 0.00 -1.95 0.00 0.00 55.36 51.70 3flz s GLN 25 Cb -0.16 -1.03 -0.01 0.00 -0.22 0.00 0.00 33.01 31.60 3flz s GLN 25 CO 0.11 -0.08 0.67 0.09 -0.25 0.00 0.00 175.29 175.83 3flz n ASN 26 N -0.65 -1.90 -4.73 5.90 3.02 -1.26 -0.30 115.26 115.35 3flz n ASN 26 Ca -0.04 -0.88 -0.42 0.00 -0.03 0.00 0.00 54.58 53.22 3flz n ASN 26 Cb 0.65 -3.84 -0.03 0.00 -0.61 0.00 0.00 39.78 35.95 3flz n ASN 26 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3flz s LEU 27 N -6.62 4.41 -0.08 3.41 1.02 -1.26 -4.31 118.68 115.25 3flz s LEU 27 Ca 0.09 2.24 -0.03 0.00 0.02 0.00 0.00 54.13 56.45 3flz s LEU 27 Cb -0.03 -3.60 0.04 0.00 0.02 0.00 0.00 46.19 42.63 3flz s LEU 27 CO 0.83 -0.49 0.13 -0.55 0.02 0.00 0.00 176.35 176.29 3flz s SER 28 N 0.59 0.95 -0.03 2.29 0.15 0.23 -4.98 113.70 112.90 3flz s SER 28 Ca 0.57 0.20 -0.37 0.00 0.70 0.00 0.00 55.95 57.06 3flz s SER 28 Cb -0.34 0.14 -0.15 0.00 -1.71 0.00 0.00 66.02 63.96 3flz s SER 28 CO 0.34 -0.25 1.59 -2.65 1.20 0.00 0.00 173.24 173.46 3flz n PRO 29 N 5.32 1.51 -0.03 5.44 -0.02 -1.26 -0.64 135.00 145.32 3flz n PRO 29 Ca -0.04 0.55 -0.07 0.00 -2.02 0.00 0.00 63.50 61.92 3flz n PRO 29 Cb 0.50 -2.26 -0.02 0.00 -0.02 0.00 0.00 33.50 31.69 3flz n PRO 29 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3flz n VAL 30 N 3.71 1.15 -2.88 -1.45 0.31 -0.66 -4.85 118.33 113.66 3flz n VAL 30 Ca 0.21 0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.69 3flz n VAL 30 Cb 0.21 -1.85 0.00 0.00 -0.91 0.00 0.00 33.84 31.29 3flz n VAL 30 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3flz n GLY 31 N 2.48 1.53 3.69 2.92 0.00 -1.22 -5.04 105.19 109.55 3flz n GLY 31 Ca -0.12 -0.74 -0.36 0.00 0.00 0.00 0.00 46.02 44.80 3flz n GLY 31 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3flz s SER 32 N 1.02 6.09 0.52 1.61 0.15 -1.26 -1.83 113.70 120.00 3flz s SER 32 Ca 0.00 0.16 0.04 0.00 0.70 0.00 0.00 55.95 56.84 3flz s SER 32 Cb 0.00 -2.08 0.01 0.00 -1.71 0.00 0.00 66.02 62.24 3flz s SER 32 CO 0.00 0.13 0.20 -0.83 1.20 0.00 0.00 173.24 173.94 3flz s GLY 33 N 0.67 2.67 -0.31 9.45 0.00 0.03 -4.91 107.32 114.92 3flz s GLY 33 Ca 0.07 -0.92 -0.28 0.00 0.00 0.00 0.00 44.72 43.60 3flz s GLY 33 CO 0.01 -2.06 2.13 0.00 0.00 0.00 0.00 173.10 173.18 3flz s ALA 34 N -2.81 2.54 -1.39 3.20 0.00 -1.26 -3.05 121.76 119.00 3flz s ALA 34 Ca 0.21 0.44 0.00 0.00 0.00 0.00 0.00 51.96 52.62 3flz s ALA 34 Cb 0.00 -4.12 0.00 0.00 0.00 0.00 0.00 23.12 19.00 3flz s ALA 34 CO 0.13 -3.10 0.00 0.66 0.00 0.00 0.00 175.76 173.45 3flz n TYR 35 N 12.13 -0.49 0.00 0.00 4.01 -1.26 -4.94 117.16 126.61 3flz n TYR 35 Ca 0.29 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.03 3flz n TYR 35 Cb 0.47 -3.00 0.00 0.00 -0.31 0.00 0.00 39.34 36.51 3flz n TYR 35 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3flz n GLY 36 N -1.05 0.81 3.87 2.72 0.00 -1.17 -2.59 105.19 107.77 3flz n GLY 36 Ca -0.17 -0.84 -0.34 0.00 0.00 0.00 0.00 46.02 44.67 3flz n GLY 36 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3flz s SER 37 N 0.00 6.63 -0.02 1.61 1.04 -1.15 -0.79 113.70 121.01 3flz s SER 37 Ca 0.00 0.78 0.01 0.00 0.48 0.00 0.00 55.95 57.22 3flz s SER 37 Cb 0.00 -2.17 -0.04 0.00 0.10 0.00 0.00 66.02 63.91 3flz s SER 37 CO 0.00 0.16 0.01 -0.69 0.98 0.00 0.00 173.24 173.70 3flz s VAL 38 N -1.42 4.24 -0.02 5.02 1.01 -0.76 -2.31 120.40 126.17 3flz s VAL 38 Ca 0.34 -0.50 0.06 0.00 0.00 0.00 0.00 61.98 61.88 3flz s VAL 38 Cb -0.14 -2.87 -0.01 0.00 0.00 0.00 0.00 36.38 33.36 3flz s VAL 38 CO 0.18 0.43 -0.20 0.00 0.00 0.00 0.00 175.10 175.51 3flz s ALA 40 N -0.44 3.27 0.18 0.00 0.00 0.18 0.38 121.76 125.33 3flz s ALA 40 Ca 0.07 0.31 -0.18 0.00 0.00 0.00 0.00 51.96 52.16 3flz s ALA 40 Cb -0.08 -2.99 0.04 0.00 0.00 0.00 0.00 23.12 20.08 3flz s ALA 40 CO -0.01 0.24 0.51 0.00 0.00 0.00 0.00 175.76 176.51 3flz s ALA 41 N -1.73 -1.04 -0.29 0.00 0.00 -0.50 -0.60 121.76 117.61 3flz s ALA 41 Ca 0.50 -0.09 -0.11 0.00 0.00 0.00 0.00 51.96 52.27 3flz s ALA 41 Cb -0.15 0.83 -0.04 0.00 0.00 0.00 0.00 23.12 23.76 3flz s ALA 41 CO 0.20 -0.77 0.18 0.12 0.00 0.00 0.00 175.76 175.48 3flz s PHE 42 N -3.84 3.20 -0.61 0.00 5.36 0.59 -1.07 117.98 121.61 3flz s PHE 42 Ca 0.07 -0.08 -0.25 0.00 -0.96 0.00 0.00 56.93 55.70 3flz s PHE 42 Cb -0.01 -2.37 0.04 0.00 -0.34 0.00 0.00 43.02 40.35 3flz s PHE 42 CO -0.06 -0.25 1.05 0.34 -1.46 0.00 0.00 175.22 174.84 3flz s ASP 43 N 1.72 6.30 0.54 6.13 2.15 -0.33 -1.33 116.67 131.84 3flz s ASP 43 Ca 0.07 -0.40 0.32 0.00 0.43 0.00 0.00 52.55 52.97 3flz s ASP 43 Cb -0.16 -2.47 1.41 0.00 -0.30 0.00 0.00 42.92 41.39 3flz s ASP 43 CO 0.09 -1.41 2.01 0.71 -0.17 0.00 0.00 175.17 176.40 3flz h THR 44 N 6.04 0.17 -0.03 1.71 1.35 -1.21 0.25 112.91 121.20 3flz h THR 44 Ca -0.27 -0.58 -0.18 0.00 -0.55 0.00 0.00 66.41 64.84 3flz h THR 44 Cb 1.07 1.48 -0.01 0.00 -1.73 0.00 0.00 68.15 68.96 3flz h THR 44 CO 1.15 0.06 -0.78 0.11 -0.25 0.00 0.00 175.52 175.81 3flz h LYS 45 N 0.00 0.24 0.00 4.72 1.79 -1.91 -3.37 116.57 118.04 3flz h LYS 45 Ca -0.00 -0.22 -0.03 0.00 -2.18 0.00 0.00 60.65 58.21 3flz h LYS 45 Cb 0.48 0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.18 3flz h LYS 45 CO 0.01 0.91 -1.47 0.25 -1.08 0.00 0.00 179.45 178.07 3flz n THR 46 N -3.75 0.12 -0.87 -0.16 -2.24 -1.08 -5.00 114.28 101.30 3flz n THR 46 Ca -0.03 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 3flz n THR 46 Cb 0.74 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 69.03 3flz n THR 46 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3flz n GLY 47 N 2.07 0.71 3.85 3.38 0.00 0.86 -5.04 105.19 111.02 3flz n GLY 47 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 3flz n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3flz s LEU 48 N 0.00 4.29 -0.01 0.99 1.43 -1.21 -4.89 118.68 119.27 3flz s LEU 48 Ca 0.00 1.05 -0.26 0.00 -1.03 0.00 0.00 54.13 53.89 3flz s LEU 48 Cb 0.00 -3.40 -0.04 0.00 0.03 0.00 0.00 46.19 42.78 3flz s LEU 48 CO 0.00 0.05 0.80 -0.13 0.23 0.00 0.00 176.35 177.30 3flz s ARG 49 N -2.19 4.50 0.14 1.70 0.52 -1.26 -1.19 118.95 121.16 3flz s ARG 49 Ca 0.41 1.09 0.08 0.00 -0.52 0.00 0.00 55.73 56.78 3flz s ARG 49 Cb -0.14 -3.42 -0.04 0.00 0.52 0.00 0.00 34.95 31.87 3flz s ARG 49 CO 0.20 0.11 -0.17 0.14 0.02 0.00 0.00 175.30 175.60 3flz s VAL 50 N 0.54 1.65 -0.20 3.52 -7.23 -0.23 -1.61 120.40 116.85 3flz s VAL 50 Ca 0.42 -1.80 -0.08 0.00 -1.81 0.00 0.00 61.98 58.70 3flz s VAL 50 Cb -0.20 -1.70 -0.04 0.00 0.56 0.00 0.00 36.38 35.00 3flz s VAL 50 CO 0.22 -0.31 0.09 0.00 -0.31 0.00 0.00 175.10 174.79 3flz s ALA 51 N -1.94 3.45 -0.25 1.32 0.00 0.67 -1.41 121.76 123.60 3flz s ALA 51 Ca 0.12 -0.80 -0.01 0.00 0.00 0.00 0.00 51.96 51.27 3flz s ALA 51 Cb -0.06 -2.04 0.03 0.00 0.00 0.00 0.00 23.12 21.06 3flz s ALA 51 CO 0.05 0.05 -0.07 0.08 0.00 0.00 0.00 175.76 175.88 3flz s VAL 52 N 0.60 2.75 -0.23 0.00 1.01 0.16 -1.07 120.40 123.62 3flz s VAL 52 Ca 0.05 -1.16 -0.08 0.00 0.00 0.00 0.00 61.98 60.78 3flz s VAL 52 Cb -0.13 -2.44 -0.04 0.00 0.00 0.00 0.00 36.38 33.77 3flz s VAL 52 CO 0.01 0.14 0.10 -0.75 0.00 0.00 0.00 175.10 174.59 3flz s LYS 53 N 1.28 3.85 -0.29 2.72 2.20 0.37 -0.28 119.74 129.60 3flz s LYS 53 Ca -0.02 -0.39 -0.14 0.00 -0.36 0.00 0.00 55.97 55.06 3flz s LYS 53 Cb -0.17 -3.36 -0.03 0.00 -1.51 0.00 0.00 37.83 32.75 3flz s LYS 53 CO -0.04 -0.00 0.34 0.21 -0.36 0.00 0.00 175.35 175.50 3flz s LYS 54 N 1.15 3.92 0.27 4.03 2.20 -0.98 -0.62 119.74 129.71 3flz s LYS 54 Ca 0.05 -0.10 -0.29 0.00 -0.36 0.00 0.00 55.97 55.27 3flz s LYS 54 Cb -0.14 -3.69 -0.09 0.00 -1.51 0.00 0.00 37.83 32.40 3flz s LYS 54 CO 0.04 -0.31 1.21 -0.51 -0.36 0.00 0.00 175.35 175.42 3flz s LEU 55 N 2.02 4.48 -0.12 5.43 1.43 -0.98 -2.95 118.68 127.98 3flz s LEU 55 Ca 0.13 2.42 -0.19 0.00 -1.03 0.00 0.00 54.13 55.46 3flz s LEU 55 Cb -0.16 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.39 3flz s LEU 55 CO 0.10 -0.36 0.52 -0.94 0.23 0.00 0.00 176.35 175.91 3flz s SER 56 N -0.43 6.72 -0.42 2.29 1.04 -1.07 -4.50 113.70 117.33 3flz s SER 56 Ca 0.49 0.86 -0.05 0.00 0.48 0.00 0.00 55.95 57.72 3flz s SER 56 Cb -0.35 -2.31 0.01 0.00 0.10 0.00 0.00 66.02 63.47 3flz s SER 56 CO 0.44 -0.05 0.35 0.54 0.98 0.00 0.00 173.24 175.50 3flz n ARG 57 N 3.89 -0.94 0.29 4.02 3.00 -1.26 -4.83 116.66 120.83 3flz n ARG 57 Ca -0.06 0.52 0.18 0.00 -0.01 0.00 0.00 57.85 58.48 3flz n ARG 57 Cb 0.51 -1.23 0.84 0.00 0.00 0.00 0.00 32.46 32.57 3flz n ARG 57 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.63 176.63 3flz h PRO 58 N 0.48 0.00 -0.21 5.56 0.13 -1.83 -3.27 132.00 132.86 3flz h PRO 58 Ca -0.36 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.57 3flz h PRO 58 Cb 0.81 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 31.68 3flz h PRO 58 CO 0.19 0.03 -0.82 1.19 -0.23 0.00 0.00 178.00 178.37 3flz n PHE 59 N -3.20 0.73 0.49 1.56 3.01 -1.26 -2.75 117.46 116.04 3flz n PHE 59 Ca -0.01 -1.45 0.13 0.00 1.01 0.00 0.00 57.45 57.13 3flz n PHE 59 Cb 0.23 -0.23 0.30 0.00 -0.01 0.00 0.00 39.48 39.77 3flz n PHE 59 CO 0.00 0.00 0.00 -0.56 1.01 0.00 0.00 176.76 177.21 3flz h GLN 60 N 1.49 0.00 -3.70 -1.08 3.07 -1.92 -3.46 115.11 109.50 3flz h GLN 60 Ca -0.02 0.00 -0.08 0.00 0.09 0.00 0.00 58.65 58.64 3flz h GLN 60 Cb 1.41 0.00 -0.09 0.00 0.08 0.00 0.00 27.48 28.88 3flz h GLN 60 CO 0.20 0.00 -0.13 -1.54 0.09 0.00 0.00 178.83 177.45 3flz s SER 61 N -5.00 -0.02 0.14 0.06 1.04 -1.26 -5.00 113.70 103.66 3flz s SER 61 Ca 0.09 -0.99 -0.17 0.00 0.48 0.00 0.00 55.95 55.36 3flz s SER 61 Cb 0.10 0.59 -0.01 0.00 0.10 0.00 0.00 66.02 66.81 3flz s SER 61 CO 0.64 -1.15 1.75 0.40 0.98 0.00 0.00 173.24 175.86 3flz h ILE 62 N 2.25 1.14 -0.56 -1.02 2.04 -1.95 0.21 117.51 119.63 3flz h ILE 62 Ca -0.27 -0.35 0.09 0.00 1.00 0.00 0.00 64.86 65.33 3flz h ILE 62 Cb 1.25 0.69 -0.07 0.00 -0.74 0.00 0.00 36.82 37.96 3flz h ILE 62 CO 0.36 0.14 0.18 0.40 0.00 0.00 0.00 178.15 179.24 3flz h ILE 63 N 0.48 0.76 -0.24 -0.67 1.08 -1.98 -0.44 117.51 116.51 3flz h ILE 63 Ca 0.13 -0.12 -0.07 0.00 -0.39 0.00 0.00 64.86 64.42 3flz h ILE 63 Cb 0.04 0.39 -0.01 0.00 -3.07 0.00 0.00 36.82 34.18 3flz h ILE 63 CO -0.02 0.06 -0.12 0.45 -0.69 0.00 0.00 178.15 177.83 3flz h HIS 64 N 0.35 0.58 -0.44 1.37 3.86 -1.79 -2.40 115.15 116.67 3flz h HIS 64 Ca 0.28 -0.14 -0.01 0.00 -1.16 0.00 0.00 60.37 59.33 3flz h HIS 64 Cb 0.34 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.66 3flz h HIS 64 CO -0.18 0.77 0.22 0.00 0.86 0.00 0.00 177.93 179.60 3flz h ALA 65 N 0.72 0.57 -0.65 2.45 0.00 -0.23 -0.78 119.26 121.35 3flz h ALA 65 Ca 0.05 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 3flz h ALA 65 Cb 0.62 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 3flz h ALA 65 CO 0.04 0.13 0.17 -0.22 0.00 0.00 0.00 179.25 179.36 3flz h LYS 66 N 0.58 1.03 -0.67 0.00 3.64 -1.16 -1.96 116.57 118.02 3flz h LYS 66 Ca 0.15 -0.24 0.02 0.00 -1.27 0.00 0.00 60.65 59.31 3flz h LYS 66 Cb 0.11 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 31.75 3flz h LYS 66 CO -0.02 0.92 0.42 -0.09 -2.27 0.00 0.00 179.45 178.41 3flz h ARG 67 N 0.95 0.82 -0.14 1.90 2.43 -1.09 0.20 114.38 119.44 3flz h ARG 67 Ca 0.20 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.32 3flz h ARG 67 Cb 0.34 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 3flz h ARG 67 CO -0.00 