#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fwh s ASN 3 N 0.00 0.52 -0.03 4.04 0.01 -1.26 -5.14 114.94 113.08 1fwh s ASN 3 Ca 0.00 -0.49 -0.07 0.00 -0.71 0.00 0.00 52.86 51.59 1fwh s ASN 3 Cb 0.00 0.06 0.01 0.00 0.41 0.00 0.00 41.25 41.73 1fwh s ASN 3 CO 0.00 -0.23 0.17 -0.51 -1.51 0.00 0.00 177.10 175.02 1fwh s ILE 4 N -1.31 0.05 0.59 0.60 2.07 -1.26 -5.15 121.20 116.79 1fwh s ILE 4 Ca -0.12 -0.38 -0.15 0.00 -1.41 0.00 0.00 60.65 58.59 1fwh s ILE 4 Cb -0.09 -0.37 -0.04 0.00 0.13 0.00 0.00 42.46 42.09 1fwh s ILE 4 CO -0.00 -0.21 1.05 -0.94 -1.91 0.00 0.00 174.94 172.92 1fwh s SER 5 N -0.74 5.86 0.30 4.50 1.04 -1.26 -4.89 113.70 118.52 1fwh s SER 5 Ca -0.08 1.75 -0.02 0.00 0.48 0.00 0.00 55.95 58.08 1fwh s SER 5 Cb -0.05 -2.52 0.46 0.00 0.10 0.00 0.00 66.02 64.01 1fwh s SER 5 CO 0.01 -1.11 1.96 0.03 0.98 0.00 0.00 173.24 175.11 1fwh h ARG 6 N 0.36 1.04 -0.24 4.02 3.08 -2.01 -0.40 114.38 120.23 1fwh h ARG 6 Ca -0.46 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 59.47 1fwh h ARG 6 Cb 1.21 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 31.02 1fwh h ARG 6 CO 0.58 0.71 -0.02 0.37 -1.07 0.00 0.00 179.97 180.53 1fwh h GLN 7 N 1.07 0.44 -0.34 0.04 5.75 -1.99 0.08 115.11 120.16 1fwh h GLN 7 Ca 0.29 -0.15 -0.06 0.00 -0.15 0.00 0.00 58.65 58.58 1fwh h GLN 7 Cb -0.10 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.40 1fwh h GLN 7 CO -0.06 0.64 -0.03 0.00 -2.65 0.00 0.00 178.83 176.73 1fwh h ALA 8 N 0.79 1.31 -0.11 3.38 0.00 -1.90 -1.76 119.26 120.97 1fwh h ALA 8 Ca 0.07 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1fwh h ALA 8 Cb 0.45 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1fwh h ALA 8 CO 0.02 0.47 0.03 -0.92 0.00 0.00 0.00 179.25 178.84 1fwh h TYR 9 N 0.52 0.18 -0.54 0.00 3.20 -0.81 -2.23 116.97 117.29 1fwh h TYR 9 Ca 0.11 -0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.95 1fwh h TYR 9 Cb 0.38 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.58 1fwh h TYR 9 CO 0.01 0.33 0.33 0.00 -1.64 0.00 0.00 178.16 177.19 1fwh h ALA 10 N 0.83 1.56 -0.05 1.82 0.00 -0.60 0.13 119.26 122.95 1fwh h ALA 10 Ca 0.03 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 1fwh h ALA 10 Cb 0.24 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1fwh h ALA 10 CO -0.00 0.39 -0.48 -0.44 0.00 0.00 0.00 179.25 178.72 1fwh h ASP 11 N 0.74 0.13 0.15 0.00 3.45 -1.15 0.27 116.42 120.02 1fwh h ASP 11 Ca 0.20 -0.06 -0.36 0.00 0.43 0.00 0.00 57.03 57.24 1fwh h ASP 11 Cb -0.03 -0.04 -0.01 0.00 -0.56 0.00 0.00 39.33 38.69 1fwh h ASP 11 CO -0.04 0.59 -1.91 0.24 -1.57 0.00 0.00 179.24 176.55 1fwh h MET 12 N 0.10 0.31 0.00 3.56 2.86 -0.74 -3.41 114.93 117.61 1fwh h MET 12 Ca 0.00 -0.53 0.00 0.00 -2.06 0.00 0.00 59.70 57.11 1fwh h MET 12 Cb 0.89 0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.75 1fwh h MET 12 CO 0.07 1.25 0.00 1.19 1.06 0.00 0.00 176.91 180.48 1fwh n PHE 13 N -3.52 0.00 0.00 -0.22 3.01 0.38 -4.97 117.46 112.14 1fwh n PHE 13 Ca -0.29 -0.20 0.00 0.00 1.01 0.00 0.00 57.45 57.97 1fwh n PHE 13 Cb 1.06 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 40.51 1fwh n PHE 13 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1fwh n GLY 14 N -0.20 -0.19 3.76 1.37 0.00 0.08 -4.40 105.19 105.62 1fwh n GLY 14 Ca 0.00 -1.77 -0.31 0.00 0.00 0.00 0.00 46.02 43.94 1fwh n GLY 14 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1fwh s PRO 15 N -1.97 2.18 0.22 1.61 0.04 -1.26 -4.00 135.00 131.82 1fwh s PRO 15 Ca 0.00 1.22 0.02 0.00 0.04 0.00 0.00 61.00 62.28 1fwh s PRO 15 Cb 0.00 -1.88 -0.01 0.00 0.04 0.00 0.00 34.50 32.65 1fwh s PRO 15 CO 0.00 -1.71 0.06 -2.37 0.04 0.00 0.00 177.00 173.02 1fwh n THR 16 N -3.51 0.00 -1.66 1.26 5.66 -1.26 -4.94 114.28 109.83 1fwh n THR 16 Ca 0.09 -1.23 -0.61 0.00 -3.05 0.00 0.00 64.05 59.26 1fwh n THR 16 Cb 0.53 0.40 -0.08 0.00 -1.55 0.00 0.00 70.33 69.62 1fwh n THR 16 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 1fwh n VAL 17 N -0.51 0.08 0.00 1.08 0.31 -1.26 -1.37 118.33 116.65 1fwh n VAL 17 Ca -0.05 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 1fwh n VAL 17 Cb 0.32 -0.61 0.00 0.00 -0.91 0.00 0.00 33.84 32.64 1fwh n VAL 17 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1fwh n GLY 18 N 3.23 3.27 3.80 2.92 0.00 -0.91 -4.97 105.19 112.54 1fwh n GLY 18 Ca 0.25 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.94 1fwh n GLY 18 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1fwh s ASP 19 N -0.48 6.22 0.16 1.61 1.01 -0.47 -4.79 116.67 119.93 1fwh s ASP 19 Ca 0.00 1.89 0.10 0.00 0.71 0.00 0.00 52.55 55.24 1fwh s ASP 19 Cb 0.00 -2.55 -0.04 0.00 1.01 0.00 0.00 42.92 41.34 1fwh s ASP 19 CO 0.00 -0.87 -0.16 -0.54 0.21 0.00 0.00 175.17 173.81 1fwh s LYS 20 N -3.47 1.82 -0.02 8.23 1.02 -1.26 -1.78 119.74 124.28 1fwh s LYS 20 Ca 0.66 -1.31 0.01 0.00 0.02 0.00 0.00 55.97 55.35 1fwh s LYS 20 Cb -0.16 -2.06 0.01 0.00 -0.52 0.00 0.00 37.83 35.11 1fwh s LYS 20 CO 0.24 0.44 -0.02 0.08 -0.92 0.00 0.00 175.35 175.18 1fwh s VAL 21 N -1.52 0.23 0.07 3.17 1.01 0.17 -4.95 120.40 118.58 1fwh s VAL 21 Ca 0.22 -0.02 -0.27 0.00 0.00 0.00 0.00 61.98 61.90 1fwh s VAL 21 Cb -0.09 -0.27 -0.05 0.00 0.00 0.00 0.00 36.38 35.96 1fwh s VAL 21 CO 0.12 0.12 0.84 -0.60 0.00 0.00 0.00 175.10 175.58 1fwh s ARG 22 N 0.56 4.57 -0.51 2.72 3.52 -1.26 -1.11 118.95 127.44 1fwh s ARG 22 Ca -0.06 1.21 -0.26 0.00 -0.13 0.00 0.00 55.73 56.49 1fwh s ARG 22 Cb -0.09 -3.37 0.03 0.00 -1.56 0.00 0.00 34.95 29.96 1fwh s ARG 22 CO -0.01 0.25 1.03 -0.51 -0.81 0.00 0.00 175.30 175.24 1fwh s LEU 23 N -0.00 3.84 0.00 -0.88 1.43 -0.40 -4.73 118.68 117.94 1fwh s LEU 23 Ca 0.42 0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.60 1fwh s LEU 23 Cb -0.21 -3.18 0.00 0.00 0.03 0.00 0.00 46.19 42.83 1fwh s LEU 23 CO 0.25 -1.22 0.00 0.00 0.23 0.00 0.00 176.35 175.61 1fwh n ALA 24 N 7.63 0.00 -1.27 4.21 0.00 0.14 -1.83 120.51 129.39 1fwh n ALA 24 Ca 0.07 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.37 1fwh n ALA 24 Cb 0.48 0.00 0.21 0.00 0.00 0.00 0.00 19.45 20.14 1fwh n ALA 24 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1fwh n ASP 25 N 1.89 3.51 -4.06 0.00 5.75 -1.26 -4.84 116.55 117.54 1fwh n ASP 25 Ca 0.00 -3.58 -0.18 0.00 -0.01 0.00 0.00 54.79 51.02 1fwh n ASP 25 Cb 0.00 -0.75 0.09 0.00 -1.03 0.00 0.00 41.12 39.43 1fwh n ASP 25 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1fwh n THR 26 N -0.97 0.00 -0.02 2.12 -2.24 -0.76 -4.80 114.28 107.61 1fwh n THR 26 Ca 0.47 -1.29 0.11 0.00 -2.27 0.00 0.00 64.05 61.06 1fwh n THR 26 Cb 1.40 -0.92 0.29 0.00 -2.10 0.00 0.00 70.33 68.99 1fwh n THR 26 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1fwh n GLU 27 N -2.37 2.52 -2.95 -0.78 -0.58 -1.26 -4.68 120.64 110.54 1fwh n GLU 27 Ca 0.13 -2.34 -0.40 0.00 -0.42 0.00 0.00 57.16 54.12 1fwh n GLU 27 Cb 0.47 -1.51 -0.04 0.00 -0.57 0.00 0.00 31.44 29.78 1fwh n GLU 27 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1fwh s LEU 28 N -1.09 4.31 -0.05 -4.62 1.43 -1.26 -5.01 118.68 112.39 1fwh s LEU 28 Ca 0.43 1.29 0.05 0.00 -1.03 0.00 0.00 54.13 54.88 1fwh s LEU 28 Cb 0.23 -3.22 -0.01 0.00 0.03 0.00 0.00 46.19 43.23 1fwh s LEU 28 CO 0.30 -0.19 -0.20 0.26 0.23 0.00 0.00 176.35 176.76 1fwh s TRP 29 N 1.04 1.97 0.11 0.29 0.52 -1.26 -1.28 118.94 120.32 1fwh s TRP 29 Ca 0.41 -0.56 0.07 0.00 0.02 0.00 0.00 56.10 56.03 1fwh s TRP 29 Cb -0.18 -1.31 -0.04 0.00 -1.15 0.00 0.00 33.47 30.79 1fwh s TRP 29 CO 0.20 -0.18 -0.07 0.96 0.02 0.00 0.00 176.95 177.88 1fwh s ILE 30 N -0.06 3.53 -0.07 2.03 -4.36 -0.27 -1.23 121.20 120.78 1fwh s ILE 30 Ca -0.03 -1.22 0.05 0.00 -0.26 0.00 0.00 60.65 59.18 1fwh s ILE 30 Cb -0.12 -2.67 -0.00 0.00 1.25 0.00 0.00 42.46 40.92 1fwh s ILE 30 CO 0.03 0.10 -0.21 -0.70 0.24 0.00 0.00 174.94 174.39 1fwh s GLU 31 N -2.28 2.41 -0.01 0.37 2.12 -1.26 -0.65 118.70 119.40 1fwh s GLU 31 Ca 0.23 -0.76 -0.30 0.00 0.36 0.00 0.00 54.97 54.49 1fwh s GLU 31 Cb -0.11 -1.96 -0.07 0.00 0.26 0.00 0.00 34.13 32.25 1fwh s GLU 31 CO 0.15 0.24 1.67 0.08 -0.54 0.00 0.00 175.26 176.86 1fwh s VAL 32 N 0.14 3.40 0.02 3.70 1.01 -0.73 -4.88 120.40 123.06 1fwh s VAL 32 Ca -0.10 0.61 0.10 0.00 0.00 0.00 0.00 61.98 62.60 1fwh s VAL 32 Cb -0.15 -3.39 -0.20 0.00 0.00 0.00 0.00 36.38 32.64 1fwh s VAL 32 CO 0.05 -0.04 1.00 -0.33 0.00 0.00 0.00 