0.54 0.08 1.15 -1.51 0.00 0.00 179.97 180.23 3flz h THR 68 N 0.84 1.10 -0.60 0.20 2.02 -1.01 -1.04 112.91 114.43 3flz h THR 68 Ca 0.26 -0.29 0.02 0.00 0.77 0.00 0.00 66.41 67.17 3flz h THR 68 Cb -0.02 1.04 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 3flz h THR 68 CO -0.09 0.10 0.38 0.22 0.37 0.00 0.00 175.52 176.50 3flz h TYR 69 N 0.12 0.73 0.11 3.16 3.20 -0.97 -1.69 116.97 121.64 3flz h TYR 69 Ca 0.05 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.94 3flz h TYR 69 Cb 0.09 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.11 3flz h TYR 69 CO -0.04 0.44 -0.10 -0.09 -1.64 0.00 0.00 178.16 176.73 3flz h ARG 70 N 0.77 -0.23 -0.30 1.82 2.43 -0.43 0.12 114.38 118.57 3flz h ARG 70 Ca 0.23 0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.42 3flz h ARG 70 Cb -0.04 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 3flz h ARG 70 CO -0.07 -0.15 0.18 1.49 -1.51 0.00 0.00 179.97 179.91 3flz h GLU 71 N -0.24 0.37 -0.32 0.20 4.81 -1.07 -0.32 114.58 118.01 3flz h GLU 71 Ca 0.00 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.23 3flz h GLU 71 Cb 0.22 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.50 3flz h GLU 71 CO -0.02 0.24 0.18 1.25 -0.73 0.00 0.00 179.01 179.93 3flz h LEU 72 N 0.38 0.27 -0.49 1.64 5.85 -1.18 -0.26 115.31 121.52 3flz h LEU 72 Ca 0.11 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.87 3flz h LEU 72 Cb -0.02 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 3flz h LEU 72 CO -0.04 0.20 0.29 0.03 -0.34 0.00 0.00 178.44 178.58 3flz h ARG 73 N 0.36 0.56 -0.23 1.25 2.47 -0.49 -1.74 114.38 116.56 3flz h ARG 73 Ca 0.13 -0.03 -0.02 0.00 -1.26 0.00 0.00 59.98 58.80 3flz h ARG 73 Cb 0.02 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.21 3flz h ARG 73 CO -0.08 0.37 0.06 -0.07 0.56 0.00 0.00 179.97 180.82 3flz h LEU 74 N 0.58 0.35 -0.86 3.04 3.38 -0.78 -2.72 115.31 118.28 3flz h LEU 74 Ca 0.20 -0.22 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 3flz h LEU 74 Cb 0.03 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3flz h LEU 74 CO -0.10 0.47 -0.21 -0.07 0.09 0.00 0.00 178.44 178.63 3flz h LEU 75 N 0.20 0.61 -1.49 1.67 3.38 -0.98 -2.77 115.31 115.94 3flz h LEU 75 Ca 0.07 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 3flz h LEU 75 Cb 0.26 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 3flz h LEU 75 CO -0.00 0.82 -0.23 0.11 0.09 0.00 0.00 178.44 179.23 3flz h LYS 76 N 0.55 0.00 0.08 1.13 1.57 -1.28 -3.18 116.57 115.44 3flz h LYS 76 Ca 0.08 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.60 3flz h LYS 76 Cb 0.65 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.95 3flz h LYS 76 CO 0.05 0.23 -1.23 1.25 -0.57 0.00 0.00 179.45 179.18 3flz h HIS 77 N 0.00 0.31 -3.45 -1.35 2.76 -1.20 -3.46 115.15 108.76 3flz h HIS 77 Ca -0.00 -0.23 -0.56 0.00 -2.20 0.00 0.00 60.37 57.38 3flz h HIS 77 Cb 0.55 -0.01 -0.07 0.00 1.55 0.00 0.00 27.41 29.43 3flz h HIS 77 CO 0.00 1.20 0.97 -1.64 -1.30 0.00 0.00 177.93 177.16 3flz s MET 78 N -2.66 3.61 -0.63 5.26 -1.94 -1.13 -4.93 119.30 116.87 3flz s MET 78 Ca -0.03 0.50 0.05 0.00 -1.71 0.00 0.00 55.69 54.49 3flz s MET 78 Cb 0.08 -3.97 0.17 0.00 2.01 0.00 0.00 34.83 33.12 3flz s MET 78 CO 0.86 -1.54 0.47 1.63 -0.01 0.00 0.00 175.02 176.43 3flz n LYS 79 N 8.12 1.44 -3.80 2.03 5.02 -1.26 -4.50 118.16 125.22 3flz n LYS 79 Ca 0.11 -4.16 -0.12 0.00 -2.02 0.00 0.00 58.31 52.12 3flz n LYS 79 Cb 0.49 -2.13 -0.11 0.00 -0.02 0.00 0.00 35.03 33.26 3flz n LYS 79 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 3flz s HIS 80 N -1.12 -0.21 0.37 2.13 2.46 -1.26 -5.06 115.29 112.60 3flz s HIS 80 Ca 0.27 0.49 0.09 0.00 0.47 0.00 0.00 55.06 56.38 3flz s HIS 80 Cb -0.01 0.07 0.83 0.00 -0.13 0.00 0.00 32.58 33.33 3flz s HIS 80 CO -0.17 -0.17 1.92 0.93 -2.47 0.00 0.00 174.74 174.77 3flz h GLU 81 N 5.38 0.65 -0.67 2.88 5.08 -1.97 -2.70 114.58 123.23 3flz h GLU 81 Ca -0.27 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 3flz h GLU 81 Cb 1.19 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.30 3flz h GLU 81 CO 0.37 0.43 0.00 0.09 -1.00 0.00 0.00 179.01 178.90 3flz n ASN 82 N -4.51 4.61 -4.06 1.42 5.03 -1.26 -4.71 115.26 111.77 3flz n ASN 82 Ca 0.14 -2.36 -0.22 0.00 0.87 0.00 0.00 54.58 53.01 3flz n ASN 82 Cb 0.37 -0.56 -0.15 0.00 -1.02 0.00 0.00 39.78 38.41 3flz n ASN 82 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3flz s VAL 83 N -1.67 1.01 0.11 2.41 1.01 -1.02 -0.88 120.40 121.37 3flz s VAL 83 Ca 0.51 -0.51 -0.34 0.00 0.00 0.00 0.00 61.98 61.64 3flz s VAL 83 Cb 0.31 -0.87 -0.13 0.00 0.00 0.00 0.00 36.38 35.69 3flz s VAL 83 CO 0.26 0.30 1.65 0.00 0.00 0.00 0.00 175.10 177.31 3flz n ILE 84 N 3.03 0.13 -4.43 2.22 0.00 -0.55 -4.53 119.36 115.24 3flz n ILE 84 Ca -0.16 -0.02 -0.25 0.00 0.00 0.00 0.00 62.75 62.31 3flz n ILE 84 Cb 0.55 -1.64 -0.09 0.00 0.00 0.00 0.00 39.64 38.45 3flz n ILE 84 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 3flz s GLY 85 N 1.64 2.12 -0.37 4.50 0.00 -1.26 -4.82 107.32 109.13 3flz s GLY 85 Ca 0.82 -2.01 -0.17 0.00 0.00 0.00 0.00 44.72 43.35 3flz s GLY 85 CO 0.41 -1.96 0.46 -2.27 0.00 0.00 0.00 173.10 169.74 3flz s LEU 86 N -3.67 4.48 0.11 0.66 2.96 -1.24 -4.52 118.68 117.46 3flz s LEU 86 Ca 0.34 -0.23 -0.09 0.00 -0.22 0.00 0.00 54.13 53.93 3flz s LEU 86 Cb 0.01 -2.48 -0.13 0.00 0.50 0.00 0.00 46.19 44.09 3flz s LEU 86 CO 0.18 -0.48 1.29 -0.07 -1.32 0.00 0.00 176.35 175.96 3flz h LEU 87 N 9.02 0.74 -7.00 -0.68 3.38 -1.35 -3.42 115.31 116.00 3flz h LEU 87 Ca -0.28 -0.55 -0.03 0.00 0.09 0.00 0.00 57.88 57.12 3flz h LEU 87 Cb 1.13 -0.22 -0.16 0.00 0.09 0.00 0.00 40.66 41.49 3flz h LEU 87 CO 0.76 1.34 0.23 -0.62 0.09 0.00 0.00 178.44 180.25 3flz s ASP 88 N -7.14 -0.59 -0.06 -0.43 3.68 -1.14 -4.56 116.67 106.44 3flz s ASP 88 Ca -0.08 0.35 -0.04 0.00 2.13 0.00 0.00 52.55 54.91 3flz s ASP 88 Cb 0.08 0.54 0.02 0.00 -1.45 0.00 0.00 42.92 42.12 3flz s ASP 88 CO 0.89 -0.75 0.14 0.54 0.13 0.00 0.00 175.17 176.11 3flz s VAL 89 N -2.41 -0.02 0.12 1.11 0.11 -1.26 -0.67 120.40 117.38 3flz s VAL 89 Ca -0.04 0.06 -0.13 0.00 -2.93 0.00 0.00 61.98 58.93 3flz s VAL 89 Cb -0.01 -0.21 0.02 0.00 -1.53 0.00 0.00 36.38 34.65 3flz s VAL 89 CO -0.02 0.02 0.33 0.72 -3.33 0.00 0.00 175.10 172.83 3flz s PHE 90 N 0.44 -0.05 -0.00 1.54 -0.12 -0.84 -4.99 117.98 113.95 3flz s PHE 90 Ca -0.03 -0.31 0.01 0.00 -0.05 0.00 0.00 56.93 56.56 3flz s PHE 90 Cb -0.04 0.14 -0.00 0.00 -0.63 0.00 0.00 43.02 42.48 3flz s PHE 90 CO -0.02 -0.66 -0.05 -0.08 -0.05 0.00 0.00 175.22 174.37 3flz s THR 91 N -3.83 0.38 0.47 -4.49 -1.32 -1.26 -1.85 115.64 103.74 3flz s THR 91 Ca 0.04 -0.20 0.38 0.00 -1.21 0.00 0.00 61.69 60.70 3flz s THR 91 Cb 0.03 -0.33 0.40 0.00 -1.51 0.00 0.00 72.50 71.09 3flz s THR 91 CO -0.11 0.11 2.21 1.55 -2.21 0.00 0.00 174.62 176.18 3flz h PRO 92 N 6.05 0.00 -6.84 7.08 0.13 -1.83 -3.45 132.00 133.14 3flz h PRO 92 Ca -0.28 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.29 3flz h PRO 92 Cb 1.19 0.00 0.13 0.00 0.13 0.00 0.00 31.00 32.45 3flz h PRO 92 CO 0.50 0.02 0.46 0.00 -0.23 0.00 0.00 178.00 178.75 3flz n ALA 93 N -2.13 1.19 0.95 -0.56 0.00 -1.26 -4.94 120.51 113.76 3flz n ALA 93 Ca -0.02 0.23 0.10 0.00 0.00 0.00 0.00 53.44 53.75 3flz n ALA 93 Cb 0.16 -2.25 -0.10 0.00 0.00 0.00 0.00 19.45 17.26 3flz n ALA 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3flz n ARG 94 N -0.12 0.49 -3.81 0.00 1.74 -1.26 -4.99 116.66 108.71 3flz n ARG 94 Ca 0.08 -0.17 -0.09 0.00 -0.77 0.00 0.00 57.85 56.89 3flz n ARG 94 Cb 0.40 -1.45 -0.04 0.00 -1.02 0.00 0.00 32.46 30.35 3flz n ARG 94 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3flz s SER 95 N -2.82 -0.19 0.39 0.55 1.04 -1.26 -5.04 113.70 106.36 3flz s SER 95 Ca 0.09 -0.61 0.08 0.00 0.48 0.00 0.00 55.95 56.00 3flz s SER 95 Cb 0.16 0.57 0.83 0.00 0.10 0.00 0.00 66.02 67.67 3flz s SER 95 CO 0.78 -1.06 1.99 0.25 0.98 0.00 0.00 173.24 176.18 3flz h LEU 96 N 2.24 0.56 -1.10 2.42 5.85 -1.96 -2.46 115.31 120.86 3flz h LEU 96 Ca -0.28 -0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.35 3flz h LEU 96 Cb 1.25 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.15 3flz h LEU 96 CO 0.38 0.37 -0.44 1.05 -0.34 0.00 0.00 178.44 179.45 3flz h GLU 97 N 0.64 0.00 -0.56 1.25 9.09 -2.02 -2.75 114.58 120.23 3flz h GLU 97 Ca 0.26 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.67 3flz h GLU 97 Cb 0.23 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.33 3flz h GLU 97 CO -0.08 0.44 0.00 -0.85 0.05 0.00 0.00 179.01 178.57 3flz n GLU 98 N -3.95 3.05 -2.57 1.06 0.28 -1.08 -4.96 120.64 112.47 3flz n GLU 98 Ca -0.02 -2.55 -0.43 0.00 -0.16 0.00 0.00 57.16 54.00 3flz n GLU 98 Cb 0.47 -1.58 -0.02 0.00 1.43 0.00 0.00 31.44 31.74 3flz n GLU 98 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 3flz s PHE 99 N -1.34 2.92 0.00 -1.84 5.36 -0.95 -4.63 117.98 117.51 3flz s PHE 99 Ca 0.41 0.97 0.00 0.00 -0.96 0.00 0.00 56.93 57.35 3flz s PHE 99 Cb 0.24 -3.98 0.00 0.00 -0.34 0.00 0.00 43.02 38.94 3flz s PHE 99 CO 0.24 -1.16 0.00 -1.71 -1.46 0.00 0.00 175.22 171.13 3flz n ASN 100 N 7.40 0.49 -4.29 6.13 5.15 -1.26 -5.03 115.26 123.83 3flz n ASN 100 Ca 0.13 0.00 -0.26 0.00 -0.60 0.00 0.00 54.58 53.85 3flz n ASN 100 Cb 0.48 0.09 -0.13 0.00 -0.53 0.00 0.00 39.78 39.68 3flz n ASN 100 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 3flz s ASP 101 N -0.32 2.71 -0.06 1.20 -0.00 -1.26 -4.67 116.67 114.26 3flz s ASP 101 Ca 0.00 -0.62 0.02 0.00 -0.00 0.00 0.00 52.55 51.95 3flz s ASP 101 Cb 0.00 -0.20 0.02 0.00 -0.00 0.00 0.00 42.92 42.74 3flz s ASP 101 CO 0.00 0.14 -0.09 -0.69 -0.00 0.00 0.00 175.17 174.53 3flz s VAL 102 N -0.95 0.93 -0.06 -1.27 1.01 -1.26 -4.54 120.40 114.26 3flz s VAL 102 Ca 0.09 -0.34 0.06 0.00 0.00 0.00 0.00 61.98 61.78 3flz s VAL 102 Cb -0.10 -0.89 -0.01 0.00 0.00 0.00 0.00 36.38 35.38 3flz s VAL 102 CO 0.03 0.32 -0.24 -0.31 0.00 0.00 0.00 175.10 174.90 3flz s TYR 103 N 0.86 2.47 -0.02 5.22 1.51 -0.77 -2.32 117.35 124.31 3flz s TYR 103 Ca -0.11 -0.66 0.06 0.00 -1.01 0.00 0.00 57.07 55.35 3flz s TYR 103 Cb -0.15 -1.61 -0.02 0.00 -0.11 0.00 0.00 41.96 40.07 3flz s TYR 103 CO 0.01 -0.17 -0.21 -0.51 -1.11 0.00 0.00 175.55 173.56 3flz s LEU 104 N -0.21 2.39 -0.08 -1.29 1.43 0.21 -1.99 118.68 119.15 3flz s LEU 104 Ca -0.02 -0.37 0.03 0.00 -1.03 0.00 0.00 54.13 52.74 3flz s LEU 104 Cb -0.13 -1.44 0.01 0.00 0.03 0.00 0.00 46.19 44.65 3flz s LEU 104 CO 0.03 0.32 -0.16 -0.69 0.23 0.00 0.00 176.35 176.08 3flz s VAL 105 N -0.71 1.46 0.30 -1.59 1.01 0.16 -0.48 120.40 120.55 3flz s VAL 105 Ca 0.11 -0.67 0.06 0.00 0.00 0.00 0.00 61.98 61.47 3flz s VAL 105 Cb -0.10 -1.