175.10 175.79 1fwh h GLU 33 N 9.20 0.00 -2.65 2.72 5.08 -1.51 -2.40 114.58 125.01 1fwh h GLU 33 Ca -0.41 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 57.92 1fwh h GLU 33 Cb 1.19 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.30 1fwh h GLU 33 CO 0.94 0.71 0.21 0.34 -1.00 0.00 0.00 179.01 180.21 1fwh s ASP 34 N -6.37 -0.59 -0.08 1.42 2.15 -1.25 -4.92 116.67 107.02 1fwh s ASP 34 Ca -0.01 0.24 -0.02 0.00 0.43 0.00 0.00 52.55 53.19 1fwh s ASP 34 Cb 0.09 0.57 0.03 0.00 -0.30 0.00 0.00 42.92 43.31 1fwh s ASP 34 CO 0.82 -0.84 0.01 -0.62 -0.17 0.00 0.00 175.17 174.36 1fwh s ASP 35 N -2.23 1.70 -0.01 -0.34 -1.08 -1.26 -1.11 116.67 112.34 1fwh s ASP 35 Ca -0.03 -0.15 0.04 0.00 -0.52 0.00 0.00 52.55 51.90 1fwh s ASP 35 Cb -0.01 -0.45 0.15 0.00 -1.46 0.00 0.00 42.92 41.15 1fwh s ASP 35 CO -0.05 -0.21 1.03 0.18 0.52 0.00 0.00 175.17 176.65 1fwh n LEU 36 N 5.14 1.12 -4.99 -1.34 4.32 -0.64 -4.92 117.00 115.70 1fwh n LEU 36 Ca -0.07 -0.56 -0.24 0.00 -0.02 0.00 0.00 56.01 55.12 1fwh n LEU 36 Cb 0.50 -0.21 0.11 0.00 -1.62 0.00 0.00 43.42 42.20 1fwh n LEU 36 CO 0.11 0.24 0.56 0.28 -1.22 0.00 0.00 177.39 177.36 1fwh s THR 37 N -1.69 2.15 -0.26 -5.08 -1.32 -1.26 -4.44 115.64 103.74 1fwh s THR 37 Ca 0.11 -0.55 0.02 0.00 -1.21 0.00 0.00 61.69 60.05 1fwh s THR 37 Cb 0.06 -2.60 0.07 0.00 -1.51 0.00 0.00 72.50 68.52 1fwh s THR 37 CO 0.06 0.00 -0.06 -0.89 -2.21 0.00 0.00 174.62 171.52 1fwh s THR 38 N -3.17 1.86 -0.23 5.08 2.01 -1.26 -5.07 115.64 114.85 1fwh s THR 38 Ca 0.66 -1.54 -0.37 0.00 0.31 0.00 0.00 61.69 60.75 1fwh s THR 38 Cb -0.06 -2.10 -0.13 0.00 0.01 0.00 0.00 72.50 70.22 1fwh s THR 38 CO 0.45 -0.15 1.91 -1.22 -0.69 0.00 0.00 174.62 174.91 1fwh n TYR 39 N 4.53 2.04 0.00 4.92 0.53 -1.26 -0.18 117.16 127.74 1fwh n TYR 39 Ca -0.10 0.28 0.00 0.00 -1.02 0.00 0.00 57.90 57.05 1fwh n TYR 39 Cb 0.43 -2.55 0.00 0.00 -1.03 0.00 0.00 39.34 36.19 1fwh n TYR 39 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1fwh n GLY 40 N 4.87 2.01 0.65 2.72 0.00 -1.26 -4.94 105.19 109.24 1fwh n GLY 40 Ca 0.29 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.38 1fwh n GLY 40 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1fwh n GLU 41 N -0.87 2.78 -1.84 1.61 -0.58 0.75 -5.02 120.64 117.46 1fwh n GLU 41 Ca 0.00 -2.39 -0.39 0.00 -0.42 0.00 0.00 57.16 53.95 1fwh n GLU 41 Cb 0.00 -1.52 0.02 0.00 -0.57 0.00 0.00 31.44 29.37 1fwh n GLU 41 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1fwh s GLU 42 N -1.95 3.63 -0.10 3.49 8.01 -1.25 -4.87 118.70 125.66 1fwh s GLU 42 Ca 0.30 2.33 -0.15 0.00 0.01 0.00 0.00 54.97 57.47 1fwh s GLU 42 Cb 0.22 -2.60 -0.05 0.00 -4.31 0.00 0.00 34.13 27.40 1fwh s GLU 42 CO 0.10 -0.83 0.37 0.14 0.01 0.00 0.00 175.26 175.05 1fwh s VAL 43 N -1.24 5.21 -0.01 2.63 -7.23 -1.26 -4.93 120.40 113.57 1fwh s VAL 43 Ca 0.62 0.72 0.01 0.00 -1.81 0.00 0.00 61.98 61.52 1fwh s VAL 43 Cb -0.42 -3.69 0.00 0.00 0.56 0.00 0.00 36.38 32.83 1fwh s VAL 43 CO 0.53 0.44 -0.03 -0.75 -0.31 0.00 0.00 175.10 174.98 1fwh s LYS 44 N -0.01 0.28 -0.08 4.82 2.20 -1.26 -4.73 119.74 120.95 1fwh s LYS 44 Ca 0.21 -0.09 -0.05 0.00 -0.36 0.00 0.00 55.97 55.69 1fwh s LYS 44 Cb -0.15 -0.30 -0.04 0.00 -1.51 0.00 0.00 37.83 35.84 1fwh s LYS 44 CO 0.08 0.04 0.13 0.12 -0.36 0.00 0.00 175.35 175.36 1fwh s PHE 45 N 0.11 3.52 -5.00 4.03 5.36 -1.26 -1.51 117.98 123.22 1fwh s PHE 45 Ca -0.01 0.42 0.00 0.00 -0.96 0.00 0.00 56.93 56.39 1fwh s PHE 45 Cb -0.03 -1.88 0.00 0.00 -0.34 0.00 0.00 43.02 40.77 1fwh s PHE 45 CO -0.00 0.67 0.00 0.41 -1.46 0.00 0.00 175.22 174.84 1fwh n GLY 46 N 1.65 0.03 3.63 13.12 0.00 -1.26 -4.92 105.19 117.45 1fwh n GLY 46 Ca -0.17 -1.78 -0.42 0.00 0.00 0.00 0.00 46.02 43.65 1fwh n GLY 46 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fwh s GLY 47 N 0.00 1.03 0.00 -0.02 0.00 -1.26 -1.35 107.32 105.72 1fwh s GLY 47 Ca 0.00 1.04 0.00 0.00 0.00 0.00 0.00 44.72 45.76 1fwh s GLY 47 CO 0.00 3.59 0.00 0.61 0.00 0.00 0.00 173.10 177.30 1fwh n GLY 48 N 5.07 0.43 0.00 0.20 0.00 -1.26 -5.00 105.19 104.63 1fwh n GLY 48 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1fwh n GLY 48 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fwh n LYS 49 N -1.81 1.00 0.08 1.61 4.76 -0.46 -5.04 118.16 118.31 1fwh n LYS 49 Ca 0.00 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.22 1fwh n LYS 49 Cb 0.12 0.00 -0.14 0.00 -1.84 0.00 0.00 35.03 33.17 1fwh n LYS 49 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1fwh h VAL 50 N -0.13 1.34 -0.40 -0.18 2.07 -1.56 -3.41 116.25 113.98 1fwh h VAL 50 Ca 0.00 -2.47 -0.63 0.00 0.82 0.00 0.00 66.70 64.42 1fwh h VAL 50 Cb 0.00 2.84 -0.04 0.00 -1.52 0.00 0.00 31.29 32.57 1fwh h VAL 50 CO 0.00 0.74 2.35 -0.38 0.02 0.00 0.00 177.57 180.30 1fwh n ILE 51 N -3.90 3.19 -4.04 4.57 5.41 -0.84 -0.27 119.36 123.49 1fwh n ILE 51 Ca -0.14 -3.09 -0.09 0.00 1.00 0.00 0.00 62.75 60.42 1fwh n ILE 51 Cb 0.94 -2.40 -0.11 0.00 -0.71 0.00 0.00 39.64 37.36 1fwh n ILE 51 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 1fwh s ARG 52 N 4.34 0.47 -0.26 0.38 0.52 -1.26 -4.79 118.95 118.34 1fwh s ARG 52 Ca 0.54 -0.85 -0.43 0.00 -0.52 0.00 0.00 55.73 54.47 1fwh s ARG 52 Cb 0.08 0.03 -0.19 0.00 0.52 0.00 0.00 34.95 35.40 1fwh s ARG 52 CO 0.04 -0.04 1.48 -3.47 0.02 0.00 0.00 175.30 173.32 1fwh n ASP 53 N 1.06 1.25 0.00 0.23 2.03 -1.26 -0.44 116.55 119.41 1fwh n ASP 53 Ca -0.20 1.15 0.00 0.00 0.52 0.00 0.00 54.79 56.26 1fwh n ASP 53 Cb 0.57 -0.99 0.00 0.00 -0.72 0.00 0.00 41.12 39.98 1fwh n ASP 53 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1fwh n GLY 54 N 3.29 2.84 0.00 0.27 0.00 -0.36 -4.88 105.19 106.35 1fwh n GLY 54 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.28 1fwh n GLY 54 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1fwh n MET 55 N -2.00 0.00 0.00 1.61 2.81 0.41 -4.84 117.12 115.11 1fwh n MET 55 Ca 0.00 0.00 0.10 0.00 -1.81 0.00 0.00 57.70 55.99 1fwh n MET 55 Cb 0.00 0.00 0.53 0.00 -0.71 0.00 0.00 33.22 33.04 1fwh n MET 55 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1fwh n GLY 56 N 5.00 -0.97 3.30 3.03 0.00 0.63 -4.42 105.19 111.77 1fwh n GLY 56 Ca 0.00 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.59 1fwh n GLY 56 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1fwh s GLN 57 N -2.56 3.28 0.00 1.61 0.74 -0.98 -3.04 119.66 118.72 1fwh s GLN 57 Ca 0.20 -0.72 0.00 0.00 0.05 0.00 0.00 55.36 54.89 1fwh s GLN 57 Cb 0.14 -2.65 0.00 0.00 1.10 0.00 0.00 33.01 31.60 1fwh s GLN 57 CO 0.32 0.07 0.00 0.41 -0.55 0.00 0.00 175.29 175.54 1fwh n GLY 58 N 3.92 0.34 0.89 2.59 0.00 0.46 -1.22 105.19 112.16 1fwh n GLY 58 Ca -0.19 -1.89 0.08 0.00 0.00 0.00 0.00 46.02 44.02 1fwh n GLY 58 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1fwh n GLN 59 N -1.00 2.84 -1.61 1.61 1.13 -1.26 -4.27 117.38 114.83 1fwh n GLN 59 Ca 0.00 -2.27 -0.32 0.00 -1.94 0.00 0.00 57.00 52.46 1fwh n GLN 59 Cb 0.00 -1.38 0.06 0.00 0.11 0.00 0.00 30.24 29.03 1fwh n GLN 59 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1fwh s MET 60 N -1.03 2.64 0.79 -1.09 0.23 -1.26 -5.01 119.30 114.57 1fwh s MET 60 Ca 0.32 1.32 -0.12 0.00 -1.03 0.00 0.00 55.69 56.18 1fwh s MET 60 Cb 0.17 -1.94 0.06 0.00 -1.53 0.00 0.00 34.83 31.60 1fwh s MET 60 CO 0.22 -1.36 1.10 -0.51 -2.03 0.00 0.00 175.02 172.44 1fwh s LEU 61 N -5.19 2.62 0.44 0.18 1.43 -1.26 -4.50 118.68 112.40 1fwh s LEU 61 Ca 0.65 1.21 0.22 0.00 -1.03 0.00 0.00 54.13 55.18 1fwh s LEU 61 Cb -0.19 -3.83 1.21 0.00 0.03 0.00 0.00 46.19 43.40 1fwh s LEU 61 CO 0.46 -1.86 1.82 0.00 0.23 0.00 0.00 176.35 177.00 1fwh h ALA 62 N -1.02 2.42 0.00 4.21 0.00 -1.96 0.53 119.26 123.44 1fwh h ALA 62 Ca -0.47 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 1fwh h ALA 62 Cb 1.27 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 1fwh h ALA 62 CO 0.61 -0.75 -0.10 0.00 0.00 0.00 0.00 179.25 179.01 1fwh h ALA 63 N 1.58 1.02 -0.49 0.00 0.00 -1.99 -2.95 119.26 116.43 1fwh h ALA 63 Ca 0.52 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1fwh h ALA 63 Cb 1.51 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.28 1fwh h ALA 63 CO -0.18 0.12 0.00 -0.25 0.00 0.00 0.00 179.25 178.94 1fwh n ASP 64 N -3.24 4.35 -3.91 0.00 8.00 0.17 -4.96 116.55 116.97 1fwh n ASP 64 Ca 0.00 -2.56 -0.08 0.00 0.71 0.00 0.00 54.79 52.86 1fwh n ASP 64 Cb 0.36 -0.52 -0.08 0.00 -0.02 0.00 0.00 41.12 40.86 1fwh n ASP 64 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1fwh s VAL 66 N -3.81 4.20 0.04 0.00 -7.23 -0.98 -4.90 120.40 107.72 1fwh s VAL 66 Ca 0.05 0.73 0.02 0.00 -1.81 0.00 0.00 61.98 60.97 1fwh s VAL 66 Cb 0.05 -3.52 -0.25 0.00 0.56 0.00 0.00 36.38 33.22 1fwh s VAL 66 CO -0.10 -0.92 0.99 0.44 -0.31 0.00 0.00 175.10 175.19 1fwh h ASP 67 N -0.56 0.23 -4.18 4.85 3.32 -1.29 -3.33 116.42 115.45 1fwh h ASP 67 Ca -0.44 -0.30 -0.19 0.00 0.02 0.00 0.00 57.03 56.13 1fwh h ASP 67 Cb 1.21 -0.07 -0.25 0.00 0.22 0.00 0.00 39.33 40.43 1fwh h ASP 67 CO 0.58 1.24 -0.59 -0.22 -1.72 0.00 0.00 179.24 178.53 1fwh s LEU 68 N -6.79 1.68 -0.05 1.55 2.96 -0.83 -0.13 118.68 117.07 1fwh s LEU 68 Ca -0.05 0.03 0.02 0.00 -0.22 0.00 0.00 54.13 53.90 1fwh s LEU 68 Cb 0.08 0.39 0.02 0.00 0.50 0.00 0.00 46.19 47.17 1fwh s LEU 68 CO 0.84 -0.14 -0.07 0.54 -1.32 0.00 0.00 176.35 176.20 1fwh s VAL 69 N -0.45 0.74 -0.39 1.68 0.11 -0.60 -0.82 120.40 120.68 1fwh s VAL 69 Ca -0.05 -0.25 -0.13 0.00 -2.93 0.00 0.00 61.98 58.62 1fwh s VAL 69 Cb -0.03 -0.72 0.02 0.00 -1.53 0.00 0.00 36.38 34.12 1fwh s VAL 69 CO 0.00 0.27 0.26 -0.76 -3.33 0.00 0.00 175.10 171.54 1fwh s LEU 70 N 0.80 4.92 0.10 2.54 1.02 0.32 -1.53 118.68 126.85 1fwh s LEU 70 Ca -0.13 -0.94 -0.24 0.00 0.02 0.00 0.00 54.13 52.84 1fwh s LEU 70 Cb -0.15 -2.10 -0.07 0.00 0.02 0.00 0.00 46.19 43.90 1fwh s LEU 70 CO 0.02 -0.42 0.72 0.42 0.02 0.00 0.00 176.35 177.10 1fwh s THR 71 N 1.62 4.59 -1.36 5.49 -4.23 -0.53 -1.13 115.64 120.09 1fwh s THR 71 Ca 0.04 1.55 -0.01 0.00 -1.18 0.00 0.00 61.69 62.09 1fwh s THR 71 Cb -0.19 -4.07 -0.00 0.00 1.34 0.00 0.00 72.50 69.58 1fwh s THR 71 CO 0.08 0.48 0.54 0.59 -0.54 0.00 0.00 174.62 175.77 1fwh n ASN 72 N 2.05 -0.77 -4.83 3.99 3.02 -1.24 -0.87 115.26 116.61 1fwh n ASN 72 Ca -0.06 -0.93 -0.36 0.00 -0.03 0.00 0.00 54.58 53.20 1fwh n ASN 72 Cb 0.50 -3.47 -0.06 0.00 -0.61 0.00 0.00 39.78 36.14 1fwh n ASN 72 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1fwh s ALA 73 N -3.83 3.51 -0.50 5.41 0.00 0.37 -3.06 121.76 123.65 1fwh s ALA 73 Ca 0.01 0.01 -0.15 0.00 0.00 0.00 0.00 51.96 51.83 1fwh s ALA 73 Cb -0.00 -2.66 0.11 0.00 0.00 0.00 0.00 23.12 20.56 1fwh s ALA 73 CO 0.86 0.40 0.44 -1.17 0.00 0.00 0.00 175.76 176.28 1fwh s LEU 74 N -1.92 5.90 0.11 0.00 2.96 -1.00 -1.04 118.68 123.69 1fwh s LEU 74 Ca 0.40 -1.64 -0.30 0.00 -0.22 0.00 0.00 54.13 52.37 1fwh s LEU 74 Cb -0.16 -2.17 -0.06 0.00 0.50 0.00 0.00 46.19 44.30 1fwh s LEU 74 CO 0.20 -0.76 0.98 -0.63 -1.32 0.00 0.00 176.35 174.82 1fwh s ILE 75 N 1.58 4.45 -0.26 6.68 1.01 0.15 -1.33 121.20 133.47 1fwh s ILE 75 Ca 0.04 2.03 0.01 0.00 0.00 0.00 0.00 60.65 62.72 1fwh s ILE 75 Cb -0.27 -4.29 0.07 0.00 0.01 0.00 0.00 42.46 37.98 1fwh s ILE 75 CO 0.04 0.31 -0.00 -0.69 0.00 0.00 0.00 174.94 174.59 1fwh s VAL 76 N 0.01 1.43 0.25 2.92 1.01 -0.93 -1.84 120.40 123.25 1fwh s VAL 76 Ca 0.47 -1.36 -0.02 0.00 0.00 0.00 0.00 61.98 61.08 1fwh s VAL 76 Cb -0.24 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.28 1fwh s VAL 76 CO 0.30 -0.29 0.27 -0.62 0.00 0.00 0.00 175.10 174.76 1fwh s ASP 77 N 1.41 0.46 0.59 3.32 2.15 -0.64 -4.57 116.67 119.39 1fwh s ASP 77 Ca -0.00 -1.38 0.30 0.00 0.43 0.00 0.00 52.55 51.90 1fwh s ASP 77 Cb -0.18 0.49 1.83 0.00 -0.30 0.00 0.00 42.92 44.75 1fwh s ASP 77 CO -0.10 -0.99 2.24 1.12 -0.17 0.00 0.00 175.17 177.27 1fwh h HIS 78 N 2.40 0.00 0.00 -5.34 2.07 -1.94 -2.55 115.15 109.79 1fwh h HIS 78 Ca -0.31 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.21 1fwh h HIS 78 Cb 1.25 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.23 1fwh h HIS 78 CO 0.74 0.00 -0.73 -2.67 -3.07 0.00 0.00 177.93 172.19 1fwh n TRP 79 N -3.81 0.08 0.00 6.12 4.27 -1.26 -4.93 117.44 117.91 1fwh n TRP 79 Ca -0.02 0.02 0.00 0.00 -3.89 0.00 0.00 57.50 53.61 1fwh n TRP 79 Cb 0.11 -0.25 0.00 0.00 -1.36 0.00 0.00 31.31 29.81 1fwh n TRP 79 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1fwh n GLY 80 N 1.46 1.47 2.84 -1.67 0.00 -0.96 -5.06 105.19 103.27 1fwh n GLY 80 Ca 0.04 -0.92 -0.30 0.00 0.00 0.00 0.00 46.02 44.85 1fwh n GLY 80 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fwh s ILE 81 N -2.00 1.87 0.12 -0.61 1.01 -1.25 -1.63 121.20 118.71 1fwh s ILE 81 Ca 0.00 -2.66 0.05 0.00 0.00 0.00 0.00 60.65 58.04 1fwh s ILE 81 Cb 0.00 -2.32 -0.04 0.00 0.01 0.00 0.00 42.46 40.11 1fwh s ILE 81 CO 0.00 -0.80 -0.12 0.68 0.00 0.00 0.00 174.94 174.70 1fwh s VAL 82 N 0.35 1.18 -0.17 2.92 -7.23 -0.77 -1.19 120.40 115.49 1fwh s VAL 82 Ca 0.16 -1.74 -0.13 0.00 -1.81 0.00 0.00 61.98 58.45 1fwh s VAL 82 Cb -0.23 -1.52 -0.05 0.00 0.56 0.00 0.00 36.38 35.14 1fwh s VAL 82 CO -0.04 -0.51 0.26 -0.75 -0.31 0.00 0.00 175.10 173.75 1fwh s LYS 83 N -2.87 4.24 0.08 4.82 2.47 -0.27 0.33 119.74 128.56 1fwh s LYS 83 Ca 0.09 0.03 -0.27 0.00 -1.56 0.00 0.00 55.97 54.26 1fwh s LYS 83 Cb -0.03 -3.42 0.09 0.00 -1.46 0.00 0.00 37.83 33.00 1fwh s LYS 83 CO 0.02 0.25 1.13 0.00 0.16 0.00 0.00 175.35 176.90 1fwh s ALA 84 N 0.45 -1.93 0.02 3.13 0.00 -0.20 -1.61 121.76 121.61 1fwh s ALA 84 Ca 0.15 0.22 -0.04 0.00 0.00 0.00 0.00 51.96 52.29 1fwh s ALA 84 Cb -0.13 0.59 -0.04 0.00 0.00 0.00 0.00 23.12 23.54 1fwh s ALA 84 CO 0.03 -1.06 0.24 -0.51 0.00 0.00 0.00 175.76 174.45 1fwh s ASP 85 N -3.14 6.42 -0.14 0.00 1.01 -0.48 -0.48 116.67 119.87 1fwh s ASP 85 Ca 0.17 0.44 0.02 0.00 0.71 0.00 0.00 52.55 53.89 1fwh s ASP 85 Cb 0.01 -2.04 0.01 0.00 1.01 0.00 0.00 42.92 41.91 1fwh s ASP 85 CO 0.00 0.22 -0.22 -0.63 0.21 0.00 0.00 175.17 174.76 1fwh s ILE 86 N -1.38 2.10 -0.14 0.77 1.01 -0.28 -1.27 121.20 122.01 1fwh s ILE 86 Ca 0.30 -0.96 -0.05 0.00 0.00 0.00 0.00 60.65 59.93 1fwh s ILE 86 Cb -0.13 -1.84 -0.04 0.00 0.01 0.00 0.00 42.46 40.46 1fwh s ILE 86 CO 0.20 0.55 0.06 -0.83 0.00 0.00 0.00 174.94 174.91 1fwh s GLY 87 N 0.81 1.95 -0.08 6.18 0.00 -0.07 -0.52 107.32 115.59 1fwh s GLY 87 Ca -0.07 -0.74 0.04 0.00 0.00 0.00 0.00 44.72 43.95 1fwh s GLY 87 CO -0.02 -0.25 -0.20 0.14 0.00 0.00 0.00 173.10 172.77 1fwh s VAL 88 N -0.38 1.75 -0.05 1.40 1.01 0.00 -0.42 120.40 123.73 1fwh s VAL 88 Ca 0.09 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.20 1fwh s VAL 88 Cb -0.12 -1.53 0.03 0.00 0.00 0.00 0.00 36.38 34.76 1fwh s VAL 88 CO 0.02 0.49 0.10 -0.75 0.00 0.00 0.00 175.10 174.96 1fwh s LYS 89 N 0.37 0.06 -1.68 2.72 2.20 -0.32 -0.99 119.74 122.09 1fwh s LYS 89 Ca -0.16 0.27 -0.02 0.00 -0.36 0.00 0.00 55.97 55.70 1fwh s LYS 89 Cb -0.17 -0.15 0.00 0.00 -1.51 0.00 0.00 37.83 36.01 1fwh s LYS 89 CO 0.07 -0.13 0.20 -0.25 -0.36 0.00 0.00 175.35 174.88 1fwh n ASP 90 N 3.94 -5.90 0.00 1.43 8.00 -1.26 -1.72 116.55 121.04 1fwh n ASP 90 Ca -0.24 -0.10 0.00 0.00 0.71 0.00 0.00 54.79 55.16 1fwh n ASP 90 Cb 0.53 -4.86 0.00 0.00 -0.02 0.00 0.00 41.12 36.77 1fwh n ASP 90 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fwh n GLY 91 N -1.18 0.69 3.38 0.44 0.00 -1.26 -5.02 105.19 102.25 1fwh n GLY 91 Ca -0.20 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.62 1fwh n GLY 91 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fwh s ARG 92 N -0.12 1.43 -0.21 1.61 0.52 -0.70 -0.56 118.95 120.91 1fwh s ARG 92 Ca 0.00 -1.65 -0.29 0.00 -0.52 0.00 0.00 55.73 53.27 1fwh s ARG 92 Cb 0.00 -1.27 -0.02 0.00 0.52 0.00 0.00 34.95 34.18 1fwh s ARG 92 CO 0.00 0.20 1.55 0.42 0.02 0.00 0.00 175.30 177.49 1fwh s ILE 93 N -2.88 3.79 -0.18 1.52 1.01 0.01 -1.18 121.20 123.30 1fwh s ILE 93 Ca 0.25 0.90 -0.23 0.00 0.00 0.00 0.00 60.65 61.57 1fwh s ILE 93 Cb -0.01 -3.77 -0.20 0.00 0.01 0.00 0.00 42.46 38.49 1fwh s ILE 93 CO 0.09 -0.29 0.39 0.15 0.00 0.00 0.00 174.94 175.28 1fwh h PHE 94 N 10.25 0.00 -2.62 3.97 3.57 -1.04 0.13 116.94 131.20 1fwh h PHE 94 Ca -0.32 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.20 1fwh h PHE 94 Cb 1.14 0.00 -0.14 0.00 2.79 0.00 0.00 35.95 39.74 1fwh h PHE 94 CO 0.90 1.18 0.32 0.00 -2.23 0.00 0.00 178.31 178.48 1fwh s ALA 95 N -2.34 -1.70 -0.22 2.41 0.00 -1.13 -4.77 121.76 114.00 1fwh s ALA 95 Ca -0.23 0.78 0.01 0.00 0.00 0.00 0.00 51.96 52.51 1fwh s ALA 95 Cb 0.02 0.60 0.05 0.00 0.00 0.00 0.00 23.12 23.80 1fwh s ALA 95 CO 0.59 -0.70 -0.09 0.42 0.00 0.00 0.00 175.76 175.98 1fwh s ILE 96 N -3.25 1.70 0.00 0.00 1.01 -1.26 -0.89 121.20 118.51 1fwh