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 3flz s VAL 105 CO 0.01 0.43 0.25 0.28 0.00 0.00 0.00 175.10 176.06 3flz s THR 106 N 0.53 0.00 0.35 3.92 -1.32 -0.23 -0.84 115.64 118.05 3flz s THR 106 Ca -0.16 -2.00 -0.28 0.00 -1.21 0.00 0.00 61.69 58.04 3flz s THR 106 Cb -0.16 -2.50 -0.11 0.00 -1.51 0.00 0.00 72.50 68.22 3flz s THR 106 CO 0.05 0.00 1.43 -1.00 -2.21 0.00 0.00 174.62 172.89 3flz s HIS 107 N -3.60 2.77 0.00 9.09 3.76 -1.26 -0.24 115.29 125.81 3flz s HIS 107 Ca 0.40 1.23 -0.30 0.00 -0.15 0.00 0.00 55.06 56.24 3flz s HIS 107 Cb 0.03 -3.90 -0.04 0.00 1.11 0.00 0.00 32.58 29.78 3flz s HIS 107 CO 0.24 -2.62 1.12 -1.17 -0.85 0.00 0.00 174.74 171.47 3flz s LEU 108 N -1.86 4.34 0.08 0.89 2.96 -0.63 -4.20 118.68 120.25 3flz s LEU 108 Ca 0.52 1.83 0.02 0.00 -0.22 0.00 0.00 54.13 56.28 3flz s LEU 108 Cb -0.44 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.64 3flz s LEU 108 CO 0.58 -0.44 0.13 -0.04 -1.32 0.00 0.00 176.35 175.27 3flz s MET 109 N 1.39 3.09 -0.07 1.98 -1.94 -1.26 -4.91 119.30 117.58 3flz s MET 109 Ca 0.55 -0.61 -0.18 0.00 -1.71 0.00 0.00 55.69 53.75 3flz s MET 109 Cb -0.25 -2.84 -0.14 0.00 2.01 0.00 0.00 34.83 33.61 3flz s MET 109 CO 0.26 0.58 0.68 0.78 -0.01 0.00 0.00 175.02 177.31 3flz h GLY 110 N 3.17 -0.18 -2.45 -0.03 0.00 -1.96 -3.48 103.07 98.14 3flz h GLY 110 Ca -0.46 0.07 -0.19 0.00 0.00 0.00 0.00 47.33 46.75 3flz h GLY 110 CO 0.69 -0.07 -0.45 0.00 0.00 0.00 0.00 176.54 176.72 3flz s ALA 111 N -3.29 0.74 0.33 3.60 0.00 -1.15 -5.04 121.76 116.95 3flz s ALA 111 Ca -0.11 -1.45 0.04 0.00 0.00 0.00 0.00 51.96 50.45 3flz s ALA 111 Cb -0.00 1.29 0.04 0.00 0.00 0.00 0.00 23.12 24.45 3flz s ALA 111 CO 0.41 -0.68 0.36 -0.40 0.00 0.00 0.00 175.76 175.44 3flz n ASP 112 N -0.36 1.60 0.20 0.00 3.85 -1.26 -0.99 116.55 119.59 3flz n ASP 112 Ca 0.01 -1.99 0.08 0.00 -0.71 0.00 0.00 54.79 52.18 3flz n ASP 112 Cb 0.65 -0.14 0.32 0.00 -1.35 0.00 0.00 41.12 40.59 3flz n ASP 112 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.20 176.44 3flz h LEU 113 N 0.00 0.00 -0.18 -2.12 5.85 -0.22 -3.11 115.31 115.54 3flz h LEU 113 Ca -0.18 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.58 3flz h LEU 113 Cb 0.73 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.73 3flz h LEU 113 CO 0.27 0.28 -0.04 0.78 -0.34 0.00 0.00 178.44 179.38 3flz h ASN 114 N 0.00 -0.16 -0.13 1.25 -0.26 -1.86 -2.32 115.58 112.10 3flz h ASN 114 Ca -0.00 0.05 -0.05 0.00 -0.56 0.00 0.00 56.30 55.74 3flz h ASN 114 Cb 0.94 0.11 -0.01 0.00 -1.06 0.00 0.00 38.32 38.29 3flz h ASN 114 CO 0.04 -0.06 -0.05 0.78 -1.06 0.00 0.00 177.43 177.08 3flz h ASN 115 N 0.00 0.37 0.20 5.81 -0.26 -1.92 -2.37 115.58 117.41 3flz h ASN 115 Ca 0.08 -0.07 -0.01 0.00 -0.56 0.00 0.00 56.30 55.74 3flz h ASN 115 Cb 0.13 -0.10 0.00 0.00 -1.06 0.00 0.00 38.32 37.29 3flz h ASN 115 CO -0.18 0.48 -0.09 0.40 -1.06 0.00 0.00 177.43 176.97 3flz h ILE 116 N 0.38 0.87 -0.15 2.81 2.04 -1.56 -3.31 117.51 118.60 3flz h ILE 116 Ca 0.08 -0.90 0.05 0.00 1.00 0.00 0.00 64.86 65.09 3flz h ILE 116 Cb 0.34 1.36 -0.05 0.00 -0.74 0.00 0.00 36.82 37.72 3flz h ILE 116 CO 0.01 0.19 -0.19 0.58 0.00 0.00 0.00 178.15 178.74 3flz h VAL 117 N -0.75 0.51 -7.00 1.67 2.07 -1.33 -3.47 116.25 107.95 3flz h VAL 117 Ca -0.03 0.00 -0.58 0.00 0.82 0.00 0.00 66.70 66.91 3flz h VAL 117 Cb 0.51 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 3flz h VAL 117 CO 0.04 0.00 -0.97 2.29 0.02 0.00 0.00 177.57 178.96 3flz n LYS 118 N -5.33 -0.27 -0.36 1.57 2.85 -0.90 -0.13 118.16 115.58 3flz n LYS 118 Ca -0.02 0.03 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 3flz n LYS 118 Cb 0.25 -2.34 0.00 0.00 -0.65 0.00 0.00 35.03 32.29 3flz n LYS 118 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3flz s GLN 120 N -0.67 2.72 0.34 0.00 -2.07 0.82 -4.78 119.66 116.02 3flz s GLN 120 Ca 0.00 -0.84 -0.28 0.00 -1.82 0.00 0.00 55.36 52.42 3flz s GLN 120 Cb 0.00 -2.60 -0.10 0.00 -1.09 0.00 0.00 33.01 29.23 3flz s GLN 120 CO 0.00 0.52 1.23 0.15 -1.32 0.00 0.00 175.29 175.87 3flz s LYS 121 N -2.64 4.31 0.22 9.60 1.02 -1.26 -4.16 119.74 126.82 3flz s LYS 121 Ca 0.28 2.04 0.05 0.00 0.02 0.00 0.00 55.97 58.36 3flz s LYS 121 Cb -0.11 -2.98 -0.03 0.00 -0.52 0.00 0.00 37.83 34.19 3flz s LYS 121 CO 0.21 -0.16 0.33 -0.51 -0.92 0.00 0.00 175.35 174.30 3flz s LEU 122 N -1.94 4.28 0.70 3.17 1.02 -1.06 -5.00 118.68 119.85 3flz s LEU 122 Ca 0.51 0.07 -0.14 0.00 0.02 0.00 0.00 54.13 54.58 3flz s LEU 122 Cb -0.36 -2.83 0.02 0.00 0.02 0.00 0.00 46.19 43.04 3flz s LEU 122 CO 0.47 -0.04 1.13 0.42 0.02 0.00 0.00 176.35 178.34 3flz s THR 123 N -1.94 3.04 0.33 5.49 -4.23 -1.26 -4.83 115.64 112.24 3flz s THR 123 Ca 0.34 0.46 0.02 0.00 -1.18 0.00 0.00 61.69 61.33 3flz s THR 123 Cb -0.09 -2.96 0.28 0.00 1.34 0.00 0.00 72.50 71.06 3flz s THR 123 CO 0.29 -0.32 1.96 -0.78 -0.54 0.00 0.00 174.62 175.23 3flz h ASP 124 N -0.25 0.79 0.71 3.99 3.58 -1.98 -2.26 116.42 121.00 3flz h ASP 124 Ca -0.46 -0.01 -0.12 0.00 0.42 0.00 0.00 57.03 56.86 3flz h ASP 124 Cb 1.25 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 42.11 3flz h ASP 124 CO 0.52 0.53 -0.57 -0.78 -2.88 0.00 0.00 179.24 176.07 3flz h ASP 125 N 0.91 0.00 -0.40 2.28 3.58 -1.99 -0.87 116.42 119.93 3flz h ASP 125 Ca 0.31 0.00 -0.14 0.00 0.42 0.00 0.00 57.03 57.62 3flz h ASP 125 Cb 0.09 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.13 3flz h ASP 125 CO -0.09 0.57 -0.30 0.45 -2.88 0.00 0.00 179.24 176.99 3flz h HIS 126 N 0.00 1.06 -0.08 0.28 3.86 -1.80 -2.75 115.15 115.72 3flz h HIS 126 Ca -0.01 -0.30 -0.01 0.00 -1.16 0.00 0.00 60.37 58.90 3flz h HIS 126 Cb 1.08 -0.23 -0.00 0.00 1.06 0.00 0.00 27.41 29.32 3flz h HIS 126 CO 0.00 1.10 0.03 0.28 0.86 0.00 0.00 177.93 180.20 3flz h VAL 127 N 0.72 1.15 -0.54 2.45 2.07 -1.17 -1.47 116.25 119.46 3flz h VAL 127 Ca 0.08 -0.46 0.09 0.00 0.82 0.00 0.00 66.70 67.23 3flz h VAL 127 Cb 0.88 1.32 -0.11 0.00 -1.52 0.00 0.00 31.29 31.87 3flz h VAL 127 CO 0.08 0.13 -0.35 1.56 0.02 0.00 0.00 177.57 179.01 3flz h GLN 128 N -0.05 -0.19 -0.45 1.57 4.20 -1.20 -0.56 115.11 118.44 3flz h GLN 128 Ca 0.03 0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 3flz h GLN 128 Cb 0.19 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.99 3flz h GLN 128 CO -0.00 -0.13 0.17 0.35 -0.67 0.00 0.00 178.83 178.55 3flz h PHE 129 N -0.20 0.69 0.07 2.96 3.57 -1.29 0.60 116.94 123.34 3flz h PHE 129 Ca 0.21 -0.06 -0.00 0.00 3.53 0.00 0.00 57.97 61.65 3flz h PHE 129 Cb 0.55 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 39.09 3flz h PHE 129 CO -0.62 0.60 -0.03 -0.07 -2.23 0.00 0.00 178.31 175.96 3flz h LEU 130 N 0.58 -0.08 -0.67 0.59 3.38 -1.03 -2.64 115.31 115.44 3flz h LEU 130 Ca 0.15 -0.42 0.01 0.00 0.09 0.00 0.00 57.88 57.71 3flz h LEU 130 Cb 0.22 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 3flz h LEU 130 CO -0.01 0.40 0.44 0.40 0.09 0.00 0.00 178.44 179.76 3flz h ILE 131 N -0.58 1.15 -0.64 1.22 1.08 -1.13 -2.02 117.51 116.59 3flz h ILE 131 Ca -0.01 -0.30 0.14 0.00 -0.39 0.00 0.00 64.86 64.29 3flz h ILE 131 Cb 0.49 0.18 -0.11 0.00 -3.07 0.00 0.00 36.82 34.32 3flz h ILE 131 CO 0.02 0.16 0.01 0.22 -0.69 0.00 0.00 178.15 177.86 3flz h TYR 132 N 0.89 -0.03 -0.49 1.37 3.20 -0.87 -0.26 116.97 120.77 3flz h TYR 132 Ca 0.25 0.05 -0.08 0.00 3.14 0.00 0.00 58.73 62.09 3flz h TYR 132 Cb -0.07 0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.30 3flz h TYR 132 CO -0.03 -0.17 -0.02 1.96 -1.64 0.00 0.00 178.16 178.26 3flz h GLN 133 N 0.12 0.89 -0.24 1.82 4.20 -1.08 -0.26 115.11 120.55 3flz h GLN 133 Ca 0.34 -0.29 0.03 0.00 0.06 0.00 0.00 58.65 58.79 3flz h GLN 133 Cb 0.56 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.23 3flz h GLN 133 CO -0.55 0.93 0.06 0.82 -0.67 0.00 0.00 178.83 179.41 3flz h ILE 134 N 0.74 0.90 -0.10 2.54 2.04 -0.82 -1.26 117.51 121.55 3flz h ILE 134 Ca 0.14 -0.05 -0.08 0.00 1.00 0.00 0.00 64.86 65.87 3flz h ILE 134 Cb 0.54 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.34 3flz h ILE 134 CO 0.03 0.03 -0.29 -0.07 0.00 0.00 0.00 178.15 177.85 3flz h LEU 135 N 0.15 0.18 -0.06 1.44 3.38 -0.82 0.62 115.31 120.20 3flz h LEU 135 Ca 0.11 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 3flz h LEU 135 Cb 0.10 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 3flz h LEU 135 CO -0.14 0.48 0.01 -0.09 0.09 0.00 0.00 178.44 178.79 3flz h ARG 136 N 0.17 0.10 -0.71 1.13 2.43 -0.75 -0.30 114.38 116.45 3flz h ARG 136 Ca 0.02 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 3flz h ARG 136 Cb 0.60 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.11 3flz h ARG 136 CO 0.04 0.32 0.37 0.78 -1.51 0.00 0.00 179.97 179.97 3flz h GLY 137 N -0.13 1.07 0.99 2.80 0.00 -0.98 -2.79 103.07 104.03 3flz h GLY 137 Ca 0.02 -0.50 -0.06 0.00 0.00 0.00 0.00 47.33 46.78 3flz h GLY 137 CO 0.00 0.48 0.06 1.41 0.00 0.00 0.00 176.54 178.49 3flz h LEU 138 N 0.98 0.80 -0.52 3.11 3.38 -0.83 -0.35 115.31 121.88 3flz h LEU 138 Ca 0.25 -0.27 0.10 0.00 0.09 0.00 0.00 57.88 58.05 3flz h LEU 138 Cb 0.07 -0.21 -0.09 0.00 0.09 0.00 0.00 40.66 40.52 3flz h LEU 138 CO -0.04 0.87 -0.04 0.50 0.09 0.00 0.00 178.44 179.82 3flz h LYS 139 N 0.70 0.07 0.10 1.13 3.64 -0.99 0.24 116.57 121.46 3flz h LYS 139 Ca 0.15 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.52 3flz h LYS 139 Cb 0.43 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.23 3flz h LYS 139 CO 0.01 0.05 -0.07 -0.92 -2.27 0.00 0.00 179.45 176.25 3flz h TYR 140 N 0.07 -0.17 -0.02 1.91 3.20 -1.22 -1.75 116.97 118.99 3flz h TYR 140 Ca 0.26 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.13 3flz h TYR 140 Cb 0.40 0.06 -0.00 0.00 1.54 0.00 0.00 36.73 38.74 3flz h TYR 140 CO -0.36 -0.11 0.01 0.82 -1.64 0.00 0.00 178.16 176.88 3flz h ILE 141 N -0.17 1.03 -0.39 1.81 2.04 -0.69 -3.02 117.51 118.12 3flz h ILE 141 Ca -0.01 -0.08 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 3flz h ILE 141 Cb 0.15 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 3flz h ILE 141 CO 0.01 0.02 0.18 0.45 0.00 0.00 0.00 178.15 178.81 3flz h HIS 142 N -0.00 0.53 0.00 1.37 3.86 -0.53 -2.16 115.15 118.22 3flz h HIS 142 Ca 0.01 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3flz h HIS 142 Cb 0.03 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.33 3flz h HIS 142 CO -0.07 0.40 0.00 0.66 0.86 0.00 0.00 177.93 179.78 3flz h SER 143 N 0.54 0.00 -0.44 2.45 4.64 -1.18 0.96 113.55 120.52 3flz h SER 143 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 3flz h SER 143 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 3flz h SER 143 CO -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.94 3flz n ALA 144 N -2.03 2.77 -3.53 5.18 0.00 -0.84 -4.73 120.51 117.33 3flz n ALA 144 Ca -0.01 -0.97 -0.26 0.00 0.00 0.00 0.00 53.44 52.20 3flz n ALA 144 Cb 0.19 -1.01 0.01 0.00 0.00 0.00 0.00 19.45 18.65 3flz n ALA 144 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3flz n ASP 145 N 0.71 -4.27 -4.70 0.00 10.43 0.33 -4.51 116.55 114.53 3flz n ASP 145 Ca 0.16 -0.53 -0.35 0.00 2.57 0.00 0.00 54.79 56.65 3flz n ASP 145 Cb 0.56 -3.48 -0.09 0.00 1.84 0.00 0.00 41.12 39.95 3flz n ASP 145 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 3flz s ILE 146 N -3.08 4.85 -0.13 0.53 1.01 -1.05 -5.03 121.20 118.30 3flz s ILE 146 Ca 0.49 -0.03 -0.03 0.00 0.00 0.00 0.00 60.65 61.08 3flz s ILE 146 Cb -0.25 -3.13 -0.03 0.00 0.01 0.00 0.00 42.46 39.06 3flz s ILE 146 CO 0.60 0.53 -0.03 -0.63 0.00 0.00 0.00 174.94 175.41 3flz s ILE 147 N -0.27 3.98 0.00 2.92 1.01 -1.26 -3.66 121.20 123.91 3flz s ILE 147 Ca 0.08 -0.35 -0.25 0.00 0.00 0.00 0.00 60.65 60.14 3flz s ILE 147 Cb -0.12 -2.71 -0.19 0.00 0.01 0.00 0.00 42.46 39.46 3flz s ILE 147 CO 0.01 0.54 1.33 -0.74 0.00 0.00 0.00 174.94 176.08 3flz h HIS 148 N 6.11 -0.08 0.00 3.97 -0.00 -1.93 -2.75 115.15 120.46 3flz h HIS 148 Ca -0.39 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.98 3flz h HIS 148 Cb 1.19 0.03 0.00 0.00 -0.00 0.00 0.00 27.41 28.62 3flz h HIS 148 CO 0.56 0.29 0.00 0.54 -0.00 0.00 0.00 177.93 179.32 3flz n ARG 149 N -4.95 0.00 -2.77 5.26 1.74 -1.26 -3.00 116.66 111.68 3flz n ARG 149 Ca -0.08 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 56.98 3flz n ARG 149 Cb 0.22 -1.07 0.08 0.00 -1.02 0.00 0.00 32.46 30.67 3flz n ARG 149 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3flz n ASP 150 N 0.00 0.33 -4.73 0.55 2.03 -1.26 -5.01 116.55 108.47 3flz n ASP 150 Ca 0.00 -2.13 -0.42 0.00 0.52 0.00 0.00 54.79 52.76 3flz n ASP 150 Cb 0.00 -0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.37 3flz n ASP 150 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3flz s LEU 151 N -3.89 4.37 0.10 -2.67 1.43 -1.26 -4.90 118.68 111.86 3flz s LEU 151 Ca 0.20 2.66 -0.25 0.00 -1.03 0.00 0.00 54.13 55.71 3flz s LEU 151 Cb 0.38 -3.61 0.08 0.00 0.03 0.00 0.00 46.19 43.07 3flz s LEU 151 CO -0.07 -0.80 0.74 -1.59 0.23 0.00 0.00 176.35 174.86 3flz s LYS 152 N 0.55 1.12 0.42 1.70 -2.85 -1.26 -4.81 119.74 114.61 3flz s LYS 152 Ca 0.66 -0.44 0.20 0.00 -1.00 0.00 0.00 55.97 55.40 3flz s LYS 152 Cb -0.44 0.50 1.15 0.00 -2.06 0.00 0.00 37.83 36.98 3flz s LYS 152 CO 0.36 -0.49 1.79 -1.35 0.10 0.00 0.00 175.35 175.76 3flz h PRO 153 N 2.00 0.34 0.00 1.78 0.11 -1.94 0.15 132.00 134.44 3flz h PRO 153 Ca -0.28 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.81 3flz h PRO 153 Cb 1.28 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3flz h PRO 153 CO 0.34 0.23 0.00 -1.13 -0.21 0.00 0.00 178.00 177.22 3flz n SER 154 N -4.56 0.73 -0.77 -2.05 3.41 -1.26 -1.81 113.62 107.31 3flz n SER 154 Ca 0.24 0.66 0.10 0.00 -0.26 0.00 0.00 58.87 59.61 3flz n SER 154 Cb 0.88 -0.82 0.29 0.00 -0.26 0.00 0.00 64.21 64.30 3flz n SER 154 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3flz n ASN 155 N -2.28 2.30 -4.00 4.04 3.02 0.52 -4.82 115.26 114.04 3flz n ASN 155 Ca 0.03 -1.85 -0.31 0.00 -0.03 0.00 0.00 54.58 52.41 3flz n ASN 155 Cb 0.26 -0.19 -0.15 0.00 -0.61 0.00 0.00 39.78 39.09 3flz n ASN 155 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3flz s LEU 156 N -1.41 3.44 -0.06 3.41 1.43 -0.75 -1.00 118.68 123.73 3flz s LEU 156 Ca 0.33 -1.54 -0.04 0.00 -1.03 0.00 0.00 54.13 51.86 3flz s LEU 156 Cb 0.18 -1.41 -0.04 0.00 0.03 0.00 0.00 46.19 44.95 3flz s LEU 156 CO 0.26 -0.27 0.11 0.00 0.23 0.00 0.00 176.35 176.69 3flz s ALA 157 N 1.17 3.73 -0.01 4.21 0.00 -0.66 -0.62 121.76 129.59 3flz s ALA 157 Ca -0.02 -0.75 0.02 0.00 0.00 0.00 0.00 51.96 51.22 3flz s ALA 157 Cb -0.19 -1.78 -0.00 0.00 0.00 0.00 0.00 23.12 21.14 3flz s ALA 157 CO -0.07 0.66 -0.08 0.08 0.00 0.00 0.00 175.76 176.35 3flz s VAL 158 N -1.11 0.65 0.62 0.00 1.01 -0.16 -0.71 120.40 120.70 3flz s VAL 158 Ca 0.19 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 61.85 3flz s VAL 158 Cb -0.12 -0.55 0.12 0.00 0.00 0.00 0.00 36.38 35.82 3flz s VAL 158 CO 0.09 0.19 0.85 -0.46 0.00 0.00 0.00 175.10 175.77 3flz n ASN 159 N 2.94 1.40 -0.28 3.32 0.23 -0.31 -2.91 115.26 119.65 3flz n ASN 159 Ca -0.14 -2.12 0.20 0.00 -0.53 0.00 0.00 54.58 51.99 3flz n ASN 159 Cb 0.57 -0.53 0.50 0.00 -2.08 0.00 0.00 39.78 38.24 3flz n ASN 159 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3flz h GLU 160 N 0.00 0.41 -0.05 -3.83 3.07 -2.00 0.14 114.58 112.33 3flz h GLU 160 Ca -0.28 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.55 3flz h GLU 160 Cb 1.11 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.92 3flz h GLU 160 CO 0.33 0.27 0.00 -0.25 -1.40 0.00 0.00 179.01 177.96 3flz n ASP 161 N -4.56 0.32 -1.09 1.42 10.43 -1.26 -4.86 116.55 116.96 3flz n ASP 161 Ca 0.22 -1.73 -0.14 0.00 2.57 0.00 0.00 54.79 55.71 3flz n ASP 161 Cb 0.76 -0.03 -0.06 0.00 1.84 0.00 0.00 41.12 43.64 3flz n ASP 161 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3flz s GLU 163 N -3.24 4.47 -0.04 0.00 2.02 -1.25 -4.80 118.70 115.86 3flz s GLU 163 Ca 0.00 1.60 0.03 0.00 0.02 0.00 0.00 54.97 56.61 3flz s GLU 163 Cb 0.00 -3.43 -0.03 0.00 0.10 0.00 0.00 34.13 30.77 3flz s GLU 163 CO 0.00 -0.20 -0.11 -1.17 0.02 0.00 0.00 175.26 173.80 3flz s LEU 164 N 1.24 2.96 0.01 1.80 0.20 -1.26 -1.16 118.68 122.47 3flz s LEU 164 Ca 0.55 -0.15 0.06 0.00 0.69 0.00 0.00 54.13 55.28 3flz s LEU 164 Cb -0.25 -1.65 -0.02 0.00 -0.43 0.00 0.00 46.19 43.84 3flz s LEU 164 CO 0.27 0.33 -0.18 -0.54 -0.29 0.00 0.00 176.35 175.94 3flz s LYS 165 N -0.97 1.33 -0.13 1.98 1.02 0.11 -4.23 119.74 118.86 3flz s LYS 165 Ca 0.13 -0.75 -0.19 0.00 0.02 0.00 0.00 55.97 55.18 3flz s LYS 165 Cb -0.11 -1.35 -0.04 0.00 -0.52 0.00 0.00 37.83 35.82 3flz s LYS 165 CO 0.03 0.36 0.52 0.42 -0.92 0.00 0.00 175.35 175.75 3flz s ILE 166 N -0.61 5.15 0.25 2.17 1.01 -0.06 -1.65 121.20 127.47 3flz s ILE 166 Ca 0.06 1.03 0.09 0.00 0.00 0.00 0.00 60.65 61.84 3flz s ILE 166 Cb -0.08 -3.86 -0.04 0.00 0.01 0.00 0.00 42.46 38.49 3flz s ILE 166 CO 0.00 0.28 -0.00 -0.76 0.00 0.00 0.00 174.94 174.47 3flz s LEU 167 N 0.85 3.22 -0.94 2.97 1.43 -0.17 -1.49 118.68 124.54 3flz s LEU 167 Ca 0.27 -0.60 -0.01 0.00 -1.03 0.00 0.00 54.13 52.77 3flz s LEU 167 Cb -0.16 -1.77 0.00 0.00 0.03 0.00 0.00 46.19 44.30 3flz s LEU 167 CO 0.11 0.02 0.12 0.47 0.23 0.00 0.00 176.35 177.30 3flz n ASP 168 N -0.76 -3.85 -4.85 2.29 10.43 -1.26 -4.86 116.55 113.68 3flz n ASP 168 Ca -0.07 -0.07 -0.32 0.00 2.57 0.00 0.00 54.79 56.90 3flz n ASP 168 Cb 0.58 -2.95 -0.06 0.00 1.84 0.00 0.00 41.12 40.53 3flz n ASP 168 CO 0.00 0.00 0.00 0.72 -1.07 0.00 0.00 177.20 176.85 3flz s PHE 169 N -2.69 3.39 -0.89 1.24 -0.12 -1.26 -4.27 117.98 113.37 3flz s PHE 169 Ca 0.06 1.22 0.00 0.00 -0.05 0.00 0.00 56.93 58.16 3flz s PHE 169 Cb -0.03 -2.54 0.00 0.00 -0.63 0.00 0.00 43.02 39.82 3flz s PHE 169 CO 0.08 0.03 0.00 0.41 -0.05 0.00 0.00 175.22 175.69 3flz n GLY 170 N -0.58 1.00 0.00 1.99 0.00 -1.04 -4.96 105.19 101.59 3flz n GLY 170 Ca 0.04 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.40 3flz n GLY 170 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3flz n LEU 171 N -0.97 0.00 -3.65 0.99 4.77 -1.26 -4.97 117.00 111.91 3flz n LEU 171 Ca -0.09 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 55.89 3flz n LEU 171 Cb 0.29 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.31 3flz n LEU 171 CO 0.13 0.00 0.93 -1.00 -1.33 0.00 0.00 177.39 176.12 3flz s HIS 174 N 3.01 -0.22 0.66 -1.77 3.76 -1.26 -4.95 115.29 114.52 3flz s HIS 174 Ca 0.00 0.47 -0.12 0.00 -0.15 0.00 0.00 55.06 55.25 3flz s HIS 174 Cb 0.00 0.21 -0.01 0.00 1.11 0.00 0.00 32.58 33.90 3flz s HIS 174 CO 0.00 -0.11 1.06 0.95 -0.85 0.00 0.00 174.74 175.79 3flz s THR 175 N 0.90 3.96 0.28 1.30 -4.23 -1.26 -4.94 115.64 111.66 3flz s THR 175 Ca -0.05 0.72 0.03 0.00 -1.18 0.00 0.00 61.69 61.21 3flz s THR 175 Cb -0.03 -3.39 0.27 0.00 1.34 0.00 0.00 72.50 70.69 3flz s THR 175 CO -0.12 -0.75 1.77 0.44 -0.54 0.00 0.00 174.62 175.42 3flz h ASP 176 N -0.37 0.68 -0.79 3.99 3.45 -2.05 -2.43 116.42 118.91 3flz h ASP 176 Ca -0.45 0.09 -0.04 0.00 0.43 0.00 0.00 57.03 57.07 3flz h ASP 176 Cb 1.21 -0.03 -0.04 0.00 -0.56 0.00 0.00 39.33 39.92 3flz h ASP 176 CO 0.57 0.26 0.35 -0.78 -1.57 0.00 0.00 179.24 178.08 3flz h ASP 177 N 0.72 1.06 0.09 6.45 1.82 -1.97 -2.58 116.42 122.00 3flz h ASP 177 Ca 0.53 -0.15 0.00 0.00 -0.39 0.00 0.00 57.03 57.01 3flz h ASP 177 Cb 0.77 -0.27 0.00 0.00 0.68 0.00 0.00 39.33 40.51 3flz h ASP 177 CO -0.37 0.91 -0.01 -1.84 -1.61 0.00 0.00 179.24 176.33 3flz n GLU 178 N -4.33 1.00 -0.26 0.28 0.28 -0.92 -2.54 120.64 114.15 3flz n GLU 178 Ca 0.07 -0.15 0.09 0.00 -0.16 0.00 0.00 57.16 57.01 3flz n GLU 178 Cb 0.16 -1.50 0.23 0.00 1.43 0.00 0.00 31.44 31.76 3flz n GLU 178 CO 0.00 0.00 0.00 -1.33 -0.16 0.00 0.00 177.13 175.64 3flz n MET 179 N -0.87 2.66 -3.70 3.44 2.81 -0.98 -4.69 117.12 115.79 3flz n MET 179 Ca 0.21 -2.31 -0.37 0.00 -1.81 0.00 0.00 57.70 53.43 3flz n MET 179 Cb 0.17 -1.43 -0.06 0.00 -0.71 0.00 0.00 33.22 31.19 3flz n MET 179 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 3flz s THR 180 N -1.05 5.33 0.00 2.03 2.01 -1.05 -4.83 115.64 118.08 3flz s THR 180 Ca 0.36 0.44 0.00 0.00 0.31 0.00 0.00 61.69 62.80 3flz s THR 180 Cb 0.19 -3.53 0.00 0.00 0.01 0.00 0.00 72.50 69.17 3flz s THR 180 CO 0.25 0.54 0.00 0.61 -0.69 0.00 0.00 174.62 175.34 3flz n GLY 181 N 2.39 -0.92 3.27 4.40 0.00 -1.26 -4.53 105.19 108.54 3flz n GLY 181 Ca -0.16 -1.43 -0.43 0.00 0.00 0.00 0.00 46.02 43.99 3flz n GLY 181 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3flz n TYR 182 N 0.00 4.27 -4.37 1.61 9.36 -1.12 -3.67 117.16 123.23 3flz n TYR 182 Ca 0.00 -3.04 -0.20 0.00 3.32 0.00 0.00 57.90 57.98 3flz n TYR 182 Cb 0.00 -2.33 -0.15 0.00 -0.63 0.00 0.00 39.34 36.23 3flz n TYR 182 CO 0.00 0.00 0.00 0.14 0.22 0.00 0.00 176.86 177.22 3flz s VAL 183 N 2.35 0.75 0.02 2.97 -7.23 -1.26 -5.02 120.40 112.97 3flz s VAL 183 Ca 0.46 -0.36 0.27 0.00 -1.81 0.00 0.00 61.98 60.54 3flz s VAL 183 Cb 0.04 -0.66 0.27 0.00 0.56 0.00 0.00 36.38 36.59 3flz s VAL 183 CO 0.01 0.23 1.82 0.00 -0.31 0.00 0.00 175.10 176.85 3flz h ALA 184 N 6.27 1.01 0.00 1.32 0.00 -1.94 -2.45 119.26 123.47 3flz h ALA 184 Ca -0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3flz h ALA 184 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3flz h ALA 184 CO 0.49 -0.01 0.00 1.79 0.00 0.00 0.00 179.25 181.52 3flz h THR 185 N 0.00 0.00 0.00 0.00 1.35 -1.96 -3.22 112.91 109.08 3flz h THR 185 Ca 0.00 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.46 3flz h THR 185 Cb 0.03 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 67.73 3flz h THR 185 CO 0.00 0.00 -1.31 -1.14 -0.25 0.00 0.00 175.52 172.82 3flz n ARG 186 N -2.67 0.23 0.32 4.72 0.63 -0.93 -4.75 116.66 114.20 3flz n ARG 186 Ca 0.02 -0.06 0.20 0.00 -0.92 0.00 0.00 57.85 57.08 3flz n ARG 186 Cb 0.29 -1.16 1.05 0.00 0.45 0.00 0.00 32.46 33.08 3flz n ARG 186 CO 0.00 0.00 0.00 -1.49 -2.51 0.00 0.00 177.63 173.63 3flz h TRP 187 N 0.00 0.00 -0.21 -0.14 6.55 -1.56 -2.27 115.95 118.32 3flz h TRP 187 Ca 0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 3flz h TRP 187 Cb 0.31 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.61 3flz h TRP 187 CO 0.00 0.01 0.00 0.66 -1.05 0.00 0.00 178.44 178.06 3flz n TYR 188 N -3.23 0.27 -2.86 0.49 4.02 -1.26 -4.59 117.16 109.99 3flz n TYR 188 Ca -0.02 -0.19 -0.40 0.00 -0.01 0.00 0.00 57.90 57.28 3flz n TYR 188 Cb 0.13 -0.01 -0.05 0.00 -0.02 0.00 0.00 39.34 39.39 3flz n TYR 188 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 3flz s ARG 189 N -1.26 4.66 0.43 -0.72 1.81 -0.86 -3.79 118.95 119.22 3flz s ARG 189 Ca 0.26 1.29 -0.26 0.00 -1.72 0.00 0.00 55.73 55.30 3flz s ARG 189 Cb 0.16 -3.31 -0.09 0.00 -0.45 0.00 0.00 34.95 31.26 3flz s ARG 189 CO 0.22 0.43 1.42 0.00 -0.68 0.00 0.00 175.30 176.69 3flz s ALA 190 N -0.72 3.32 0.43 2.13 0.00 -1.26 -4.82 121.76 120.84 3flz s ALA 190 Ca 0.40 1.45 0.10 0.00 0.00 0.00 0.00 51.96 53.91 3flz s ALA 190 Cb -0.23 -3.58 0.94 0.00 0.00 0.00 0.00 23.12 20.25 3flz s ALA 190 CO 0.28 -1.10 2.05 -1.00 0.00 0.00 0.00 175.76 175.98 3flz h PRO 191 N 2.54 0.46 0.00 0.00 0.13 -1.96 -0.91 132.00 132.25 3flz h PRO 191 Ca -0.51 -0.03 -0.05 0.00 -0.87 0.00 0.00 66.00 64.54 3flz h PRO 191 Cb 1.26 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 3flz h PRO 191 CO 0.62 