s ILE 96 Ca 0.01 -1.21 0.00 0.00 0.00 0.00 0.00 60.65 59.45 1fwh s ILE 96 Cb -0.01 -1.86 0.00 0.00 0.01 0.00 0.00 42.46 40.60 1fwh s ILE 96 CO -0.09 0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.49 1fwh n GLY 97 N 4.63 0.84 3.15 6.18 0.00 -0.40 -4.96 105.19 114.62 1fwh n GLY 97 Ca -0.14 0.29 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 1fwh n GLY 97 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1fwh s LYS 98 N 3.98 2.94 0.33 1.61 2.36 -1.26 -1.38 119.74 128.33 1fwh s LYS 98 Ca 0.00 -0.88 -0.04 0.00 -2.55 0.00 0.00 55.97 52.50 1fwh s LYS 98 Cb 0.00 -2.72 -0.05 0.00 -1.05 0.00 0.00 37.83 34.01 1fwh s LYS 98 CO 0.00 -0.27 0.59 0.00 1.55 0.00 0.00 175.35 177.21 1fwh s ALA 99 N 1.30 3.61 0.00 3.13 0.00 -1.26 -0.12 121.76 128.42 1fwh s ALA 99 Ca 0.03 -0.63 0.00 0.00 0.00 0.00 0.00 51.96 51.36 1fwh s ALA 99 Cb -0.14 -2.30 0.00 0.00 0.00 0.00 0.00 23.12 20.68 1fwh s ALA 99 CO -0.10 0.09 0.00 0.41 0.00 0.00 0.00 175.76 176.17 1fwh n GLY 100 N -1.33 0.20 3.13 0.00 0.00 -0.56 -4.68 105.19 101.95 1fwh n GLY 100 Ca -0.02 -1.37 -0.33 0.00 0.00 0.00 0.00 46.02 44.30 1fwh n GLY 100 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1fwh s ASN 101 N -4.00 4.06 0.55 1.61 2.47 -1.17 -1.47 114.94 116.99 1fwh s ASN 101 Ca 0.00 -1.01 0.36 0.00 0.42 0.00 0.00 52.86 52.63 1fwh s ASN 101 Cb 0.00 -1.58 1.97 0.00 -1.45 0.00 0.00 41.25 40.19 1fwh s ASN 101 CO 0.00 -0.12 2.11 -0.65 -3.72 0.00 0.00 177.10 174.72 1fwh h PRO 102 N 7.91 0.00 -0.15 0.43 0.11 -1.92 -0.40 132.00 137.97 1fwh h PRO 102 Ca -0.31 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.73 1fwh h PRO 102 Cb 1.09 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1fwh h PRO 102 CO 0.55 0.00 -0.22 -0.44 -0.21 0.00 0.00 178.00 177.68 1fwh h ASP 103 N 0.00 0.26 0.00 -2.05 3.32 -1.94 -3.36 116.42 112.64 1fwh h ASP 103 Ca 0.00 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1fwh h ASP 103 Cb 0.04 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.52 1fwh h ASP 103 CO 0.00 0.50 -0.06 2.30 -1.72 0.00 0.00 179.24 180.26 1fwh n ILE 104 N -4.18 0.00 -4.22 0.35 -5.35 -1.02 -5.08 119.36 99.85 1fwh n ILE 104 Ca -0.01 -0.18 -0.28 0.00 -0.27 0.00 0.00 62.75 62.01 1fwh n ILE 104 Cb 0.35 0.88 -0.09 0.00 -1.74 0.00 0.00 39.64 39.04 1fwh n ILE 104 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1fwh s GLN 105 N -0.48 2.26 0.37 6.28 -0.21 -0.19 -5.08 119.66 122.61 1fwh s GLN 105 Ca 0.00 -1.08 0.00 0.00 0.02 0.00 0.00 55.36 54.30 1fwh s GLN 105 Cb 0.00 -2.32 -0.03 0.00 1.00 0.00 0.00 33.01 31.66 1fwh s GLN 105 CO 0.00 0.48 0.58 -1.25 -2.12 0.00 0.00 175.29 172.97 1fwh s PRO 106 N -2.62 3.41 -1.06 2.91 0.04 -1.26 -4.43 135.00 131.99 1fwh s PRO 106 Ca 0.25 -0.36 0.00 0.00 0.04 0.00 0.00 61.00 60.93 1fwh s PRO 106 Cb -0.10 -2.64 0.00 0.00 0.04 0.00 0.00 34.50 31.80 1fwh s PRO 106 CO 0.16 0.06 0.00 0.09 0.04 0.00 0.00 177.00 177.35 1fwh n ASN 107 N -1.85 -3.78 -4.68 6.66 4.13 -1.26 -4.92 115.26 109.56 1fwh n ASN 107 Ca -0.03 0.21 -0.43 0.00 1.68 0.00 0.00 54.58 56.01 1fwh n ASN 107 Cb 0.56 -3.25 -0.02 0.00 -1.54 0.00 0.00 39.78 35.53 1fwh n ASN 107 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1fwh s VAL 108 N -2.54 4.34 -0.11 2.41 1.01 -1.26 -4.52 120.40 119.72 1fwh s VAL 108 Ca 0.00 1.64 0.03 0.00 0.00 0.00 0.00 61.98 63.65 1fwh s VAL 108 Cb 0.00 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.29 1fwh s VAL 108 CO 0.00 -0.06 0.11 0.35 0.00 0.00 0.00 175.10 175.50 1fwh n THR 109 N 4.89 0.00 -3.79 3.92 -2.24 0.84 -4.88 114.28 113.02 1fwh n THR 109 Ca 0.12 -0.37 -0.30 0.00 -2.27 0.00 0.00 64.05 61.23 1fwh n THR 109 Cb 0.46 0.90 -0.14 0.00 -2.10 0.00 0.00 70.33 69.45 1fwh n THR 109 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1fwh s ILE 110 N -1.44 1.71 0.12 2.28 1.01 -0.52 -4.90 121.20 119.46 1fwh s ILE 110 Ca 0.01 -2.65 -0.31 0.00 0.00 0.00 0.00 60.65 57.70 1fwh s ILE 110 Cb 0.02 -2.21 -0.09 0.00 0.01 0.00 0.00 42.46 40.20 1fwh s ILE 110 CO 0.12 -0.84 1.52 -2.16 0.00 0.00 0.00 174.94 173.58 1fwh s PRO 111 N 0.32 4.25 -0.19 2.79 0.04 -1.26 -1.50 135.00 139.45 1fwh s PRO 111 Ca 0.16 2.24 -0.07 0.00 0.04 0.00 0.00 61.00 63.38 1fwh s PRO 111 Cb -0.24 -3.31 -0.04 0.00 0.04 0.00 0.00 34.50 30.95 1fwh s PRO 111 CO -0.02 -0.58 0.04 0.42 0.04 0.00 0.00 177.00 176.90 1fwh s ILE 112 N 1.57 4.52 0.15 0.56 1.01 -0.54 -2.32 121.20 126.15 1fwh s ILE 112 Ca 0.69 -0.13 0.02 0.00 0.00 0.00 0.00 60.65 61.24 1fwh s ILE 112 Cb -0.40 -3.04 -0.01 0.00 0.01 0.00 0.00 42.46 39.02 1fwh s ILE 112 CO 0.31 0.45 0.08 0.61 0.00 0.00 0.00 174.94 176.39 1fwh n GLY 113 N 3.74 3.67 0.43 6.18 0.00 -1.26 -0.41 105.19 117.54 1fwh n GLY 113 Ca -0.17 -1.88 0.23 0.00 0.00 0.00 0.00 46.02 44.21 1fwh n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fwh h ALA 114 N 1.35 2.53 -0.22 4.61 0.00 -1.79 -0.24 119.26 125.50 1fwh h ALA 114 Ca -0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1fwh h ALA 114 Cb 0.48 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1fwh h ALA 114 CO 0.17 -0.78 0.00 0.00 0.00 0.00 0.00 179.25 178.64 1fwh n ALA 115 N -2.62 2.53 -2.67 0.00 0.00 -1.26 -4.88 120.51 111.60 1fwh n ALA 115 Ca 0.17 -0.42 -0.36 0.00 0.00 0.00 0.00 53.44 52.83 1fwh n ALA 115 Cb 0.80 -0.99 -0.09 0.00 0.00 0.00 0.00 19.45 19.16 1fwh n ALA 115 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1fwh s THR 116 N -1.68 5.37 0.24 0.00 2.01 -0.10 -4.49 115.64 117.00 1fwh s THR 116 Ca 0.15 0.18 -0.06 0.00 0.31 0.00 0.00 61.69 62.28 1fwh s THR 116 Cb 0.08 -3.50 -0.06 0.00 0.01 0.00 0.00 72.50 69.04 1fwh s THR 116 CO 0.09 0.36 0.51 -0.70 -0.69 0.00 0.00 174.62 174.20 1fwh s GLU 117 N 0.93 3.67 -0.05 4.92 2.56 0.82 -4.90 118.70 126.64 1fwh s GLU 117 Ca 0.08 0.04 0.05 0.00 0.00 0.00 0.00 54.97 55.14 1fwh s GLU 117 Cb -0.13 -2.69 -0.01 0.00 2.00 0.00 0.00 34.13 33.30 1fwh s GLU 117 CO 0.03 0.29 -0.21 0.08 -0.56 0.00 0.00 175.26 174.89 1fwh s VAL 118 N -1.93 1.77 -0.17 3.70 1.01 -1.26 -1.56 120.40 121.95 1fwh s VAL 118 Ca 0.44 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.52 1fwh s VAL 118 Cb -0.11 -1.50 0.02 0.00 0.00 0.00 0.00 36.38 34.79 1fwh s VAL 118 CO 0.27 0.50 -0.17 -0.63 0.00 0.00 0.00 175.10 175.06 1fwh s ILE 119 N -0.08 1.88 -0.58 2.22 1.01 -0.58 -4.97 121.20 120.10 1fwh s ILE 119 Ca -0.03 -0.88 -0.26 0.00 0.00 0.00 0.00 60.65 59.47 1fwh s ILE 119 Cb -0.13 -1.74 0.03 0.00 0.01 0.00 0.00 42.46 40.63 1fwh s ILE 119 CO 0.03 0.46 1.10 0.00 0.00 0.00 0.00 174.94 176.53 1fwh s ALA 120 N 1.35 3.05 -1.51 9.38 0.00 -1.26 -1.45 121.76 131.32 1fwh s ALA 120 Ca 0.04 -1.02 0.19 0.00 0.00 0.00 0.00 51.96 51.17 1fwh s ALA 120 Cb -0.13 -3.93 0.61 0.00 0.00 0.00 0.00 23.12 19.67 1fwh s ALA 120 CO -0.12 -2.58 1.52 0.00 0.00 0.00 0.00 175.76 174.58 1fwh n ALA 121 N 8.09 2.56 -1.95 0.00 0.00 -0.05 -4.91 120.51 124.25 1fwh n ALA 121 Ca 0.05 -1.39 -0.42 0.00 0.00 0.00 0.00 53.44 51.68 1fwh n ALA 121 Cb 0.48 -0.86 -0.03 0.00 0.00 0.00 0.00 19.45 19.04 1fwh n ALA 121 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1fwh s GLU 122 N -1.29 4.20 0.00 0.00 1.03 -0.98 -1.11 118.70 120.54 1fwh s GLU 122 Ca 0.45 2.29 0.00 0.00 0.03 0.00 0.00 54.97 57.74 1fwh s GLU 122 Cb 0.26 -3.69 0.00 0.00 -0.80 0.00 0.00 34.13 29.90 1fwh s GLU 122 CO 0.27 -0.75 0.00 0.41 -1.33 0.00 0.00 175.26 173.86 1fwh n GLY 123 N 4.02 0.68 3.58 -3.83 0.00 -1.26 -4.77 105.19 103.61 1fwh n GLY 123 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 1fwh n GLY 123 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fwh s LYS 124 N -0.66 2.08 -0.12 1.61 -0.14 -0.27 -4.38 119.74 117.87 1fwh s LYS 124 Ca 0.00 -1.50 -0.02 0.00 -1.36 0.00 0.00 55.97 53.09 1fwh s LYS 124 Cb 0.00 -2.05 -0.03 0.00 -1.68 0.00 0.00 37.83 34.08 1fwh s LYS 124 CO 0.00 0.36 -0.03 0.42 -0.76 0.00 0.00 175.35 175.34 1fwh s ILE 125 N -2.29 3.95 -0.07 2.17 1.01 0.50 -2.38 121.20 124.09 1fwh s ILE 125 Ca 0.30 -0.36 0.04 0.00 0.00 0.00 0.00 60.65 60.63 1fwh s ILE 125 Cb -0.06 -2.69 -0.02 0.00 0.01 0.00 0.00 42.46 39.70 1fwh s ILE 125 CO 0.18 0.54 -0.19 -0.69 0.00 0.00 0.00 174.94 174.78 1fwh s VAL 126 N -0.17 2.60 0.13 2.92 1.01 -0.45 0.20 120.40 126.64 1fwh s VAL 126 Ca 0.03 -0.86 0.01 0.00 0.00 0.00 0.00 61.98 61.16 1fwh s VAL 126 Cb -0.13 -2.01 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 1fwh