0.30 -0.26 1.05 -0.23 0.00 0.00 178.00 179.48 3flz h GLU 192 N 0.47 0.00 0.06 0.86 9.09 -1.92 -2.02 114.58 121.13 3flz h GLU 192 Ca 0.17 0.00 -0.35 0.00 0.05 0.00 0.00 59.36 59.23 3flz h GLU 192 Cb 0.11 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.17 3flz h GLU 192 CO -0.04 0.26 -2.06 1.51 0.05 0.00 0.00 179.01 178.73 3flz n ILE 193 N -3.78 1.66 -0.21 -1.06 3.06 -0.94 0.27 119.36 118.37 3flz n ILE 193 Ca -0.01 -0.69 0.06 0.00 -2.50 0.00 0.00 62.75 59.61 3flz n ILE 193 Cb 0.36 -1.41 0.33 0.00 0.54 0.00 0.00 39.64 39.46 3flz n ILE 193 CO 0.00 0.00 0.00 -0.03 -2.50 0.00 0.00 176.55 174.02 3flz h MET 194 N 0.04 0.78 -0.08 9.51 4.05 -1.07 -2.92 114.93 125.25 3flz h MET 194 Ca -0.43 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 58.94 3flz h MET 194 Cb 2.02 -0.18 0.00 0.00 -0.80 0.00 0.00 31.60 32.65 3flz h MET 194 CO 0.05 0.52 0.00 1.28 0.23 0.00 0.00 176.91 178.98 3flz n LEU 195 N -4.48 2.59 -4.07 3.39 4.77 -0.77 -5.02 117.00 113.41 3flz n LEU 195 Ca 0.11 -2.72 -0.38 0.00 -0.03 0.00 0.00 56.01 52.99 3flz n LEU 195 Cb 0.23 -0.33 -0.01 0.00 -2.33 0.00 0.00 43.42 40.98 3flz n LEU 195 CO 0.33 0.65 -0.24 0.59 -1.33 0.00 0.00 177.39 177.40 3flz n ASN 196 N -0.88 -2.58 0.08 -1.43 4.13 -0.98 -4.87 115.26 108.72 3flz n ASN 196 Ca 0.13 -1.23 -0.05 0.00 1.68 0.00 0.00 54.58 55.11 3flz n ASN 196 Cb 0.57 -2.04 0.12 0.00 -1.54 0.00 0.00 39.78 36.89 3flz n ASN 196 CO 0.00 0.00 0.00 -0.50 0.28 0.00 0.00 177.26 177.04 3flz h TRP 197 N -2.24 0.34 -2.47 3.10 6.55 -0.45 -3.44 115.95 117.34 3flz h TRP 197 Ca -0.69 -0.13 0.15 0.00 0.95 0.00 0.00 58.89 59.18 3flz h TRP 197 Cb 1.40 -0.06 -0.07 0.00 -0.86 0.00 0.00 29.16 29.56 3flz h TRP 197 CO 0.42 0.79 0.45 0.00 -1.05 0.00 0.00 178.44 179.04 3flz s MET 198 N -3.81 1.33 -0.25 0.49 0.23 -1.25 -2.38 119.30 113.66 3flz s MET 198 Ca -0.04 -0.75 -0.29 0.00 -1.03 0.00 0.00 55.69 53.58 3flz s MET 198 Cb 0.12 0.44 -0.02 0.00 -1.53 0.00 0.00 34.83 33.84 3flz s MET 198 CO 0.80 -0.61 1.61 -1.58 -2.03 0.00 0.00 175.02 173.21 3flz s HIS 199 N -3.26 2.11 0.28 3.16 2.46 -1.26 -4.87 115.29 113.91 3flz s HIS 199 Ca 0.13 0.58 -0.01 0.00 0.47 0.00 0.00 55.06 56.23 3flz s HIS 199 Cb -0.02 -4.02 -0.04 0.00 -0.13 0.00 0.00 32.58 28.36 3flz s HIS 199 CO 0.04 -2.81 0.48 1.52 -2.47 0.00 0.00 174.74 171.50 3flz s TYR 200 N 5.42 3.49 0.00 3.88 -0.85 -1.26 -5.12 117.35 122.90 3flz s TYR 200 Ca 0.71 0.38 0.00 0.00 -0.52 0.00 0.00 57.07 57.64 3flz s TYR 200 Cb -0.23 -1.90 0.00 0.00 0.38 0.00 0.00 41.96 40.21 3flz s TYR 200 CO 0.30 0.24 0.00 0.27 -1.52 0.00 0.00 175.55 174.84 3flz n ASN 201 N -1.22 1.47 0.28 -0.18 0.23 -1.26 -5.04 115.26 109.54 3flz n ASN 201 Ca -0.04 -0.62 0.14 0.00 -0.53 0.00 0.00 54.58 53.52 3flz n ASN 201 Cb 0.55 0.00 0.81 0.00 -2.08 0.00 0.00 39.78 39.06 3flz n ASN 201 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 3flz h GLN 202 N 0.00 0.00 0.00 -3.83 4.20 -1.98 -2.71 115.11 110.79 3flz h GLN 202 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3flz h GLN 202 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 3flz h GLN 202 CO 0.00 0.07 0.00 0.25 -0.67 0.00 0.00 178.83 178.48 3flz n THR 203 N -3.72 0.51 -0.16 -0.54 -2.24 -1.26 -1.91 114.28 104.96 3flz n THR 203 Ca -0.02 0.13 0.08 0.00 -2.27 0.00 0.00 64.05 61.97 3flz n THR 203 Cb 0.17 -0.82 0.39 0.00 -2.10 0.00 0.00 70.33 67.97 3flz n THR 203 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 3flz h VAL 204 N 0.00 0.98 -0.03 2.28 -1.51 -1.86 -2.22 116.25 113.89 3flz h VAL 204 Ca 0.00 -0.23 -0.15 0.00 -1.23 0.00 0.00 66.70 65.09 3flz h VAL 204 Cb 0.20 0.26 -0.01 0.00 -2.13 0.00 0.00 31.29 29.61 3flz h VAL 204 CO 0.00 0.12 -0.66 0.44 -1.23 0.00 0.00 177.57 176.24 3flz h ASP 205 N 0.66 0.17 -0.11 4.19 3.32 -1.64 -2.90 116.42 120.10 3flz h ASP 205 Ca 0.31 -0.10 -0.11 0.00 0.02 0.00 0.00 57.03 57.15 3flz h ASP 205 Cb 0.36 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 3flz h ASP 205 CO -0.10 0.78 -0.26 0.40 -1.72 0.00 0.00 179.24 178.33 3flz h ILE 206 N 0.10 1.27 -0.55 0.35 1.08 -1.54 -2.00 117.51 116.22 3flz h ILE 206 Ca -0.01 -1.33 0.04 0.00 -0.39 0.00 0.00 64.86 63.17 3flz h ILE 206 Cb 1.18 1.34 -0.04 0.00 -3.07 0.00 0.00 36.82 36.23 3flz h ILE 206 CO 0.10 0.43 0.31 -0.25 -0.69 0.00 0.00 178.15 178.04 3flz h TRP 207 N 0.50 0.57 -0.69 1.37 2.91 -1.27 -1.71 115.95 117.62 3flz h TRP 207 Ca 0.07 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.11 3flz h TRP 207 Cb 0.72 -0.18 -0.03 0.00 -0.51 0.00 0.00 29.16 29.16 3flz h TRP 207 CO 0.03 0.30 0.44 0.77 -1.03 0.00 0.00 178.44 178.94 3flz h SER 208 N 0.60 0.81 -0.85 2.65 0.02 -1.40 -1.76 113.55 113.62 3flz h SER 208 Ca 0.23 -0.04 0.01 0.00 -0.84 0.00 0.00 61.79 61.15 3flz h SER 208 Cb 0.09 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 62.39 3flz h SER 208 CO -0.13 0.61 0.56 0.58 -1.14 0.00 0.00 176.83 177.31 3flz h VAL 209 N 0.94 1.22 -0.50 2.27 2.07 -1.08 -1.03 116.25 120.15 3flz h VAL 209 Ca 0.25 -0.42 0.06 0.00 0.82 0.00 0.00 66.70 67.41 3flz h VAL 209 Cb -0.07 -0.02 -0.05 0.00 -1.52 0.00 0.00 31.29 29.63 3flz h VAL 209 CO -0.05 0.22 0.20 1.23 0.02 0.00 0.00 177.57 179.19 3flz h GLY 210 N 1.16 0.68 1.38 2.17 0.00 -0.68 0.32 103.07 108.09 3flz h GLY 210 Ca 0.31 -0.12 -0.08 0.00 0.00 0.00 0.00 47.33 47.43 3flz h GLY 210 CO -0.07 0.04 -0.07 0.00 0.00 0.00 0.00 176.54 176.45 3flz h ILE 212 N 0.69 1.44 -0.53 0.00 2.04 -0.77 -2.05 117.51 118.33 3flz h ILE 212 Ca 0.13 -1.56 0.08 0.00 1.00 0.00 0.00 64.86 64.51 3flz h ILE 212 Cb 0.52 2.33 -0.07 0.00 -0.74 0.00 0.00 36.82 38.86 3flz h ILE 212 CO 0.03 0.43 0.17 -0.03 0.00 0.00 0.00 178.15 178.76 3flz h MET 213 N -0.32 0.33 -0.37 2.37 4.05 -0.33 -0.22 114.93 120.44 3flz h MET 213 Ca -0.01 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.38 3flz h MET 213 Cb 0.79 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 31.50 3flz h MET 213 CO 0.04 0.22 0.18 0.00 0.23 0.00 0.00 176.91 177.58 3flz h ALA 214 N 1.37 0.47 -0.94 0.39 0.00 -1.39 -1.49 119.26 117.68 3flz h ALA 214 Ca 0.26 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.12 3flz h ALA 214 Cb 0.32 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 3flz h ALA 214 CO -0.29 0.02 0.61 1.49 0.00 0.00 0.00 179.25 181.09 3flz h GLU 215 N 0.46 1.12 -0.27 0.00 4.81 -0.86 -0.94 114.58 118.89 3flz h GLU 215 Ca 0.13 -0.07 -0.08 0.00 -0.13 0.00 0.00 59.36 59.21 3flz h GLU 215 Cb 0.10 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 3flz h GLU 215 CO -0.02 0.74 -0.17 -0.07 -0.73 0.00 0.00 179.01 178.76 3flz h LEU 216 N 1.15 0.47 -0.16 1.64 3.38 -0.73 0.42 115.31 121.48 3flz h LEU 216 Ca 0.38 -0.13 -0.23 0.00 0.09 0.00 0.00 57.88 57.99 3flz h LEU 216 Cb 0.06 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 40.70 3flz h LEU 216 CO -0.12 0.66 -0.84 -0.07 0.09 0.00 0.00 178.44 178.16 3flz h LEU 217 N 0.44 0.85 0.00 1.67 3.38 -0.49 -2.82 115.31 118.34 3flz h LEU 217 Ca 0.07 -0.59 -0.10 0.00 0.09 0.00 0.00 57.88 57.35 3flz h LEU 217 Cb 0.56 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 3flz h LEU 217 CO 0.04 1.38 -1.99 0.35 0.09 0.00 0.00 178.44 178.31 3flz n THR 218 N -3.89 0.38 -1.00 0.22 -2.24 -0.43 -4.62 114.28 102.69 3flz n THR 218 Ca -0.08 -0.54 -0.00 0.00 -2.27 0.00 0.00 64.05 61.16 3flz n THR 218 Cb 0.78 -0.12 -0.00 0.00 -2.10 0.00 0.00 70.33 68.88 3flz n THR 218 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3flz n GLY 219 N 1.55 0.46 3.05 3.38 0.00 0.15 -4.40 105.19 109.38 3flz n GLY 219 Ca -0.11 -0.37 -0.15 0.00 0.00 0.00 0.00 46.02 45.38 3flz n GLY 219 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3flz s ARG 220 N -0.72 0.59 0.17 1.61 1.81 -1.20 -4.30 118.95 116.90 3flz s ARG 220 Ca 0.00 -0.59 -0.33 0.00 -1.72 0.00 0.00 55.73 53.08 3flz s ARG 220 Cb 0.00 -0.48 -0.13 0.00 -0.45 0.00 0.00 34.95 33.89 3flz s ARG 220 CO 0.00 0.11 1.63 2.41 -0.68 0.00 0.00 175.30 178.77 3flz n THR 221 N 1.99 0.02 0.07 0.02 -1.04 -1.26 -4.04 114.28 110.05 3flz n THR 221 Ca -0.19 -0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.69 3flz n THR 221 Cb 0.56 -1.68 -0.08 0.00 -1.82 0.00 0.00 70.33 67.30 3flz n THR 221 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 3flz h LEU 222 N 6.30 -0.13 -6.46 -4.42 5.85 -1.93 -3.38 115.31 111.14 3flz h LEU 222 Ca -0.45 -0.22 -0.60 0.00 0.84 0.00 0.00 57.88 57.46 3flz h LEU 222 Cb 1.24 0.03 -0.41 0.00 0.37 0.00 0.00 40.66 41.89 3flz h LEU 222 CO 0.91 0.14 -0.69 0.49 -0.34 0.00 0.00 178.44 178.95 3flz n PHE 223 N -5.04 2.57 -1.27 1.25 3.01 -1.26 -5.00 117.46 111.72 3flz n PHE 223 Ca -0.09 -4.05 -0.37 0.00 1.01 0.00 0.00 57.45 53.96 3flz n PHE 223 Cb 0.19 -0.48 -0.02 0.00 -0.01 0.00 0.00 39.48 39.16 3flz n PHE 223 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 3flz n PRO 224 N 1.45 3.19 -1.78 -1.08 -0.04 -1.26 -4.70 135.00 130.77 3flz n PRO 224 Ca 0.26 -2.12 -0.40 0.00 -0.04 0.00 0.00 63.50 61.20 3flz n PRO 224 Cb 0.41 -2.82 0.02 0.00 -0.04 0.00 0.00 33.50 31.08 3flz n PRO 224 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3flz s GLY 225 N 2.68 2.91 0.00 0.55 0.00 -1.26 -4.91 107.32 107.29 3flz s GLY 225 Ca 0.60 1.45 0.27 0.00 0.00 0.00 0.00 44.72 47.05 3flz s GLY 225 CO -0.05 2.05 1.70 -1.30 0.00 0.00 0.00 173.10 175.50 3flz n THR 226 N -0.41 0.00 -3.89 0.90 -2.24 -1.26 -4.26 114.28 103.12 3flz n THR 226 Ca 0.06 -0.05 0.01 0.00 -2.27 0.00 0.00 64.05 61.81 3flz n THR 226 Cb 0.42 0.02 0.01 0.00 -2.10 0.00 0.00 70.33 68.68 3flz n THR 226 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3flz s ASP 227 N -2.70 -0.01 0.21 3.42 1.47 -1.24 -2.80 116.67 115.02 3flz s ASP 227 Ca 0.21 -0.29 -0.09 0.00 1.18 0.00 0.00 52.55 53.56 3flz s ASP 227 Cb 0.19 0.23 0.30 0.00 -0.34 0.00 0.00 42.92 43.30 3flz s ASP 227 CO 0.55 -0.45 1.75 0.45 0.68 0.00 0.00 175.17 178.15 3flz h HIS 228 N 2.00 0.43 -0.02 2.11 3.86 -1.88 -1.34 115.15 120.32 3flz h HIS 228 Ca -0.25 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 58.98 3flz h HIS 228 Cb 1.20 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 29.57 3flz h HIS 228 CO 1.18 0.11 -0.04 0.82 0.86 0.00 0.00 177.93 180.86 3flz h ILE 229 N 0.43 1.47 -0.57 2.45 1.08 -1.99 -1.68 117.51 118.70 3flz h ILE 229 Ca 0.32 -1.45 0.08 0.00 -0.39 0.00 0.00 64.86 63.42 3flz h ILE 229 Cb 0.40 2.40 -0.06 0.00 -3.07 0.00 0.00 36.82 36.49 3flz h ILE 229 CO -0.31 0.38 0.22 -0.78 -0.69 0.00 0.00 178.15 176.97 3flz h ASP 230 N -0.52 0.23 -0.58 1.72 1.82 -1.94 -1.15 116.42 116.01 3flz h ASP 230 Ca -0.00 0.07 -0.03 0.00 -0.39 0.00 0.00 57.03 56.68 3flz h ASP 230 Cb 0.65 0.04 -0.03 0.00 0.68 0.00 0.00 39.33 40.68 3flz h ASP 230 CO 0.01 0.15 0.25 -0.61 -1.61 0.00 0.00 179.24 177.43 3flz h GLN 231 N 0.41 0.85 -0.73 0.28 4.15 -1.22 -1.36 115.11 117.49 3flz h GLN 231 Ca 0.28 -0.14 0.03 0.00 0.77 0.00 0.00 58.65 59.59 3flz h GLN 231 Cb 0.31 -0.14 -0.05 0.00 0.21 0.00 0.00 27.48 27.81 3flz h GLN 231 CO -0.27 0.72 0.46 1.25 -1.93 0.00 0.00 178.83 179.05 3flz h LEU 232 N 0.79 0.75 -0.84 -2.39 5.85 -0.85 -0.57 115.31 118.05 3flz h LEU 232 Ca 0.20 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.90 3flz h LEU 232 Cb 0.17 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 3flz h LEU 232 CO -0.02 0.51 0.46 0.11 -0.34 0.00 0.00 178.44 179.16 3flz h LYS 233 N 0.89 1.16 -0.82 1.25 1.57 -0.87 -0.15 116.57 119.60 3flz h LYS 233 Ca 0.30 -0.13 -0.04 0.00 -1.87 0.00 0.00 60.65 58.90 3flz h LYS 233 Cb 0.03 -0.23 -0.04 0.00 0.08 0.00 0.00 32.23 32.08 3flz h LYS 233 CO -0.12 0.85 0.36 -0.07 -0.57 0.00 0.00 179.45 179.91 3flz h LEU 234 N 1.16 1.11 -0.18 2.94 3.38 -0.82 -1.63 115.31 121.28 3flz h LEU 234 Ca 0.29 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 3flz h LEU 234 Cb 0.03 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 3flz h LEU 234 CO -0.05 0.96 0.02 0.40 0.09 0.00 0.00 178.44 179.86 3flz h ILE 235 N 1.19 1.24 0.00 1.22 2.04 -0.66 -3.17 117.51 119.37 3flz h ILE 235 Ca 0.28 -0.79 -0.09 0.00 1.00 0.00 0.00 64.86 65.27 3flz h ILE 235 Cb 0.18 1.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 3flz h ILE 235 CO -0.03 0.24 -0.42 -0.07 0.00 0.00 0.00 178.15 177.87 3flz h LEU 236 N 0.07 0.00 -0.80 1.44 3.38 -0.87 -1.33 115.31 117.21 3flz h LEU 236 Ca 0.05 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 3flz h LEU 236 Cb 0.34 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 3flz h LEU 236 CO 0.01 0.42 0.41 -0.09 0.09 0.00 0.00 178.44 179.27 3flz h ARG 237 N 0.00 1.14 0.09 1.13 2.43 -1.33 0.13 114.38 117.97 3flz h ARG 237 Ca -0.00 -0.15 -0.00 0.00 -0.81 0.00 0.00 59.98 59.01 3flz h ARG 237 Cb 0.92 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.26 3flz h ARG 237 CO 0.05 0.86 -0.04 1.25 -1.51 0.00 0.00 179.97 180.58 3flz h LEU 238 N 1.12 -0.10 -0.40 3.80 5.85 -1.40 -3.37 115.31 120.81 3flz h LEU 238 Ca 0.28 -0.50 0.00 0.00 0.84 0.00 0.00 57.88 58.50 3flz h LEU 238 Cb 0.08 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.13 3flz h LEU 238 CO -0.04 0.55 -0.51 1.33 -0.34 0.00 0.00 178.44 179.44 3flz n VAL 239 N -4.82 0.00 0.00 1.05 0.24 -0.55 -0.89 118.33 113.36 3flz n VAL 239 Ca -0.08 -0.10 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 3flz n VAL 239 Cb 0.29 0.67 0.00 0.00 -1.47 0.00 0.00 33.84 33.33 3flz n VAL 239 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3flz n GLY 240 N 1.43 -0.34 3.79 7.63 0.00 0.47 -4.16 105.19 114.01 3flz n GLY 240 Ca 0.08 -1.64 -0.34 0.00 0.00 0.00 0.00 46.02 44.13 3flz n GLY 240 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3flz s THR 241 N -3.01 3.67 0.64 2.61 -4.23 -0.32 -4.70 115.64 110.30 3flz s THR 241 Ca 0.00 0.93 -0.17 0.00 -1.18 0.00 0.00 61.69 61.27 3flz s THR 241 Cb 0.00 -3.38 -0.01 0.00 1.34 0.00 0.00 72.50 70.45 3flz s THR 241 CO 0.00 -0.33 1.19 -2.16 -0.54 0.00 0.00 174.62 172.77 3flz s PRO 242 N -3.61 2.70 0.78 3.99 0.04 -1.26 -4.88 135.00 132.76 3flz s PRO 242 Ca 0.67 1.72 -0.03 0.00 0.04 0.00 0.00 61.00 63.40 3flz s PRO 242 Cb -0.18 -1.91 0.15 0.00 0.04 0.00 0.00 34.50 32.61 3flz s PRO 242 CO 0.29 -1.40 1.07 0.20 0.04 0.00 0.00 177.00 177.20 3flz s GLY 243 N -1.91 1.76 0.26 0.56 0.00 -1.26 -4.91 107.32 101.82 3flz s GLY 243 Ca 0.74 -1.76 -0.04 0.00 0.00 0.00 0.00 44.72 43.67 3flz s GLY 243 CO 0.38 -1.11 1.90 0.00 0.00 0.00 0.00 173.10 174.26 3flz h ALA 244 N -0.77 1.35 0.20 3.20 0.00 -1.99 -1.89 119.26 119.36 3flz h ALA 244 Ca -0.36 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.52 3flz h ALA 244 Cb 1.25 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 3flz h ALA 244 CO 0.37 0.51 -0.32 1.49 0.00 0.00 0.00 179.25 181.30 3flz h GLU 245 N 1.23 -0.57 -0.35 0.00 4.81 -2.01 -1.84 114.58 115.85 3flz h GLU 245 Ca 0.41 0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.59 3flz h GLU 245 Cb 0.06 0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 3flz h GLU 245 CO -0.14 -0.38 -0.16 1.25 -0.73 0.00 0.00 179.01 178.85 3flz h LEU 246 N -0.59 0.63 -0.44 1.64 5.85 -1.90 -3.15 115.31 117.34 3flz h LEU 246 Ca 0.01 -0.19 0.07 0.00 0.84 0.00 0.00 57.88 58.61 3flz h LEU 246 Cb 0.58 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.39 3flz h LEU 246 CO -0.13 0.80 0.11 -0.07 -0.34 0.00 0.00 178.44 178.81 3flz h LEU 247 N 0.57 0.05 -1.58 2.25 3.38 -0.96 -0.91 115.31 118.11 3flz h LEU 247 Ca 0.09 0.07 0.23 0.00 0.09 0.00 0.00 57.88 58.37 3flz h LEU 247 Cb 0.60 0.08 -0.07 0.00 0.09 0.00 0.00 40.66 41.37 3flz h LEU 247 CO 0.04 0.06 0.63 0.11 0.09 0.00 0.00 178.44 179.37 3flz h LYS 248 N 0.25 0.31 0.00 1.13 1.57 -1.30 -1.39 116.57 117.13 3flz h LYS 248 Ca 0.21 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 3flz h LYS 248 Cb 0.25 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.49 3flz h LYS 248 CO -0.26 0.20 -0.24 1.63 -0.57 0.00 0.00 179.45 180.21 3flz n LYS 249 N -4.48 0.14 -2.43 3.15 5.02 -0.38 -4.60 118.16 114.59 3flz n LYS 249 Ca 0.21 0.08 -0.39 0.00 -2.02 0.00 0.00 58.31 56.18 3flz n LYS 249 Cb 0.81 -1.63 -0.03 0.00 -0.02 0.00 0.00 35.03 34.15 3flz n LYS 249 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3flz s ILE 250 N -3.07 3.68 0.09 -0.18 1.01 -0.53 -4.81 121.20 117.40 3flz s ILE 250 Ca 0.11 0.04 0.24 0.00 0.00 0.00 0.00 60.65 61.04 3flz s ILE 250 Cb 0.15 -4.71 0.23 0.00 0.01 0.00 0.00 42.46 38.14 3flz s ILE 250 CO 0.63 -1.64 1.79 0.77 0.00 0.00 0.00 174.94 176.49 3flz h SER 251 N 10.93 0.00 -2.86 3.58 4.64 -1.72 -3.41 113.55 124.70 3flz h SER 251 Ca -0.14 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.61 3flz h SER 251 Cb 1.06 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.11 3flz h SER 251 CO 1.30 0.23 1.17 -0.55 -0.87 0.00 0.00 176.83 178.10 3flz s SER 252 N -6.19 6.19 0.44 4.97 0.15 -1.14 -4.87 113.70 113.24 3flz s SER 252 Ca 0.01 1.30 0.13 0.00 0.70 0.00 0.00 55.95 58.09 3flz s SER 252 Cb 0.10 -2.53 0.96 0.00 -1.71 0.00 0.00 66.02 62.84 3flz s SER 252 CO 0.64 -1.47 1.99 -0.08 1.20 0.00 0.00 173.24 175.52 3flz h GLU 253 N 11.51 0.08 0.49 5.44 4.81 -1.94 -2.39 114.58 132.59 3flz h GLU 253 Ca -0.32 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 58.87 3flz h GLU 253 Cb 1.15 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.52 3flz h GLU 253 CO 1.03 0.22 -0.24 1.03 -0.73 0.00 0.00 179.01 180.33 3flz h SER 254 N 0.08 -0.56 -0.77 1.04 0.87 -1.95 -2.34 113.55 109.91 3flz h SER 254 Ca 0.02 -0.07 0.01 0.00 -1.23 0.00 0.00 61.79 60.51 3flz h SER 254 Cb 0.29 0.15 -0.04 0.00 -0.44 0.00 0.00 62.40 62.36 3flz h SER 254 CO 0.02 -0.21 0.51 0.00 -0.53 0.00 0.00 176.83 176.62 3flz h ALA 255 N -0.64 0.98 -0.56 6.23 0.00 -1.92 -1.94 119.26 121.40 3flz h ALA 255 Ca -0.07 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.80 3flz h ALA 255 Cb 0.60 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3flz h ALA 255 CO 0.11 0.40 0.37 -0.09 0.00 0.00 0.00 179.25 180.04 3flz h ARG 256 N 1.05 0.72 -0.88 0.00 2.43 -1.48 -0.02 114.38 116.19 3flz h ARG 256 Ca 0.28 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 3flz h ARG 256 Cb -0.12 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.23 3flz h ARG 256 CO -0.06 0.48 0.55 -0.97 -1.51 0.00 0.00 179.97 178.46 3flz h ASN 257 N 0.74 1.04 -0.11 -3.80 -0.73 -1.17 -2.54 115.58 109.02 3flz h ASN 257 Ca 0.21 -0.05 -0.02 0.00 1.87 0.00 0.00 56.30 58.31 3flz h ASN 257 Cb -0.06 -0.26 -0.00 0.00 0.27 0.00 0.00 38.32 38.26 3flz h ASN 257 CO -0.06 0.79 0.01 0.22 -0.37 0.00 0.00 177.43 178.02 3flz h TYR 258 N 1.21 0.21 -0.81 0.67 3.20 -0.68 -3.19 116.97 117.57 3flz h TYR 258 Ca 0.32 -0.03 0.19 0.00 3.14 0.00 0.00 58.73 62.34 3flz h TYR 258 Cb -0.08 -0.06 -0.12 0.00 1.54 0.00 0.00 36.73 38.01 3flz h TYR 258 CO -0.00 0.42 0.27 0.82 -1.64 0.00 0.00 178.16 178.02 3flz h ILE 259 N -0.06 0.49 0.00 1.81 1.08 -0.89 -1.22 117.51 118.72 3flz h ILE 259 Ca 0.03 -0.11 -0.01 0.00 -0.39 0.00 0.00 64.86 64.39 3flz h ILE 259 Cb 0.33 0.13 -0.00 0.00 -3.07 0.00 0.00 36.82 34.21 3flz h ILE 259 CO 0.00 0.06 -0.03 1.56 -0.69 0.00 0.00 178.15 179.06 3flz h GLN 260 N 0.33 0.00 0.00 2.37 4.20 -1.44 -2.45 115.11 118.11 3flz h GLN 260 Ca 0.48 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.19 3flz h GLN 260 Cb 0.86 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.64 3flz h GLN 260 CO -0.53 0.03 0.00 -1.13 -0.67 0.00 0.00 178.83 176.53 3flz n SER 261 N -3.34 0.58 -4.79 1.46 3.41 -0.46 -4.83 113.62 105.65 3flz n SER 261 Ca -0.02 0.60 -0.39 0.00 -0.26 0.00 0.00 58.87 58.79 3flz n SER 261 Cb 0.15 -0.74 -0.06 0.00 -0.26 0.00 0.00 64.21 63.30 3flz n SER 261 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3flz s LEU 262 N -4.18 4.57 0.17 1.04 1.43 -0.92 -5.01 118.68 115.78 3flz s LEU 262 Ca 0.08 1.49 -0.32 0.00 -1.03 0.00 0.00 54.13 54.36 3flz s LEU 262 Cb 0.12 -3.14 -0.11 0.00 0.03 0.00 0.00 46.19 43.09 3flz s LEU 262 CO 0.47 0.24 1.71 -0.89 0.23 0.00 0.00 176.35 178.11 3flz s THR 263 N -1.13 2.32 0.31 5.49 2.01 -1.26 -4.91 115.64 118.48 3flz s THR 263 Ca 0.33 0.14 -0.29 0.00 0.31 0.00 0.00 61.69 62.18 3flz s THR 263 Cb -0.22 -3.09 -0.11 0.00 0.01 0.00 0.00 72.50 69.10 3flz s THR 263 CO 0.23 0.01 1.49 -1.10 -0.69 0.00 0.00 174.62 174.57 3flz s GLN 264 N 1.61 4.18 -0.02 4.92 -0.21 -1.26 -4.94 119.66 123.93 3flz s GLN 264 Ca 0.75 2.48 0.03 0.00 0.02 0.00 0.00 55.36 58.64 3flz s GLN 264 Cb -0.47 -3.03 -0.00 0.00 1.00 0.00 0.00 33.01 30.51 3flz s GLN 264 CO 0.33 -0.51 -0.11 -1.64 -2.12 0.00 0.00 175.29 171.24 3flz s MET 265 N -1.13 1.06 0.55 2.91 -1.94 -1.26 -4.99 119.30 114.50 3flz s MET 265 Ca 0.57 -0.39 -0.13 0.00 -1.71 0.00 0.00 55.69 54.03 3flz s MET 265 Cb -0.45 -0.99 -0.06 0.00 2.01 0.00 0.00 34.83 35.34 3flz s MET 265 CO 0.52 0.18 0.98 -1.25 -0.01 0.00 0.00 175.02 175.44 3flz s PRO 266 N -0.01 3.78 0.28 2.03 0.04 -1.26 -1.17 135.00 138.69 3flz s PRO 266 Ca -0.00 0.80 -0.30 0.00 0.04 0.00 0.00 61.00 61.54 3flz s PRO 266 Cb -0.07 -2.14 -0.12 0.00 0.04 0.00 0.00 34.50 32.20 3flz s PRO 266 CO 0.00 -0.37 1.48 1.17 0.04 0.00 0.00 177.00 179.33 3flz n LYS 267 N -2.06 2.38 -1.78 4.56 4.81 -1.26 -4.12 118.16 120.70 3flz n LYS 267 Ca 0.06 0.85 -0.31 0.00 -0.87 0.00 0.00 58.31 58.04 3flz n LYS 267 Cb 0.54 -2.56 0.04 0.00 0.02 0.00 0.00 35.03 33.07 3flz n LYS 267 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 3flz s MET 268 N -0.72 3.08 -0.35 1.64 -1.94 -0.06 -4.91 119.30 116.05 3flz s MET 268 Ca 0.64 0.69 -0.29 0.00 -1.71 0.00 0.00 55.69 55.02 3flz s MET 268 Cb -0.56 -2.03 0.02 0.00 2.01 0.00 0.00 34.83 34.27 3flz s MET 268 CO 0.51 -0.93 1.09 1.21 -0.01 0.00 0.00 175.02 176.89 3flz s ASN 269 N -4.13 6.88 0.33 3.03 3.84 -1.26 -4.94 114.94 118.69 3flz s ASN 269 Ca 0.57 0.95 0.11 0.00 0.21 0.00 0.00 52.86 54.70 3flz s ASN 269 Cb -0.12 -2.54 0.56 0.00 -0.55 0.00 0.00 41.25 38.60 3flz s ASN 269 CO 0.54 -0.95 1.74 -0.26 -2.79 0.00 0.00 177.10 175.38 3flz h PHE 270 N 8.29 0.02 0.00 0.43 -1.00 -1.95 -2.09 116.94 120.64 3flz h PHE 270 Ca -0.21 -0.01 -0.03 0.00 2.81 0.00 0.00 57.97 60.53 3flz h PHE 270 Cb 1.06 -0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.61 3flz h PHE 270 CO 0.86 0.48 -0.15 0.00 -1.61 0.00 0.00 178.31 177.89 3flz h ALA 271 N 1.52 1.58 0.00 2.45 0.00 -1.92 0.22 119.26 123.12 3flz h ALA 271 Ca -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3flz h ALA 271 Cb 0.83 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.60 3flz h ALA 271 CO 0.06 0.19 -0.40 -0.91 0.00 0.00 0.00 179.25 178.18 3flz h ASN 272 N 0.00 0.00 0.11 0.00 -0.26 -1.80 -3.34 115.58 110.29 3flz h ASN 272 Ca -0.00 -0.10 -0.27 0.00 -0.56 0.00 0.00 56.30 55.37 3flz h ASN 272 Cb 0.30 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.55 3flz h ASN 272 CO 0.02 0.05 -1.39 0.58 -1.06 0.00 