s VAL 126 CO 0.02 0.57 -0.00 0.42 0.00 0.00 0.00 175.10 176.11 1fwh s THR 127 N -0.21 0.47 0.91 3.92 -4.23 -0.21 -2.20 115.64 114.09 1fwh s THR 127 Ca -0.01 -1.93 -0.11 0.00 -1.18 0.00 0.00 61.69 58.45 1fwh s THR 127 Cb -0.13 -1.94 0.13 0.00 1.34 0.00 0.00 72.50 71.90 1fwh s THR 127 CO 0.03 -0.62 1.09 0.00 -0.54 0.00 0.00 174.62 174.59 1fwh s ALA 128 N -3.79 1.46 0.37 3.99 0.00 -1.26 -0.69 121.76 121.84 1fwh s ALA 128 Ca 0.20 -0.03 -0.25 0.00 0.00 0.00 0.00 51.96 51.88 1fwh s ALA 128 Cb 0.07 -3.21 -0.09 0.00 0.00 0.00 0.00 23.12 19.88 1fwh s ALA 128 CO -0.00 -2.43 1.01 0.20 0.00 0.00 0.00 175.76 174.54 1fwh s GLY 129 N -3.34 2.76 0.71 0.00 0.00 -0.50 -4.50 107.32 102.45 1fwh s GLY 129 Ca 0.64 0.63 -0.12 0.00 0.00 0.00 0.00 44.72 45.87 1fwh s GLY 129 CO 0.57 1.07 1.09 -0.32 0.00 0.00 0.00 173.10 175.51 1fwh s GLY 130 N -1.58 1.84 -0.20 0.20 0.00 0.24 -4.66 107.32 103.17 1fwh s GLY 130 Ca 0.54 0.33 -0.01 0.00 0.00 0.00 0.00 44.72 45.58 1fwh s GLY 130 CO 0.26 0.66 -0.02 -0.42 0.00 0.00 0.00 173.10 173.59 1fwh s ILE 131 N -2.73 1.01 -0.29 0.90 1.01 0.64 -0.82 121.20 120.92 1fwh s ILE 131 Ca 0.62 -0.80 -0.11 0.00 0.00 0.00 0.00 60.65 60.37 1fwh s ILE 131 Cb -0.17 -1.35 -0.04 0.00 0.01 0.00 0.00 42.46 40.91 1fwh s ILE 131 CO 0.50 -0.08 0.18 -0.62 0.00 0.00 0.00 174.94 174.91 1fwh s ASP 132 N 1.64 5.83 -0.13 3.58 -1.08 -0.82 -4.72 116.67 120.97 1fwh s ASP 132 Ca -0.02 -0.18 0.16 0.00 -0.52 0.00 0.00 52.55 51.99 1fwh s ASP 132 Cb -0.17 -2.08 0.62 0.00 -1.46 0.00 0.00 42.92 39.83 1fwh s ASP 132 CO -0.07 -0.10 1.54 0.35 0.52 0.00 0.00 175.17 177.41 1fwh n THR 133 N 5.04 1.99 -3.11 1.71 -2.24 -1.26 -0.80 114.28 115.61 1fwh n THR 133 Ca -0.14 -1.39 -0.22 0.00 -2.27 0.00 0.00 64.05 60.03 1fwh n THR 133 Cb 0.51 0.01 -0.04 0.00 -2.10 0.00 0.00 70.33 68.72 1fwh n THR 133 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1fwh n HIS 134 N 0.50 1.61 -3.73 4.78 -0.00 -1.14 -4.65 115.22 112.59 1fwh n HIS 134 Ca 0.23 -3.88 -0.36 0.00 -0.00 0.00 0.00 57.72 53.71 1fwh n HIS 134 Cb 0.87 -0.44 -0.07 0.00 -0.00 0.00 0.00 29.99 30.35 1fwh n HIS 134 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 1fwh s ILE 135 N -3.06 5.40 -0.34 3.57 -1.09 -0.68 -1.84 121.20 123.16 1fwh s ILE 135 Ca 0.43 0.31 -0.10 0.00 -2.23 0.00 0.00 60.65 59.06 1fwh s ILE 135 Cb 0.31 -3.49 0.01 0.00 -1.58 0.00 0.00 42.46 37.71 1fwh s ILE 135 CO -0.10 0.50 0.17 -1.00 -1.23 0.00 0.00 174.94 173.28 1fwh s HIS 136 N -0.20 3.21 -1.20 3.97 3.76 -1.26 -1.62 115.29 121.96 1fwh s HIS 136 Ca 0.13 -0.85 -0.18 0.00 -0.15 0.00 0.00 55.06 54.01 1fwh s HIS 136 Cb -0.12 -2.38 -0.03 0.00 1.11 0.00 0.00 32.58 31.16 1fwh s HIS 136 CO 0.02 -0.58 2.01 0.91 -0.85 0.00 0.00 174.74 176.25 1fwh n TRP 137 N 4.97 3.17 0.10 1.40 7.02 -0.67 -4.54 117.44 128.89 1fwh n TRP 137 Ca -0.13 -2.42 -0.17 0.00 -1.02 0.00 0.00 57.50 53.76 1fwh n TRP 137 Cb 0.47 -2.34 -0.14 0.00 -2.42 0.00 0.00 31.31 26.88 1fwh n TRP 137 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 1fwh h ILE 138 N 4.71 1.37 -2.49 -0.99 2.04 -1.88 -1.20 117.51 119.08 1fwh h ILE 138 Ca 0.46 -2.95 -0.09 0.00 1.00 0.00 0.00 64.86 63.28 1fwh h ILE 138 Cb 0.73 2.90 -0.20 0.00 -0.74 0.00 0.00 36.82 39.51 1fwh h ILE 138 CO 1.75 0.86 -0.03 0.00 0.00 0.00 0.00 178.15 180.72 1fwh h PRO 140 N 3.54 0.00 -0.03 0.00 0.13 -1.98 -3.01 132.00 130.65 1fwh h PRO 140 Ca -0.28 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.86 1fwh h PRO 140 Cb 1.16 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 1fwh h PRO 140 CO 0.38 0.09 0.08 1.96 -0.23 0.00 0.00 178.00 180.27 1fwh h GLN 141 N 0.00 0.00 -0.15 0.86 7.50 -2.03 -1.97 115.11 119.33 1fwh h GLN 141 Ca -0.00 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.14 1fwh h GLN 141 Cb 0.46 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.98 1fwh h GLN 141 CO 0.01 0.00 0.03 1.96 -1.50 0.00 0.00 178.83 179.34 1fwh h GLN 142 N 0.00 0.21 -0.70 1.46 4.20 -1.96 -2.78 115.11 115.54 1fwh h GLN 142 Ca 0.02 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 1fwh h GLN 142 Cb 0.17 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.88 1fwh h GLN 142 CO -0.00 0.20 0.18 0.00 -0.67 0.00 0.00 178.83 178.54 1fwh h ALA 143 N 1.83 0.99 -0.23 3.87 0.00 -1.60 -1.12 119.26 123.00 1fwh h ALA 143 Ca 0.05 -0.24 -0.17 0.00 0.00 0.00 0.00 54.91 54.55 1fwh h ALA 143 Cb 0.09 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1fwh h ALA 143 CO -0.00 0.66 -0.55 1.49 0.00 0.00 0.00 179.25 180.84 1fwh h GLU 144 N 1.06 0.70 -0.43 0.00 4.81 -1.67 -0.58 114.58 118.47 1fwh h GLU 144 Ca 0.22 -0.45 -0.02 0.00 -0.13 0.00 0.00 59.36 58.98 1fwh h GLU 144 Cb 0.36 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 1fwh h GLU 144 CO 0.00 1.07 0.19 1.49 -0.73 0.00 0.00 179.01 181.04 1fwh h GLU 145 N 0.54 0.63 -0.40 1.92 4.57 -1.34 -1.44 114.58 119.06 1fwh h GLU 145 Ca 0.01 -0.10 -0.09 0.00 -1.18 0.00 0.00 59.36 58.00 1fwh h GLU 145 Cb 1.13 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.60 1fwh h GLU 145 CO 0.11 0.55 -0.09 0.00 -1.18 0.00 0.00 179.01 178.40 1fwh h ALA 146 N 1.04 0.55 -0.41 2.92 0.00 -1.12 -2.80 119.26 119.44 1fwh h ALA 146 Ca 0.15 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.75 1fwh h ALA 146 Cb 0.14 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1fwh h ALA 146 CO -0.02 0.42 0.25 1.25 0.00 0.00 0.00 179.25 181.15 1fwh h LEU 147 N 0.58 0.42 -1.76 0.00 5.85 -0.93 -0.73 115.31 118.73 1fwh h LEU 147 Ca 0.10 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1fwh h LEU 147 Cb 0.62 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 1fwh h LEU 147 CO 0.04 0.30 0.15 0.58 -0.34 0.00 0.00 178.44 179.17 1fwh h VAL 148 N 0.51 1.06 0.00 1.05 2.07 -1.23 -1.64 116.25 118.07 1fwh h VAL 148 Ca 0.16 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.56 1fwh h VAL 148 Cb -0.02 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1fwh h VAL 148 CO -0.06 0.06 0.00 0.77 0.02 0.00 0.00 177.57 178.36 1fwh h SER 149 N 0.32 0.00 0.00 0.57 4.64 -1.14 -3.39 113.55 114.56 1fwh h SER 149 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1fwh h SER 149 Cb -0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 1fwh h SER 149 CO -0.02 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.55 1fwh n GLY 150 N 0.93 1.53 3.55 -0.77 0.00 -0.62 -4.84 105.19 104.98 1fwh n GLY 150 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1fwh n GLY 150 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fwh s VAL 151 N -2.00 4.95 -0.88 1.61 1.01 -0.34 -0.59 120.40 124.17 1fwh s VAL 151 Ca 0.00 0.05 0.15 0.00 0.00 0.00 0.00 61.98 62.18 1fwh s VAL 151 Cb 0.00 -3.34 -0.13 0.00 0.00 0.00 0.00 36.38 32.91 1fwh s VAL 151 CO 0.00 0.30 0.69 0.35 0.00 0.00 0.00 175.10 176.43 1fwh n THR 152 N 4.88 0.00 -4.43 3.92 -2.24 -0.00 -3.41 114.28 113.00 1fwh n THR 152 Ca -0.15 -0.19 -0.21 0.00 -2.27 0.00 0.00 64.05 61.24 1fwh n THR 152 Cb 0.52 1.04 -0.15 0.00 -2.10 0.00 0.00 70.33 69.63 1fwh n THR 152 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1fwh s THR 153 N -2.31 0.84 -0.09 4.28 2.01 -1.08 -0.87 115.64 118.42 1fwh s THR 153 Ca 0.07 -0.40 -0.01 0.00 0.31 0.00 0.00 61.69 61.67 1fwh s THR 153 Cb 0.12 -0.74 0.03 0.00 0.01 0.00 0.00 72.50 71.91 1fwh s THR 153 CO 0.57 0.26 -0.04 -0.04 -0.69 0.00 0.00 174.62 174.68 1fwh s MET 154 N 0.15 1.05 -0.11 4.92 -1.94 0.31 -1.95 119.30 121.73 1fwh s MET 154 Ca -0.03 -0.08 0.02 0.00 -1.71 0.00 0.00 55.69 53.89 1fwh s MET 154 Cb -0.08 -1.23 -0.01 0.00 2.01 0.00 0.00 34.83 35.52 1fwh s MET 154 CO 0.01 -0.25 -0.19 0.08 -0.01 0.00 0.00 175.02 174.65 1fwh s VAL 155 N 1.71 2.51 -0.58 -6.03 1.01 0.02 -2.77 120.40 116.28 1fwh s VAL 155 Ca 0.03 -0.86 0.00 0.00 0.00 0.00 0.00 61.98 61.15 1fwh s VAL 155 Cb -0.13 -2.00 0.00 0.00 0.00 0.00 0.00 36.38 34.25 1fwh s VAL 155 CO -0.06 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.20 1fwh n GLY 156 N 3.51 -0.72 3.25 4.51 0.00 -1.06 -1.69 105.19 112.99 1fwh n GLY 156 Ca -0.19 -0.70 -0.11 0.00 0.00 0.00 0.00 46.02 45.03 1fwh n GLY 156 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fwh s GLY 157 N 0.00 -0.11 0.00 -0.02 0.00 -0.64 -1.16 107.32 105.40 1fwh s GLY 157 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 44.72 44.60 1fwh s GLY 157 CO 0.00 -0.34 0.00 0.61 0.00 0.00 0.00 173.10 173.37 1fwh