0.00 177.43 175.63 3flz h VAL 273 N 0.00 1.03 -2.55 2.81 2.07 -1.05 -3.40 116.25 115.17 3flz h VAL 273 Ca 0.00 -2.39 -0.75 0.00 0.82 0.00 0.00 66.70 64.38 3flz h VAL 273 Cb 0.80 2.70 -0.32 0.00 -1.52 0.00 0.00 31.29 32.95 3flz h VAL 273 CO 0.00 0.69 0.46 0.49 0.02 0.00 0.00 177.57 179.23 3flz n PHE 274 N -3.95 2.81 -1.79 1.57 3.01 0.71 -5.04 117.46 114.78 3flz n PHE 274 Ca -0.25 -3.00 -0.42 0.00 1.01 0.00 0.00 57.45 54.79 3flz n PHE 274 Cb 0.88 -1.03 -0.03 0.00 -0.01 0.00 0.00 39.48 39.29 3flz n PHE 274 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 3flz s ILE 275 N -3.32 2.56 0.00 4.37 1.01 -1.25 -2.39 121.20 122.18 3flz s ILE 275 Ca 0.37 0.19 0.00 0.00 0.00 0.00 0.00 60.65 61.20 3flz s ILE 275 Cb 0.13 -3.12 0.00 0.00 0.01 0.00 0.00 42.46 39.48 3flz s ILE 275 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.56 3flz n GLY 276 N 4.07 1.02 3.82 6.18 0.00 -1.26 -5.04 105.19 113.98 3flz n GLY 276 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 3flz n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3flz s ALA 277 N -2.86 3.22 -0.30 4.61 0.00 -1.01 -4.98 121.76 120.45 3flz s ALA 277 Ca 0.00 0.28 -0.42 0.00 0.00 0.00 0.00 51.96 51.83 3flz s ALA 277 Cb 0.00 -2.99 -0.17 0.00 0.00 0.00 0.00 23.12 19.96 3flz s ALA 277 CO 0.00 0.23 1.65 -1.71 0.00 0.00 0.00 175.76 175.93 3flz n ASN 278 N -0.06 1.92 -0.17 0.00 2.85 -1.26 -4.83 115.26 113.70 3flz n ASN 278 Ca 0.03 1.11 0.22 0.00 -0.11 0.00 0.00 54.58 55.84 3flz n ASN 278 Cb 0.52 -1.06 0.61 0.00 1.24 0.00 0.00 39.78 41.09 3flz n ASN 278 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3flz h PRO 279 N 6.26 0.19 -0.21 1.20 0.11 -1.97 0.93 132.00 138.52 3flz h PRO 279 Ca -0.46 -0.01 -0.12 0.00 0.11 0.00 0.00 66.00 65.52 3flz h PRO 279 Cb 1.34 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 3flz h PRO 279 CO 0.94 0.13 -0.37 -0.07 -0.21 0.00 0.00 178.00 178.42 3flz h LEU 280 N 0.20 0.47 -0.35 2.35 3.38 -1.99 -1.05 115.31 118.32 3flz h LEU 280 Ca 0.41 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 58.13 3flz h LEU 280 Cb 1.30 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 3flz h LEU 280 CO -0.08 0.80 -0.01 0.00 0.09 0.00 0.00 178.44 179.24 3flz h ALA 281 N 1.23 0.47 -0.31 1.53 0.00 -1.22 -2.09 119.26 118.87 3flz h ALA 281 Ca 0.04 -0.25 0.06 0.00 0.00 0.00 0.00 54.91 54.76 3flz h ALA 281 Cb 0.82 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.43 3flz h ALA 281 CO 0.07 0.24 -0.02 0.28 0.00 0.00 0.00 179.25 179.82 3flz h VAL 282 N 0.43 0.76 -0.24 0.00 2.07 -1.16 -0.97 116.25 117.14 3flz h VAL 282 Ca 0.10 -0.02 0.02 0.00 0.82 0.00 0.00 66.70 67.61 3flz h VAL 282 Cb 0.46 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 3flz h VAL 282 CO 0.02 0.01 0.10 -0.78 0.02 0.00 0.00 177.57 176.94 3flz h ASP 283 N 0.07 0.12 -0.15 0.57 3.58 -1.09 -1.79 116.42 117.73 3flz h ASP 283 Ca 0.15 0.02 0.01 0.00 0.42 0.00 0.00 57.03 57.63 3flz h ASP 283 Cb 0.21 -0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.24 3flz h ASP 283 CO -0.26 0.10 0.06 0.25 -2.88 0.00 0.00 179.24 176.51 3flz h LEU 284 N 0.21 0.09 -0.86 2.28 5.85 -1.16 -2.36 115.31 119.37 3flz h LEU 284 Ca 0.10 0.01 0.16 0.00 0.84 0.00 0.00 57.88 58.99 3flz h LEU 284 Cb 0.05 -0.01 -0.10 0.00 0.37 0.00 0.00 40.66 40.98 3flz h LEU 284 CO -0.09 0.07 0.43 -0.07 -0.34 0.00 0.00 178.44 178.44 3flz h LEU 285 N 0.15 0.50 -1.40 2.25 3.38 -0.92 -0.15 115.31 119.12 3flz h LEU 285 Ca 0.06 0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 3flz h LEU 285 Cb 0.02 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 3flz h LEU 285 CO -0.05 0.19 0.14 -0.33 0.09 0.00 0.00 178.44 178.48 3flz h GLU 286 N 0.59 0.54 0.00 1.13 5.08 -0.83 0.49 114.58 121.59 3flz h GLU 286 Ca 0.48 -0.07 -0.14 0.00 -1.00 0.00 0.00 59.36 58.62 3flz h GLU 286 Cb 0.72 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 3flz h GLU 286 CO -0.39 0.46 -0.71 0.87 -1.00 0.00 0.00 179.01 178.24 3flz h LYS 287 N 0.54 0.00 0.22 2.33 1.57 -0.66 -3.33 116.57 117.24 3flz h LYS 287 Ca 0.13 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.59 3flz h LYS 287 Cb 0.13 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.47 3flz h LYS 287 CO -0.01 0.65 -1.46 0.52 -0.57 0.00 0.00 179.45 178.58 3flz h MET 288 N 0.00 0.47 -2.29 3.15 2.86 -0.77 -2.36 114.93 115.99 3flz h MET 288 Ca -0.02 -0.81 -0.76 0.00 -2.06 0.00 0.00 59.70 56.05 3flz h MET 288 Cb 1.52 0.30 -0.22 0.00 0.06 0.00 0.00 31.60 33.26 3flz h MET 288 CO 0.08 1.39 1.37 1.28 1.06 0.00 0.00 176.91 182.09 3flz n LEU 289 N -3.75 7.51 -4.83 1.22 4.77 0.13 -4.31 117.00 117.74 3flz n LEU 289 Ca -0.19 -5.06 -0.36 0.00 -0.03 0.00 0.00 56.01 50.37 3flz n LEU 289 Cb 1.06 -1.21 -0.07 0.00 -2.33 0.00 0.00 43.42 40.87 3flz n LEU 289 CO 0.57 1.99 -0.18 -0.69 -1.33 0.00 0.00 177.39 177.75 3flz s VAL 290 N -3.40 5.45 0.08 4.08 1.01 -1.26 -4.89 120.40 121.47 3flz s VAL 290 Ca 0.47 0.19 -0.17 0.00 0.00 0.00 0.00 61.98 62.47 3flz s VAL 290 Cb 0.24 -3.41 -0.10 0.00 0.00 0.00 0.00 36.38 33.11 3flz s VAL 290 CO -0.17 0.56 1.43 0.25 0.00 0.00 0.00 175.10 177.17 3flz h LEU 291 N 5.54 0.55 -9.01 3.92 5.85 -1.91 -3.41 115.31 116.83 3flz h LEU 291 Ca -0.50 -0.42 -0.57 0.00 0.84 0.00 0.00 57.88 57.23 3flz h LEU 291 Cb 1.20 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 42.03 3flz h LEU 291 CO 0.64 0.85 0.94 -0.62 -0.34 0.00 0.00 178.44 179.91 3flz s ASP 292 N -6.23 6.76 0.46 1.25 3.68 -1.26 -4.90 116.67 116.44 3flz s ASP 292 Ca -0.13 1.34 0.24 0.00 2.13 0.00 0.00 52.55 56.13 3flz s ASP 292 Cb 0.07 -2.54 1.10 0.00 -1.45 0.00 0.00 42.92 40.10 3flz s ASP 292 CO 0.78 -0.98 1.91 0.77 0.13 0.00 0.00 175.17 177.79 3flz h SER 293 N 8.92 0.00 0.19 -0.34 4.64 -1.98 -2.21 113.55 122.76 3flz h SER 293 Ca -0.26 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.05 3flz h SER 293 Cb 1.10 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.19 3flz h SER 293 CO 1.01 0.21 -0.04 0.44 -0.87 0.00 0.00 176.83 177.58 3flz h ASP 294 N 0.00 0.00 -0.02 4.97 3.45 -1.95 -3.10 116.42 119.77 3flz h ASP 294 Ca -0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 3flz h ASP 294 Cb 0.60 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.37 3flz h ASP 294 CO 0.03 0.04 -0.05 0.29 -1.57 0.00 0.00 179.24 177.97 3flz n LYS 295 N -3.52 1.29 -2.09 3.56 5.02 -0.83 -4.99 118.16 116.60 3flz n LYS 295 Ca -0.02 -1.32 -0.38 0.00 -2.02 0.00 0.00 58.31 54.57 3flz n LYS 295 Cb 0.14 -1.29 0.01 0.00 -0.02 0.00 0.00 35.03 33.87 3flz n LYS 295 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3flz s ARG 296 N -1.40 3.61 0.46 1.97 0.52 -1.17 -4.99 118.95 117.96 3flz s ARG 296 Ca 0.17 1.96 -0.25 0.00 -0.52 0.00 0.00 55.73 57.10 3flz s ARG 296 Cb 0.13 -2.42 -0.08 0.00 0.52 0.00 0.00 34.95 33.10 3flz s ARG 296 CO 0.23 -0.72 1.39 -1.50 0.02 0.00 0.00 175.30 174.71 3flz s ILE 297 N -1.43 2.18 0.58 1.52 2.07 -0.89 -5.04 121.20 120.19 3flz s ILE 297 Ca 0.65 0.15 -0.02 0.00 -1.41 0.00 0.00 60.65 60.02 3flz s ILE 297 Cb -0.33 -3.09 0.03 0.00 0.13 0.00 0.00 42.46 39.20 3flz s ILE 297 CO 0.40 0.02 0.83 0.42 -1.91 0.00 0.00 174.94 174.71 3flz s THR 298 N -1.24 2.94 0.10 4.00 -4.23 -1.26 -4.91 115.64 111.04 3flz s THR 298 Ca 0.62 -0.44 -0.20 0.00 -1.18 0.00 0.00 61.69 60.49 3flz s THR 298 Cb -0.42 -3.15 -0.08 0.00 1.34 0.00 0.00 72.50 70.19 3flz s THR 298 CO 0.53 -0.12 1.63 0.00 -0.54 0.00 0.00 174.62 176.12 3flz h ALA 299 N -0.07 0.28 -0.56 3.99 0.00 -1.93 0.49 119.26 121.46 3flz h ALA 299 Ca -0.44 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.42 3flz h ALA 299 Cb 1.29 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.94 3flz h ALA 299 CO 0.56 -0.12 0.26 0.00 0.00 0.00 0.00 179.25 179.96 3flz h ALA 300 N 0.93 0.73 -0.38 0.00 0.00 -1.93 -1.53 119.26 117.08 3flz h ALA 300 Ca 0.07 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3flz h ALA 300 Cb 0.18 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3flz h ALA 300 CO -0.01 -0.10 0.11 1.96 0.00 0.00 0.00 179.25 181.21 3flz h GLN 301 N 0.50 0.59 -0.36 0.00 4.20 -1.91 -3.13 115.11 115.00 3flz h GLN 301 Ca 0.26 -0.13 -0.04 0.00 0.06 0.00 0.00 58.65 58.80 3flz h GLN 301 Cb 0.22 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 3flz h GLN 301 CO -0.21 0.61 0.06 0.00 -0.67 0.00 0.00 178.83 178.62 3flz h ALA 302 N 0.96 1.44 -0.19 3.87 0.00 -0.53 -2.17 119.26 122.64 3flz h ALA 302 Ca 0.12 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.88 3flz h ALA 302 Cb 0.27 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3flz h ALA 302 CO -0.00 0.41 0.13 -0.07 0.00 0.00 0.00 179.25 179.71 3flz h LEU 303 N 0.52 0.19 -0.30 0.00 3.38 -1.23 -1.44 115.31 116.43 3flz h LEU 303 Ca 0.12 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3flz h LEU 303 Cb 0.24 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3flz h LEU 303 CO 0.00 0.14 -0.06 0.00 0.09 0.00 0.00 178.44 178.61 3flz n ALA 304 N -2.52 2.70 -1.77 1.53 0.00 -0.82 -4.74 120.51 114.89 3flz n ALA 304 Ca 0.00 -0.28 -0.38 0.00 0.00 0.00 0.00 53.44 52.78 3flz n ALA 304 Cb 0.10 -1.36 -0.02 0.00 0.00 0.00 0.00 19.45 18.17 3flz n ALA 304 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3flz s HIS 305 N -2.27 3.08 0.55 0.00 5.04 -0.55 -4.92 115.29 116.22 3flz s HIS 305 Ca 0.35 1.55 0.30 0.00 -1.54 0.00 0.00 55.06 55.72 3flz s HIS 305 Cb 0.21 -3.41 1.46 0.00 0.04 0.00 0.00 32.58 30.88 3flz s HIS 305 CO 0.42 -1.34 1.91 0.00 -2.34 0.00 0.00 174.74 173.40 3flz h ALA 306 N 2.74 2.63 -0.53 1.58 0.00 -1.90 -1.90 119.26 121.87 3flz h ALA 306 Ca -0.49 -0.03 0.13 0.00 0.00 0.00 0.00 54.91 54.53 3flz h ALA 306 Cb 1.23 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 3flz h ALA 306 CO 0.63 -0.92 0.37 -0.92 0.00 0.00 0.00 179.25 178.41 3flz h TYR 307 N 0.00 0.16 -0.53 0.00 3.20 -1.91 -1.98 116.97 115.91 3flz h TYR 307 Ca 0.34 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.22 3flz h TYR 307 Cb 1.45 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.66 3flz h TYR 307 CO 0.00 0.07 0.00 1.19 -1.64 0.00 0.00 178.16 177.78 3flz n PHE 308 N -4.43 1.69 -0.32 -3.82 3.01 -0.72 -4.70 117.46 108.18 3flz n PHE 308 Ca 0.09 -0.72 0.18 0.00 1.01 0.00 0.00 57.45 58.01 3flz n PHE 308 Cb 0.50 -0.40 0.37 0.00 -0.01 0.00 0.00 39.48 39.95 3flz n PHE 308 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3flz h ALA 309 N 3.57 1.60 0.00 4.37 0.00 -1.48 0.19 119.26 127.51 3flz h ALA 309 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3flz h ALA 309 Cb 1.72 0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.72 3flz h ALA 309 CO 0.37 -0.47 0.00 0.00 0.00 0.00 0.00 179.25 179.15 3flz n GLN 310 N -5.10 0.14 -0.04 0.00 10.64 -1.26 -3.75 117.38 118.01 3flz n GLN 310 Ca 0.26 0.01 -0.04 0.00 -1.83 0.00 0.00 57.00 55.39 3flz n GLN 310 Cb 0.80 -1.50 -0.06 0.00 -0.86 0.00 0.00 30.24 28.62 3flz n GLN 310 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 3flz n TYR 311 N -1.43 0.00 -1.71 2.61 4.02 0.26 -5.05 117.16 115.86 3flz n TYR 311 Ca 0.09 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.55 3flz n TYR 311 Cb 0.30 -0.38 -0.03 0.00 -0.02 0.00 0.00 39.34 39.21 3flz n TYR 311 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 176.86 177.43 3flz n HIS 312 N -2.32 2.62 -3.43 -0.72 -0.00 0.42 -4.98 115.22 106.81 3flz n HIS 312 Ca -0.13 0.12 -0.18 0.00 0.46 0.00 0.00 57.72 58.00 3flz n HIS 312 Cb 0.75 -2.63 -0.11 0.00 -0.12 0.00 0.00 29.99 27.88 3flz n HIS 312 CO 0.00 0.00 0.00 0.34 0.46 0.00 0.00 176.34 177.14 3flz s ASP 313 N 1.03 1.59 0.62 0.26 3.68 -1.26 -4.99 116.67 117.60 3flz s ASP 313 Ca 0.75 -0.55 0.33 0.00 2.13 0.00 0.00 52.55 55.21 3flz s ASP 313 Cb -0.55 0.46 1.87 0.00 -1.45 0.00 0.00 42.92 43.25 3flz s ASP 313 CO 0.35 -0.37 2.16 -0.65 0.13 0.00 0.00 175.17 176.79 3flz h PRO 314 N 8.28 0.00 -0.13 4.34 0.11 -1.97 -0.22 132.00 142.41 3flz h PRO 314 Ca -0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.96 3flz h PRO 314 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3flz h PRO 314 CO 0.32 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 177.86 3flz n ASP 315 N -3.47 2.50 -1.98 -2.05 10.43 -1.26 -4.08 116.55 116.65 3flz n ASP 315 Ca -0.01 -1.83 -0.06 0.00 2.57 0.00 0.00 54.79 55.47 3flz n ASP 315 Cb 0.25 -0.08 0.06 0.00 1.84 0.00 0.00 41.12 43.19 3flz n ASP 315 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 3flz n ASP 316 N 0.91 2.54 -3.40 -2.24 2.03 -0.10 -4.89 116.55 111.40 3flz n ASP 316 Ca 0.17 -2.86 -0.26 0.00 0.52 0.00 0.00 54.79 52.36 3flz n ASP 316 Cb 0.49 -0.41 -0.09 0.00 -0.72 0.00 0.00 41.12 40.39 3flz n ASP 316 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3flz n GLU 317 N -0.52 1.09 -1.74 -0.67 1.02 -1.20 -4.89 120.64 113.72 3flz n GLU 317 Ca 0.20 -3.68 -0.32 0.00 -0.02 0.00 0.00 57.16 53.35 3flz n GLU 317 Cb 0.90 -1.70 0.04 0.00 -0.02 0.00 0.00 31.44 30.65 3flz n GLU 317 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 3flz s PRO 318 N -1.13 3.06 0.40 3.49 0.04 -1.26 -4.97 135.00 134.63 3flz s PRO 318 Ca 0.34 1.06 0.08 0.00 0.04 0.00 0.00 61.00 62.51 3flz s PRO 318 Cb 0.10 -2.00 -0.00 0.00 0.04 0.00 0.00 34.50 32.63 3flz s PRO 318 CO -0.12 -1.00 0.49 0.14 0.04 0.00 0.00 177.00 176.54 3flz s VAL 319 N -2.81 3.07 0.32 -0.36 -7.23 -1.26 -4.12 120.40 108.01 3flz s VAL 319 Ca 0.60 -1.11 -0.05 0.00 -1.81 0.00 0.00 61.98 59.61 3flz s VAL 319 Cb -0.15 -3.06 -0.05 0.00 0.56 0.00 0.00 36.38 33.68 3flz s VAL 319 CO 0.48 -0.03 0.59 0.00 -0.31 0.00 0.00 175.10 175.83 3flz s ALA 320 N -2.36 3.58 0.70 1.32 0.00 -1.25 -5.01 121.76 118.74 3flz s ALA 320 Ca 0.51 -0.54 -0.16 0.00 0.00 0.00 0.00 51.96 51.77 3flz s ALA 320 Cb -0.08 -2.35 0.02 0.00 0.00 0.00 0.00 23.12 20.71 3flz s ALA 320 CO 0.31 0.16 1.22 -0.51 0.00 0.00 0.00 175.76 176.94 3flz s ASP 321 N -3.27 4.41 0.31 0.00 -0.00 -1.26 -4.77 116.67 112.08 3flz s ASP 321 Ca 0.45 2.39 -0.28 0.00 -0.00 0.00 0.00 52.55 55.11 3flz s ASP 321 Cb -0.11 -2.59 -0.13 0.00 -0.00 0.00 0.00 42.92 40.09 3flz s ASP 321 CO 0.31 -2.12 1.10 -2.65 -0.00 0.00 0.00 175.17 171.81 3flz n PRO 322 N -2.44 1.61 -4.00 8.23 -0.02 -1.26 -4.79 135.00 132.34 3flz n PRO 322 Ca 0.14 0.56 -0.34 0.00 -2.02 0.00 0.00 63.50 61.84 3flz n PRO 322 Cb 0.50 -2.01 -0.15 0.00 -0.02 0.00 0.00 33.50 31.83 3flz n PRO 322 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3flz s TYR 323 N -1.07 3.10 -0.52 6.00 5.04 -1.26 -5.08 117.35 123.55 3flz s TYR 323 Ca 0.57 -1.77 -0.25 0.00 -2.44 0.00 0.00 57.07 53.18 3flz s TYR 323 Cb -0.66 -2.02 0.03 0.00 0.35 0.00 0.00 41.96 39.67 3flz s TYR 323 CO 0.61 -0.78 0.98 0.34 -1.34 0.00 0.00 175.55 175.36 3flz s ASP 324 N 1.26 6.43 -0.26 4.32 -1.08 -1.26 -4.88 116.67 121.20 3flz s ASP 324 Ca -0.02 -0.06 0.09 0.00 -0.52 0.00 0.00 52.55 52.04 3flz s ASP 324 Cb -0.17 -2.47 0.46 0.00 -1.46 0.00 0.00 42.92 39.28 3flz s ASP 324 CO -0.05 -1.20 1.33 0.00 0.52 0.00 0.00 175.17 175.76 3flz n GLN 325 N 7.53 1.98 0.32 4.34 10.64 -1.26 -4.70 117.38 136.22 3flz n GLN 325 Ca 0.05 -3.39 0.19 0.00 -1.83 0.00 0.00 57.00 52.02 3flz n GLN 325 Cb 0.48 -1.80 1.06 0.00 -0.86 0.00 0.00 30.24 29.13 3flz n GLN 325 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 3flz h SER 326 N 1.19 0.00 0.08 2.61 4.64 -2.02 -1.80 113.55 118.24 3flz h SER 326 Ca 0.15 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.46 3flz h SER 326 Cb 1.31 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.40 3flz h SER 326 CO 0.29 0.00 -0.03 2.19 -0.87 0.00 0.00 176.83 178.42 3flz h PHE 327 N 0.00 0.00 -0.61 4.77 -5.15 -1.96 -2.99 116.94 111.01 3flz h PHE 327 Ca -0.00 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.77 3flz h PHE 327 Cb 0.02 0.00 -0.03 0.00 0.22 0.00 0.00 35.95 36.16 3flz h PHE 327 CO 0.00 0.03 0.38 0.93 -2.00 0.00 0.00 178.31 177.65 3flz h GLU 328 N 0.00 0.81 -0.56 6.09 4.39 -1.71 -0.89 114.58 122.70 3flz h GLU 328 Ca -0.00 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.64 3flz h GLU 328 Cb 0.07 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.54 3flz h GLU 328 CO 0.00 0.55 0.00 -1.13 -1.16 0.00 0.00 179.01 177.27 3flz n SER 329 N -4.43 3.10 -4.82 1.42 3.41 -1.13 -4.93 113.62 106.25 3flz n SER 329 Ca 0.06 -2.13 -0.37 0.00 -0.26 0.00 0.00 58.87 56.17 3flz n SER 329 Cb 0.06 -0.41 -0.06 0.00 -0.26 0.00 0.00 64.21 63.54 3flz n SER 329 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 3flz s ARG 330 N -1.49 3.84 -0.30 4.33 3.52 -0.34 -5.07 118.95 123.44 3flz s ARG 330 Ca 0.36 0.08 -0.10 0.00 -0.13 0.00 0.00 55.73 55.95 3flz s ARG 330 Cb 0.20 -3.27 -0.01 0.00 -1.56 0.00 0.00 34.95 30.31 3flz s ARG 330 CO 0.21 0.59 0.15 -0.51 -0.81 0.00 0.00 175.30 174.93 3flz s ASP 331 N -0.58 5.55 0.29 -2.12 1.01 -1.26 -5.03 116.67 114.54 3flz s ASP 331 Ca 0.18 -0.47 0.03 0.00 0.71 0.00 0.00 52.55 53.00 3flz s ASP 331 Cb -0.14 -2.01 -0.06 0.00 1.01 0.00 0.00 42.92 41.73 3flz s ASP 331 CO 0.06 -0.17 0.04 -0.76 0.21 0.00 0.00 175.17 174.55 3flz s LEU 332 N 1.62 2.11 0.60 1.23 1.43 -1.26 -5.16 118.68 119.25 3flz s LEU 332 Ca 0.05 -1.34 -0.06 0.00 -1.03 0.00 0.00 54.13 51.76 3flz s LEU 332 Cb -0.17 -0.31 0.01 0.00 0.03 0.00 0.00 46.19 45.75 3flz s LEU 332 CO 0.06 -0.59 0.90 -0.76 0.23 0.00 0.00 176.35 176.20 3flz s LEU 333 N -3.42 3.21 0.13 1.79 1.43 -1.26 -4.91 118.68 115.64 3flz s LEU 333 Ca 0.35 0.68 -0.24 0.00 -1.03 0.00 0.00 54.13 53.88 3flz s LEU 333 Cb 0.08 -3.49 -0.03 0.00 0.03 0.00 0.00 46.19 42.78 3flz s LEU 333 CO 0.14 -1.10 1.64 0.40 0.23 0.00 0.00 176.35 177.65 3flz h ILE 334 N -0.20 0.44 -0.03 -0.59 2.04 -1.95 -1.76 117.51 115.47 3flz h ILE 334 Ca -0.45 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.41 3flz h ILE 334 Cb 1.26 0.44 -0.00 0.00 -0.74 0.00 0.00 36.82 37.78 3flz h ILE 334 CO 0.60 0.00 0.02 0.44 0.00 0.00 0.00 178.15 179.21 3flz h ASP 335 N -0.33 0.02 -0.16 1.72 3.45 -1.96 0.48 116.42 119.64 3flz h ASP 335 Ca 0.08 -0.00 -0.12 0.00 0.43 0.00 0.00 57.03 57.42 3flz h ASP 335 Cb 0.45 -0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.22 3flz h ASP 335 CO -0.27 0.01 -0.37 -0.33 -1.57 0.00 0.00 179.24 176.71 3flz h GLU 336 N 0.02 0.53 -0.54 3.56 5.08 -1.78 -0.21 114.58 121.24 3flz h GLU 336 Ca 0.01 -0.36 -0.07 0.00 -1.00 0.00 0.00 59.36 57.94 3flz h GLU 336 Cb 0.02 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 3flz h GLU 336 CO -0.00 0.98 0.05 -1.49 -1.00 0.00 0.00 179.01 177.55 3flz h TRP 337 N 0.17 0.92 -0.61 4.33 -0.00 -0.61 -1.66 115.95 118.50 3flz h TRP 337 Ca -0.00 -0.12 -0.10 0.00 -0.00 0.00 0.00 58.89 58.67 3flz h TRP 337 Cb 0.98 -0.26 -0.02 0.00 -0.00 0.00 0.00 29.16 29.86 3flz h TRP 337 CO 0.10 0.81 -0.01 -0.22 -0.00 0.00 0.00 178.44 179.12 3flz h LYS 338 N 0.82 1.08 -0.32 0.49 3.64 -0.92 -0.78 116.57 120.58 3flz h LYS 338 Ca 0.17 -0.35 -0.05 0.00 -1.27 0.00 0.00 60.65 59.14 3flz h LYS 338 Cb 0.42 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 3flz h LYS 338 CO 0.01 1.06 -0.00 1.03 -2.27 0.00 0.00 179.45 179.28 3flz h SER 339 N 0.98 0.55 -0.68 4.20 0.87 -0.87 -1.01 113.55 117.58 3flz h SER 339 Ca 0.17 -0.31 0.04 0.00 -1.23 0.00 0.00 61.79 60.46 3flz h SER 339 Cb 0.57 -0.15 -0.05 0.00 -0.44 0.00 0.00 62.40 62.34 3flz h SER 339 CO 0.03 0.73 0.42 -0.07 -0.53 0.00 0.00 176.83 177.41 3flz h LEU 340 N 0.36 0.67 -0.55 2.23 3.38 -1.26 -1.48 115.31 118.66 3flz h LEU 340 Ca 0.09 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 3flz h LEU 340 Cb 0.44 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 3flz h LEU 340 CO 0.02 0.46 0.33 0.74 0.09 0.00 0.00 178.44 180.07 3flz h THR 341 N 0.80 1.17 -0.32 0.22 2.02 -1.03 -2.58 112.91 113.19 3flz h THR 341 Ca 0.28 -0.39 0.01 0.00 0.77 0.00 0.00 66.41 67.09 3flz h THR 341 Cb 0.06 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 66.89 3flz h THR 341 CO -0.13 0.17 0.20 0.22 0.37 0.00 0.00 175.52 176.35 3flz h TYR 342 N 0.74 0.37 -0.93 3.16 3.20 -0.86 -1.36 116.97 121.27 3flz h TYR 342 Ca 0.20 0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.21 3flz h TYR 342 Cb -0.00 -0.12 -0.08 0.00 1.54 0.00 0.00 36.73 38.07 3flz h TYR 342 CO -0.02 0.22 0.60 -0.44 -1.64 0.00 0.00 178.16 176.88 3flz h ASP 343 N 0.40 0.76 0.30 -2.11 3.32 -1.13 -1.14 116.42 116.82 3flz h ASP 343 Ca 0.12 0.05 -0.18 0.00 0.02 0.00 0.00 57.03 57.04 3flz h ASP 343 Cb -0.02 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 3flz h ASP 343 CO -0.05 0.39 -0.71 -0.33 -1.72 0.00 0.00 179.24 176.82 3flz h GLU 344 N 0.80 0.36 0.02 3.56 4.39 -0.95 -1.84 114.58 120.92 3flz h GLU 344 Ca 0.47 -0.29 -0.00 0.00 0.34 0.00 0.00 59.36 59.88 3flz h GLU 344 Cb 0.64 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.35 3flz h GLU 344 CO -0.23 0.93 -0.01 0.28 -1.16 0.00 0.00 179.01 178.82 3flz h VAL 345 N 0.25 1.21 -0.91 3.13 2.07 -0.75 -3.14 116.25 118.11 3flz h VAL 345 Ca -0.03 -0.69 0.04 0.00 0.82 0.00 0.00 66.70 66.84 3flz h VAL 345 Cb 1.28 1.68 -0.05 0.00 -1.52 0.00 0.00 31.29 32.68 3flz h VAL 345 CO 0.12 0.18 0.60 0.40 0.02 0.00 0.00 177.57 178.89 3flz h ILE 346 N -0.32 1.14 -0.01 4.57 1.08 -1.20 -2.79 117.51 119.98 3flz h ILE 346 Ca -0.00 -0.39 0.00 0.00 -0.39 0.00 0.00 64.86 64.08 3flz h ILE 346 Cb 0.31 -0.08 0.00 0.00 -3.07 0.00 0.00 36.82 33.98 3flz h ILE 346 CO 0.00 0.21 -0.03 -1.54 -0.69 0.00 0.00 178.15 176.09 3flz n SER 347 N -4.45 0.82 -4.73 1.72 3.41 -0.70 -4.93 113.62 104.76 3flz n SER 347 Ca 0.12 -1.14 -0.42 0.00 -0.26 0.00 0.00 58.87 57.18 3flz n SER 347 Cb 0.12 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.04 3flz n SER 347 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 3flz s PHE 348 N -2.12 2.95 -0.17 7.33 5.36 -1.06 -5.01 117.98 125.27 3flz s PHE 348 Ca 0.39 0.70 0.01 0.00 -0.96 0.00 0.00 56.93 57.07 3flz s PHE 348 Cb 0.21 -3.97 0.01 0.00 -0.34 0.00 0.00 43.02 38.93 3flz s PHE 348 CO 0.38 -3.45 -0.18 0.08 -1.46 0.00 0.00 175.22 170.59 3flz s VAL 349 N 0.62 2.26 0.67 3.12 1.01 -1.26 -5.08 120.40 121.74 3flz s VAL 349 Ca 0.67 -0.89 -0.17 0.00 0.00 0.00 0.00 61.98 61.59 3flz s VAL 349 Cb -0.45 -1.95 0.00 0.00 0.00 0.00 0.00 36.38 33.99 3flz s VAL 349 CO 0.38 0.53 1.26 -2.16 0.00 0.00 0.00 175.10 175.11 3flz s PRO 350 N 1.12 2.42 0.70 2.72 0.04 -1.26 -5.01 135.00 135.73 3flz s PRO 350 Ca 0.01 1.97 -0.11 0.00 0.04 0.00 0.00 61.00 62.90 3flz s PRO 350 Cb -0.14 -1.84 0.02 0.00 0.04 0.00 0.00 34.50 32.57 3flz s PRO 350 CO -0.07 -1.67 1.07 -1.25 0.04 0.00 0.00 177.00 175.12 3flz s PRO 351 N -3.53 2.78 0.00 0.56 0.04 -1.26 -5.16 135.00 128.42 3flz s PRO 351 Ca 0.80 1.07 0.00 0.00 0.04 0.00 0.00 61.00 62.91 3flz s PRO 351 Cb -0.35 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.23 3flz s PRO 351 CO 0.41 -1.23 0.17 -2.30 0.04 0.00 0.00 177.00 174.09