n GLY 158 N 0.33 0.96 0.00 0.20 0.00 -1.14 -1.67 105.19 103.87 1fwh n GLY 158 Ca -0.18 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.66 1fwh n GLY 158 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fwh n THR 159 N -1.01 0.09 0.00 2.61 -2.24 -1.23 -4.59 114.28 107.91 1fwh n THR 159 Ca 0.00 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 1fwh n THR 159 Cb 0.00 1.39 0.00 0.00 -2.10 0.00 0.00 70.33 69.62 1fwh n THR 159 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fwh n GLY 160 N -0.04 0.60 2.46 3.38 0.00 -0.46 -4.86 105.19 106.27 1fwh n GLY 160 Ca 0.00 -2.18 -0.32 0.00 0.00 0.00 0.00 46.02 43.53 1fwh n GLY 160 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1fwh n PRO 161 N 0.00 2.94 -4.08 1.61 -0.04 -0.85 -4.42 135.00 130.17 1fwh n PRO 161 Ca 0.00 -1.87 -0.29 0.00 -0.04 0.00 0.00 63.50 61.30 1fwh n PRO 161 Cb 0.00 -2.66 -0.06 0.00 -0.04 0.00 0.00 33.50 30.74 1fwh n PRO 161 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1fwh s ALA 162 N 2.78 3.51 0.21 0.55 0.00 -1.26 -4.96 121.76 122.58 1fwh s ALA 162 Ca 0.56 -1.12 -0.11 0.00 0.00 0.00 0.00 51.96 51.29 1fwh s ALA 162 Cb 0.14 -1.35 0.28 0.00 0.00 0.00 0.00 23.12 22.20 1fwh s ALA 162 CO -0.05 0.64 1.69 0.00 0.00 0.00 0.00 175.76 178.04 1fwh h ALA 163 N 2.96 0.64 -0.86 0.00 0.00 -1.99 0.10 119.26 120.11 1fwh h ALA 163 Ca -0.47 0.15 0.08 0.00 0.00 0.00 0.00 54.91 54.67 1fwh h ALA 163 Cb 1.18 0.24 -0.07 0.00 0.00 0.00 0.00 17.79 19.14 1fwh h ALA 163 CO 0.64 -0.35 0.52 0.78 0.00 0.00 0.00 179.25 180.84 1fwh h GLY 164 N 0.19 1.32 1.67 0.00 0.00 -1.95 -2.43 103.07 101.86 1fwh h GLY 164 Ca 0.31 -0.37 -0.21 0.00 0.00 0.00 0.00 47.33 47.06 1fwh h GLY 164 CO -0.45 0.22 -0.90 -0.84 0.00 0.00 0.00 176.54 174.56 1fwh h THR 165 N 0.92 1.45 -0.64 4.70 2.02 -1.46 0.19 112.91 120.08 1fwh h THR 165 Ca 0.39 -2.53 0.05 0.00 0.77 0.00 0.00 66.41 65.09 1fwh h THR 165 Cb 0.25 2.44 -0.04 0.00 -1.74 0.00 0.00 68.15 69.06 1fwh h THR 165 CO -0.20 0.75 0.42 0.45 0.37 0.00 0.00 175.52 177.31 1fwh h HIS 166 N 0.17 0.68 0.02 3.16 3.86 -0.40 -3.21 115.15 119.43 1fwh h HIS 166 Ca -0.06 0.02 -0.36 0.00 -1.16 0.00 0.00 60.37 58.81 1fwh h HIS 166 Cb 1.54 -0.23 -0.06 0.00 1.06 0.00 0.00 27.41 29.72 1fwh h HIS 166 CO 0.04 0.38 -2.21 0.00 0.86 0.00 0.00 177.93 177.00 1fwh n ALA 167 N -2.46 1.37 -2.44 2.45 0.00 -0.96 -4.67 120.51 113.81 1fwh n ALA 167 Ca 0.09 -1.03 -0.16 0.00 0.00 0.00 0.00 53.44 52.34 1fwh n ALA 167 Cb 0.19 -0.38 -0.11 0.00 0.00 0.00 0.00 19.45 19.16 1fwh n ALA 167 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1fwh s THR 168 N -2.53 1.23 -1.29 0.00 -4.23 0.65 -5.05 115.64 104.43 1fwh s THR 168 Ca -0.18 -1.79 -0.06 0.00 -1.18 0.00 0.00 61.69 58.47 1fwh s THR 168 Cb 0.07 -1.58 0.15 0.00 1.34 0.00 0.00 72.50 72.49 1fwh s THR 168 CO 0.75 -0.52 2.17 0.35 -0.54 0.00 0.00 174.62 176.83 1fwh n THR 169 N 0.35 5.02 -4.66 3.99 -2.24 -1.26 -4.18 114.28 111.30 1fwh n THR 169 Ca -0.14 -4.49 -0.24 0.00 -2.27 0.00 0.00 64.05 56.91 1fwh n THR 169 Cb 0.58 -2.14 -0.16 0.00 -2.10 0.00 0.00 70.33 66.51 1fwh n THR 169 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fwh s THR 171 N 0.28 3.81 -0.12 0.00 2.01 -0.61 -2.90 115.64 118.11 1fwh s THR 171 Ca -0.07 -2.28 -0.29 0.00 0.31 0.00 0.00 61.69 59.35 1fwh s THR 171 Cb -0.12 -3.52 -0.04 0.00 0.01 0.00 0.00 72.50 68.83 1fwh s THR 171 CO 0.02 -0.79 1.55 -2.84 -0.69 0.00 0.00 174.62 171.87 1fwh s PRO 172 N 0.78 4.10 0.36 4.92 0.02 -1.26 -3.90 135.00 140.02 1fwh s PRO 172 Ca 0.11 1.94 0.00 0.00 0.02 0.00 0.00 61.00 63.06 1fwh s PRO 172 Cb -0.22 -3.95 0.00 0.00 0.02 0.00 0.00 34.50 30.35 1fwh s PRO 172 CO -0.03 -0.92 0.00 0.41 -0.33 0.00 0.00 177.00 176.13 1fwh n GLY 173 N 4.14 -2.80 0.26 0.52 0.00 -1.26 -4.09 105.19 101.96 1fwh n GLY 173 Ca 0.17 -1.21 0.03 0.00 0.00 0.00 0.00 46.02 45.01 1fwh n GLY 173 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1fwh h PRO 174 N -0.91 0.12 0.29 1.61 0.11 -1.91 -0.68 132.00 130.63 1fwh h PRO 174 Ca -0.10 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.99 1fwh h PRO 174 Cb 0.89 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.97 1fwh h PRO 174 CO 0.04 0.08 -0.14 2.35 -0.21 0.00 0.00 178.00 180.12 1fwh h TRP 175 N 0.12 -0.36 -0.33 0.65 7.01 -1.99 0.63 115.95 121.68 1fwh h TRP 175 Ca 0.37 -0.01 -0.11 0.00 2.11 0.00 0.00 58.89 61.25 1fwh h TRP 175 Cb 0.63 0.12 -0.01 0.00 -2.10 0.00 0.00 29.16 27.80 1fwh h TRP 175 CO -0.39 -0.18 -0.25 1.88 -2.79 0.00 0.00 178.44 176.71 1fwh h TYR 176 N -0.45 0.75 -0.26 2.65 -1.99 -1.66 -1.05 116.97 114.96 1fwh h TYR 176 Ca -0.04 -0.17 -0.01 0.00 2.00 0.00 0.00 58.73 60.51 1fwh h TYR 176 Cb 0.34 -0.18 -0.01 0.00 2.00 0.00 0.00 36.73 38.88 1fwh h TYR 176 CO -0.04 0.85 0.14 0.82 -0.00 0.00 0.00 178.16 179.92 1fwh h ILE 177 N 0.57 1.12 -0.58 -2.88 2.04 -1.00 0.42 117.51 117.21 1fwh h ILE 177 Ca 0.08 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.60 1fwh h ILE 177 Cb 0.73 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.66 1fwh h ILE 177 CO 0.06 0.12 0.34 0.28 0.00 0.00 0.00 178.15 178.95 1fwh h SER 178 N 0.30 0.70 -0.74 1.72 0.02 -0.71 -0.48 113.55 114.37 1fwh h SER 178 Ca 0.09 -0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 60.95 1fwh h SER 178 Cb 0.07 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.40 1fwh h SER 178 CO -0.01 0.56 0.39 0.03 -1.14 0.00 0.00 176.83 176.66 1fwh h ARG 179 N 0.78 1.04 -0.03 3.45 -0.00 -0.85 -2.14 114.38 116.62 1fwh h ARG 179 Ca 0.21 -0.13 -0.15 0.00 -0.50 0.00 0.00 59.98 59.40 1fwh h ARG 179 Cb -0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 29.97 29.76 1fwh h ARG 179 CO -0.04 0.79 -0.67 0.52 0.00 0.00 0.00 179.97 180.57 1fwh h MET 180 N 1.02 0.14 -0.37 0.04 2.86 -0.58 -1.88 114.93 116.16 1fwh h MET 180 Ca 0.26 -0.11 -0.10 0.00 -2.06 0.00 0.00 59.70 57.69 1fwh h MET 180 Cb 0.06 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.73 1fwh h MET 180 CO -0.04 0.76 -0.19 -0.07 1.06 0.00 0.00 176.91 178.43 1fwh h LEU 181 N 0.10 0.70 -0.46 1.22 3.38 -0.83 -1.25 115.31 118.17 1fwh h LEU 181 Ca -0.01 -0.23 -0.11 0.00 0.09 0.00 0.00 57.88 57.61 1fwh h LEU 181 Cb 1.20 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1fwh h LEU 181 CO 0.10 0.89 -0.16 1.56 0.09 0.00 0.00 178.44 180.92 1fwh h GLN 182 N 0.62 0.92 -0.04 1.13 4.20 -1.23 -3.01 115.11 117.70 1fwh h GLN 182 Ca 0.09 -0.37 -0.08 0.00 0.06 0.00 0.00 58.65 58.35 1fwh h GLN 182 Cb 0.67 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 1fwh h GLN 182 CO 0.05 1.03 -0.34 0.00 -0.67 0.00 0.00 178.83 178.89 1fwh h ALA 183 N 0.86 1.36 -0.25 3.87 0.00 -1.13 -3.01 119.26 120.96 1fwh h ALA 183 Ca 0.11 -0.33 0.05 0.00 0.00 0.00 0.00 54.91 54.74 1fwh h ALA 183 Cb 0.72 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1fwh h ALA 183 CO 0.05 0.47 0.17 0.00 0.00 0.00 0.00 179.25 179.94 1fwh h ALA 184 N 1.59 2.09 -0.04 0.00 0.00 -1.09 -1.41 119.26 120.40 1fwh h ALA 184 Ca 0.01 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1fwh h ALA 184 Cb 0.64 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 1fwh h ALA 184 CO 0.05 -0.14 0.07 -0.44 0.00 0.00 0.00 179.25 178.78 1fwh h ASP 185 N 0.12 0.00 1.07 0.00 3.45 -1.62 -0.65 116.42 118.78 1fwh h ASP 185 Ca 0.11 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.57 1fwh h ASP 185 Cb 0.30 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.07 1fwh h ASP 185 CO -0.01 0.00 -0.26 -1.20 -1.57 0.00 0.00 179.24 176.20 1fwh n SER 186 N -3.53 0.59 -4.84 6.45 7.64 -0.53 -4.73 113.62 114.67 1fwh n SER 186 Ca -0.02 0.31 -0.37 0.00 1.01 0.00 0.00 58.87 59.80 1fwh n SER 186 Cb 0.15 -0.31 -0.06 0.00 -1.01 0.00 0.00 64.21 62.98 1fwh n SER 186 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1fwh s LEU 187 N -3.95 4.37 0.00 -3.43 1.43 -0.25 -5.01 118.68 111.84 1fwh s LEU 187 Ca 0.10 0.56 0.00 0.00 -1.03 0.00 0.00 54.13 53.76 1fwh s LEU 187 Cb 0.15 -2.23 0.00 0.00 0.03 0.00 0.00 46.19 44.14 1fwh s LEU 187 CO 0.64 0.33 0.86 -0.81 0.23 0.00 0.00 176.35 177.59 1fwh n PRO 188 N 2.30 0.88 -4.13 1.29 -0.04 -1.26 -4.83 135.00 129.20 1fwh n PRO 188 Ca -0.17 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.19 1fwh n PRO 188 Cb 0.54 -1.08 -0.10 0.00 -0.04 0.00 0.00 33.50 32.82 1fwh n PRO 188 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1fwh s VAL 189 N 0.07 0.51 0.33 0.52 -7.23 -1.26 -5.02 120.40 108.32 1fwh s VAL 189 Ca 0.00 -1.80 -0.27 0.00 -1.81 0.00 0.00 61.98 58.10 1fwh s VAL 189 Cb 0.00 -1.51 -0.09 0.00 0.56 0.00 0.00 36.38 35.34 1fwh s VAL 189 CO 0.00 -0.87 1.12 0.20 -0.31 0.00 0.00 175.10 175.24 1fwh s ASN 190 N -2.85 6.97 0.02 4.85 0.01 -0.05 -4.64 114.94 119.26 1fwh s ASN 190 Ca 0.08 2.26 0.02 0.00 -0.71 0.00 0.00 52.86 54.51 1fwh s ASN 190 Cb 0.05 -2.62 -0.01 0.00 0.41 0.00 0.00 41.25 39.08 1fwh s ASN 190 CO -0.06 -0.35 -0.07 -0.63 -1.51 0.00 0.00 177.10 174.47 1fwh s ILE 191 N -1.32 0.54 -0.02 0.60 1.01 -0.61 -0.53 121.20 120.87 1fwh s ILE 191 Ca 0.50 -0.67 -0.02 0.00 0.00 0.00 0.00 60.65 60.47 1fwh s ILE 191 Cb -0.30 -0.53 0.00 0.00 0.01 0.00 0.00 42.46 41.64 1fwh s ILE 191 CO 0.38 -0.10 0.05 -0.83 0.00 0.00 0.00 174.94 174.44 1fwh s GLY 192 N -0.84 -0.03 0.11 6.18 0.00 -1.11 -0.87 107.32 110.75 1fwh s GLY 192 Ca -0.03 0.13 0.05 0.00 0.00 0.00 0.00 44.72 44.87 1fwh s GLY 192 CO 0.00 0.11 0.02 1.08 0.00 0.00 0.00 173.10 174.31 1fwh s LEU 193 N 0.03 3.51 -0.09 0.66 1.43 -1.26 -2.56 118.68 120.39 1fwh s LEU 193 Ca -0.00 -0.18 0.01 0.00 -1.03 0.00 0.00 54.13 52.92 1fwh s LEU 193 Cb -0.00 -2.21 -0.02 0.00 0.03 0.00 0.00 46.19 43.98 1fwh s LEU 193 CO 0.00 0.16 -0.10 -0.76 0.23 0.00 0.00 176.35 175.87 1fwh s LEU 194 N -2.46 2.94 0.00 1.79 1.43 -0.31 -0.10 118.68 121.97 1fwh s LEU 194 Ca 0.27 -0.17 0.06 0.00 -1.03 0.00 0.00 54.13 53.26 1fwh s LEU 194 Cb -0.11 -1.64 0.10 0.00 0.03 0.00 0.00 46.19 44.57 1fwh s LEU 194 CO 0.19 0.28 0.80 0.61 0.23 0.00 0.00 176.35 178.46 1fwh n GLY 195 N 2.78 1.53 3.59 -3.19 0.00 -0.41 -1.58 105.19 107.90 1fwh n GLY 195 Ca -0.18 -2.16 -0.43 0.00 0.00 0.00 0.00 46.02 43.26 1fwh n GLY 195 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1fwh s LYS 196 N -4.59 3.71 0.00 1.61 2.20 -1.25 -4.53 119.74 116.88 1fwh s LYS 196 Ca 0.58 0.36 0.27 0.00 -0.36 0.00 0.00 55.97 56.83 1fwh s LYS 196 Cb -0.04 -3.85 0.96 0.00 -1.51 0.00 0.00 37.83 33.39 1fwh s LYS 196 CO 0.37 -1.03 1.69 0.41 -0.36 0.00 0.00 175.35 176.44 1fwh n GLY 197 N 4.62 -0.22 3.56 5.54 0.00 -1.26 -4.78 105.19 112.65 1fwh n GLY 197 Ca 0.06 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 1fwh n GLY 197 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1fwh s ASN 198 N -2.17 6.68 -0.02 1.61 -0.87 -1.26 -4.52 114.94 114.39 1fwh s ASN 198 Ca 0.33 -2.00 -0.26 0.00 -1.57 0.00 0.00 52.86 49.36 1fwh s ASN 198 Cb 0.20 -2.56 0.06 0.00 -0.02 0.00 0.00 41.25 38.93 1fwh s ASN 198 CO 0.40 -1.30 0.59 -0.69 -2.57 0.00 0.00 177.10 173.52 1fwh s VAL 199 N 4.40 0.01 -0.62 1.60 1.01 -1.26 -4.97 120.40 120.58 1fwh s VAL 199 Ca 0.49 -0.12 0.16 0.00 0.00 0.00 0.00 61.98 62.51 1fwh s VAL 199 Cb 0.02 -0.93 0.62 0.00 0.00 0.00 0.00 36.38 36.08 1fwh s VAL 199 CO -0.01 -0.07 1.53 -1.20 0.00 0.00 0.00 175.10 175.35 1fwh n SER 200 N 0.82 4.41 -3.98 3.32 7.64 -1.26 -4.53 113.62 120.03 1fwh n SER 200 Ca -0.19 -2.66 -0.31 0.00 1.01 0.00 0.00 58.87 56.72 1fwh n SER 200 Cb 0.58 -0.54 -0.15 0.00 -1.01 0.00 0.00 64.21 63.09 1fwh n SER 200 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 1fwh s GLN 201 N -2.22 1.75 0.23 1.43 2.00 -1.26 -5.02 119.66 116.58 1fwh s GLN 201 Ca 0.45 -1.21 -0.07 0.00 -2.00 0.00 0.00 55.36 52.53 1fwh s GLN 201 Cb 0.32 -2.72 0.40 0.00 0.80 0.00 0.00 33.01 31.81 1fwh s GLN 201 CO 0.17 -0.65 1.69 -1.35 -0.50 0.00 0.00 175.29 174.65 1fwh h PRO 202 N 7.86 0.26 -0.24 1.67 0.11 -1.91 -2.30 132.00 137.45 1fwh h PRO 202 Ca -0.16 -0.02 0.07 0.00 0.11 0.00 0.00 66.00 66.00 1fwh h PRO 202 Cb 1.05 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 1fwh h PRO 202 CO 0.44 0.17 0.18 -0.44 -0.21 0.00 0.00 178.00 178.15 1fwh h ASP 203 N 0.27 0.00 0.95 -2.05 3.32 -1.99 0.45 116.42 117.38 1fwh h ASP 203 Ca 0.38 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.41 1fwh h ASP 203 Cb 0.62 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.17 1fwh h ASP 203 CO -0.47 0.00 -0.09 0.00 -1.72 0.00 0.00 179.24 176.96 1fwh h ALA 204 N 1.87 1.02 0.11 3.45 0.00 -1.85 -2.03 119.26 121.82 1fwh h ALA 204 Ca 0.12 -0.08 -0.32 0.00 0.00 0.00 0.00 54.91 54.62 1fwh h ALA 204 Cb 0.48 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1fwh h ALA 204 CO -0.00 0.11 -1.69 -0.07 0.00 0.00 0.00 179.25 177.60 1fwh h LEU 205 N 0.00 0.36 -1.00 0.00 3.38 -1.07 -3.33 115.31 113.65 1fwh h LEU 205 Ca -0.00 -0.85 0.06 0.00 0.09 0.00 0.00 57.88 57.18 1fwh h LEU 205 Cb 0.59 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 41.16 1fwh h LEU 205 CO 0.01 1.73 0.65 0.03 0.09 0.00 0.00 178.44 180.95 1fwh h ARG 206 N -0.21 1.14 -0.32 1.13 3.08 -1.10 -1.28 114.38 116.82 1fwh h ARG 206 Ca -0.37 -0.07 0.04 0.00 0.07 0.00 0.00 59.98 59.65 1fwh h ARG 206 Cb 1.85 -0.26 -0.04 0.00 0.08 0.00 0.00 29.97 31.60 1fwh h ARG 206 CO 0.04 0.76 0.10 0.93 -1.07 0.00 0.00 179.97 180.72 1fwh h GLU 207 N 1.18 0.22 -0.68 0.04 5.08 -1.52 0.21 114.58 119.10 1fwh h GLU 207 Ca 0.43 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.74 1fwh h GLU 207 Cb 0.16 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 1fwh h GLU 207 CO -0.17 0.14 0.29 1.96 -1.00 0.00 0.00 179.01 180.23 1fwh h GLN 208 N 0.23 1.00 -0.53 2.33 4.20 -1.46 -0.56 115.11 120.31 1fwh h GLN 208 Ca 0.15 -0.17 -0.09 0.00 0.06 0.00 0.00 58.65 58.60 1fwh h GLN 208 Cb 0.14 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.73 1fwh h GLN 208 CO -0.17 0.82 -0.02 0.28 -0.67 0.00 0.00 178.83 179.08 1fwh h VAL 209 N 0.96 1.27 0.00 -0.54 2.07 -0.70 -2.29 116.25 117.01 1fwh h VAL 209 Ca 0.23 -1.13 -0.04 0.00 0.82 0.00 0.00 66.70 66.58 1fwh h VAL 209 Cb 0.18 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 1fwh h VAL 209 CO -0.02 0.40 -0.18 0.00 0.02 0.00 0.00 177.57 177.79 1fwh h ALA 210 N 0.94 1.31 0.00 1.67 0.00 -0.31 -1.70 119.26 121.16 1fwh h ALA 210 Ca 0.15 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1fwh h ALA 210 Cb 0.55 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 1fwh h ALA 210 CO 0.03 0.23 -0.05 0.00 0.00 0.00 0.00 179.25 179.46 1fwh h ALA 211 N 1.82 0.98 0.00 0.00 0.00 -0.55 -3.34 119.26 118.17 1fwh h ALA 211 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1fwh h ALA 211 Cb 0.44 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1fwh h ALA 211 CO 0.02 0.06 0.00 0.41 0.00 0.00 0.00 179.25 179.74 1fwh n GLY 212 N 0.72 0.81 3.76 0.00 0.00 -0.64 -4.73 105.19 105.12 1fwh n GLY 212 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 1fwh n GLY 212 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1fwh s VAL 213 N -0.29 2.53 -2.60 1.61 -7.23 -1.17 -3.79 120.40 109.46 1fwh s VAL 213 Ca 0.00 0.44 0.23 0.00 -1.81 0.00 0.00 61.98 60.85 1fwh s VAL 213 Cb 0.00 -3.25 0.38 0.00 0.56 0.00 0.00 36.38 34.06 1fwh s VAL 213 CO 0.00 0.04 1.42 2.30 -0.31 0.00 0.00 175.10 178.55 1fwh n ILE 214 N -0.21 0.26 -3.79 -0.62 -5.35 0.86 -4.14 119.36 106.37 1fwh n ILE 214 Ca 0.06 -0.56 -0.02 0.00 -0.27 0.00 0.00 62.75 61.96 1fwh n ILE 214 Cb 0.44 0.98 0.00 0.00 -1.74 0.00 0.00 39.64 39.32 1fwh n ILE 214 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1fwh s GLY 215 N -1.70 -0.15 0.00 3.28 0.00 -1.21 -3.02 107.32 104.53 1fwh s GLY 215 Ca 0.35 0.09 0.00 0.00 0.00 0.00 0.00 44.72 45.16 1fwh s GLY 215 CO 0.30 1.33 0.00 1.04 0.00 0.00 0.00 173.10 175.78 1fwh n LEU 216 N -0.59 0.00 -3.47 0.66 4.77 -0.33 -1.29 117.00 116.75 1fwh n LEU 216 Ca -0.05 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 55.94 1fwh n LEU 216 Cb 0.61 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.66 1fwh n LEU 216 CO 0.16 0.00 0.43 -0.63 -1.33 0.00 0.00 177.39 176.02 1fwh s ILE 218 N 0.39 -0.73 -0.01 -0.08 1.09 -0.29 -1.35 121.20 120.23 1fwh s ILE 218 Ca 0.00 0.00 0.06 0.00 -1.10 0.00 0.00 60.65 59.61 1fwh s ILE 218 Cb 0.00 -1.00 -0.02 0.00 -1.06 0.00 0.00 42.46 40.38 1fwh s ILE 218 CO 0.00 0.00 -0.18 -2.28 -0.10 0.00 0.00 174.94 172.38 1fwh s HIS 219 N 2.69 1.59 0.54 3.97 2.46 -1.26 -1.08 115.29 124.20 1fwh s HIS 219 Ca -0.02 -0.31 0.20 0.00 0.47 0.00 0.00 55.06 55.40 1fwh s HIS 219 Cb -0.09 -1.01 1.43 0.00 -0.13 0.00 0.00 32.58 32.77 1fwh s HIS 219 CO -0.18 -0.01 2.17 1.05 -2.47 0.00 0.00 174.74 175.30 1fwh h GLU 220 N 5.58 0.00 0.00 2.88 4.11 -1.71 -1.80 114.58 123.63 1fwh h GLU 220 Ca -0.38 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.03 1fwh h GLU 220 Cb 1.15 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.40 1fwh h GLU 220 CO 0.48 0.00 -0.10 -0.44 0.07 0.00 0.00 179.01 179.01 1fwh h ASP 221 N 0.00 0.00 -0.02 3.06 5.19 -1.94 -0.36 116.42 122.35 1fwh h ASP 221 Ca 0.01 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 1fwh h ASP 221 Cb 0.04 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.55 1fwh h ASP 221 CO -0.00 0.10 -0.05 0.79 -3.12 0.00 0.00 179.24 176.97 1fwh n TRP 222 N -3.59 0.00 0.00 4.55 7.02 -0.71 -5.01 117.44 119.70 1fwh n TRP 222 Ca -0.02 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.46 1fwh n TRP 222 Cb 0.23 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.12 1fwh n TRP 222 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1fwh n GLY 223 N 1.19 0.10 2.55 6.99 0.00 -0.14 -4.90 105.19 110.98 1fwh n GLY 223 Ca 0.12 -0.71 -0.40 0.00 0.00 0.00 0.00 46.02 45.02 1fwh n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fwh n ALA 224 N 0.00 6.57 -2.42 4.61 0.00 -1.23 -4.82 120.51 123.22 1fwh n ALA 224 Ca 0.00 -4.02 -0.27 0.00 0.00 0.00 0.00 53.44 49.15 1fwh n ALA 224 Cb 0.00 -2.98 -0.02 0.00 0.00 0.00 0.00 19.45 16.46 1fwh n ALA 224 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1fwh s THR 225 N 0.07 4.97 0.35 0.00 -4.23 -1.26 -4.37 115.64 111.17 1fwh s THR 225 Ca 0.53 0.04 0.07 0.00 -1.18 0.00 0.00 61.69 61.16 1fwh s THR 225 Cb 0.16 -3.81 0.31 0.00 1.34 0.00 0.00 72.50 70.50 1fwh s THR 225 CO -0.07 -0.60 1.89 -0.65 -0.54 0.00 0.00 174.62 174.65 1fwh h PRO 226 N 0.86 0.73 -0.27 3.99 0.11 -1.92 -0.23 132.00 135.27 1fwh h PRO 226 Ca -0.48 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.56 1fwh h PRO 226 Cb 1.20 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 1fwh h PRO 226 CO 0.63 0.48 0.07 0.00 -0.21 0.00 0.00 178.00 178.97 1fwh h ALA 227 N 1.59 0.36 -0.01 -0.75 0.00 -1.97 -1.33 119.26 117.14 1fwh h ALA 227 Ca 0.42 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1fwh h ALA 227 Cb 0.57 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 1fwh h ALA 227 CO -0.18 0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.09 1fwh h ALA 228 N 0.89 0.01 -0.25 0.00 0.00 -1.57 -2.04 119.26 116.29 1fwh h ALA 228 Ca 0.09 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 54.96 1fwh h ALA 228 Cb 0.28 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1fwh h ALA 228 CO 0.00 -0.40 -0.02 0.82 0.00 0.00 0.00 179.25 179.65 1fwh h ILE 229 N -0.15 0.79 -0.82 0.00 2.04 -1.02 -0.48 117.51 117.87 1fwh h ILE 229 Ca 0.00 -0.02 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 1fwh h ILE 229 Cb 0.17 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 36.94 1fwh h ILE 229 CO -0.00 0.01 0.48 -0.78 0.00 0.00 0.00 178.15 177.86 1fwh h ASP 230 N 0.05 0.99 -0.23 1.72 -0.00 -1.23 -1.48 116.42 116.24 1fwh h ASP 230 Ca 0.12 -0.07 -0.00 0.00 -0.00 0.00 0.00 57.03 57.08 1fwh h ASP 230 Cb 0.17 -0.25 -0.01 0.00 -0.00 0.00 0.00 39.33 39.24 1fwh h ASP 230 CO -0.22 0.77 0.14 0.00 -0.00 0.00 0.00 179.24 179.93 1fwh h ALA 232 N 1.05 0.76 -0.30 0.00 0.00 -0.88 -2.48 119.26 117.41 1fwh h ALA 232 Ca 0.08 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1fwh h ALA 232 Cb 0.02 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1fwh h ALA 232 CO -0.02 0.27 -0.16 -0.07 0.00 0.00 0.00 179.25 179.27 1fwh h LEU 233 N 0.81 0.52 -0.32 0.00 3.38 -1.02 -0.88 115.31 117.79 1fwh h LEU 233 Ca 0.21 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1fwh h LEU 233 Cb 0.02 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1fwh h LEU 233 CO -0.04 0.70 0.12 0.74 0.09 0.00 0.00 178.44 180.05 1fwh h THR 234 N 0.48 1.19 -0.50 0.22 2.02 -0.77 -0.24 112.91 115.31 1fwh h THR 234 Ca 0.08 -0.60 -0.12 0.00 0.77 0.00 0.00 66.41 66.54 1fwh h THR 234 Cb 0.56 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 67.94 1fwh h THR 234 CO 0.04 0.21 -0.15 0.58 0.37 0.00 0.00 175.52 176.56 1fwh h VAL 235 N 0.37 1.27 -0.83 3.16 2.07 -1.29 -2.51 116.25 118.48 1fwh h VAL 235 Ca 0.11 -1.31 0.01 0.00 0.82 0.00 0.00 66.70 66.32 1fwh h VAL 235 Cb 0.21 1.04 -0.04 0.00 -1.52 0.00 0.00 31.29 30.98 1fwh h VAL 235 CO -0.01 0.46 0.54 0.00 0.02 0.00 0.00 177.57 178.58 1fwh h ALA 236 N 0.95 1.05 -0.22 1.67 0.00 -0.93 0.32 119.26 122.09 1fwh h ALA 236 Ca 0.13 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1fwh h ALA 236 Cb 0.72 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1fwh h ALA 236 CO 0.05 0.47 -0.03 -0.44 0.00 0.00 0.00 179.25 179.31 1fwh h ASP 237 N 1.12 0.31 0.92 0.00 3.32 -0.75 -1.22 116.42 120.13 1fwh h ASP 237 Ca 0.30 -0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 1fwh h ASP 237 Cb -0.11 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 39.36 1fwh h ASP 237 CO -0.06 0.39 -1.09 -1.84 -1.72 0.00 0.00 179.24 174.92 1fwh n GLU 238 N -4.32 0.61 -0.11 3.56 0.28 -0.77 -4.30 120.64 115.59 1fwh n GLU 238 Ca 0.00 0.11 0.06 0.00 -0.16 0.00 0.00 57.16 57.17 1fwh n GLU 238 Cb 0.22 -1.81 0.12 0.00 1.43 0.00 0.00 31.44 31.40 1fwh n GLU 238 CO 0.00 0.00 0.00 -1.33 -0.16 0.00 0.00 177.13 175.64 1fwh n MET 239 N -2.66 1.95 -3.58 3.44 2.81 0.03 -5.02 117.12 114.09 1fwh n MET 239 Ca -0.01 -1.73 -0.23 0.00 -1.81 0.00 0.00 57.70 53.92 1fwh n MET 239 Cb 0.57 -1.26 0.05 0.00 -0.71 0.00 0.00 33.22 31.86 1fwh n MET 239 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1fwh n ASP 240 N 0.63 -4.10 -4.29 7.83 2.03 -0.48 -4.65 116.55 113.52 1fwh n ASP 240 Ca 0.10 -0.86 -0.16 0.00 0.52 0.00 0.00 54.79 54.39 1fwh n ASP 240 Cb 0.38 -4.11 -0.10 0.00 -0.72 0.00 0.00 41.12 36.57 1fwh n ASP 240 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1fwh s ILE 241 N -3.52 1.22 0.14 5.18 -5.25 -1.17 -4.59 121.20 113.21 1fwh s ILE 241 Ca 0.29 -2.08 -0.03 0.00 -0.99 0.00 0.00 60.65 57.85 1fwh s ILE 241 Cb -0.08 -2.03 -0.05 0.00 2.95 0.00 0.00 42.46 43.25 1fwh s ILE 241 CO 0.81 -0.59 0.34 -1.58 -1.79 0.00 0.00 174.94 172.13 1fwh s GLN 242 N -3.77 3.55 -0.10 0.37 2.00 -1.17 -4.68 119.66 115.87 1fwh s GLN 242 Ca 0.21 -0.23 0.01 0.00 -2.00 0.00 0.00 55.36 53.36 1fwh s GLN 242 Cb 0.03 -2.89 -0.02 0.00 0.80 0.00 0.00 33.01 30.94 1fwh s GLN 242 CO 0.04 0.48 -0.14 0.08 -0.50 0.00 0.00 175.29 175.25 1fwh s VAL 243 N -1.68 2.98 -0.09 1.34 1.01 -1.26 -1.18 120.40 121.51 1fwh s VAL 243 Ca 0.39 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.66 1fwh s VAL 243 Cb -0.12 -2.21 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 1fwh s VAL 243 CO 0.26 0.55 -0.09 0.00 0.00 0.00 0.00 175.10 175.82 1fwh s ALA 244 N -0.01 2.85 -0.04 5.51 0.00 -0.45 -1.22 121.76 128.39 1fwh s ALA 244 Ca -0.04 -0.90 0.07 0.00 0.00 0.00 0.00 51.96 51.09 1fwh s ALA 244 Cb -0.14 -1.22 -0.01 0.00 0.00 0.00 0.00 23.12 21.74 1fwh s ALA 244 CO 0.04 0.45 -0.25 -1.17 0.00 0.00 0.00 175.76 174.83 1fwh s LEU 245 N -0.37 2.05 -0.33 0.00 2.96 0.31 -1.14 118.68 122.16 1fwh s LEU 245 Ca 0.05 -0.49 0.01 0.00 -0.22 0.00 0.00 54.13 53.48 1fwh s LEU 245 Cb -0.12 -1.33 0.10 0.00 0.50 0.00 0.00 46.19 45.34 1fwh s LEU 245 CO 0.02 0.26 0.10 -2.28 -1.32 0.00 0.00 176.35 173.13 1fwh s HIS 246 N -0.29 2.33 1.13 5.38 5.65 -0.24 -1.30 115.29 127.95 1fwh s HIS 246 Ca 0.01 -2.17 -0.16 0.00 0.25 0.00 0.00 55.06 52.99 1fwh s HIS 246 Cb -0.12 -2.09 0.25 0.00 -1.18 0.00 0.00 32.58 29.44 1fwh s HIS 246 CO 0.02 -0.89 1.09 -1.54 -0.65 0.00 0.00 174.74 172.77 1fwh s SER 247 N 1.29 1.52 -0.82 9.88 1.04 -1.26 -2.49 113.70 122.87 1fwh s SER 247 Ca 0.11 0.93 -0.25 0.00 0.48 0.00 0.00 55.95 57.22 1fwh s SER 247 Cb -0.18 -1.41 -0.03 0.00 0.10 0.00 0.00 66.02 64.50 1fwh s SER 247 CO -0.18 -3.78 1.87 -0.62 0.98 0.00 0.00 173.24 171.51 1fwh s ASP 248 N -3.57 5.29 0.30 7.02 -1.08 -1.26 -3.71 116.67 119.66 1fwh s ASP 248 Ca 0.68 -0.41 -0.00 0.00 -0.52 0.00 0.00 52.55 52.30 1fwh s ASP 248 Cb -0.15 -2.55 0.47 0.00 -1.46 0.00 0.00 42.92 39.23 1fwh s ASP 248 CO 0.57 -2.53 1.90 0.74 0.52 0.00 0.00 175.17 176.37 1fwh h THR 249 N 7.08 1.21 0.00 1.71 2.02 -1.93 -2.64 112.91 120.36 1fwh h THR 249 Ca -0.02 -0.61 0.00 0.00 0.77 0.00 0.00 66.41 66.55 1fwh h THR 249 Cb 1.05 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 1fwh h THR 249 CO 1.23 0.25 0.00 0.18 0.37 0.00 0.00 175.52 177.55 1fwh n LEU 250 N -4.34 0.68 -2.05 2.58 4.77 -1.26 -2.90 117.00 114.49 1fwh n LEU 250 Ca 0.05 0.69 -0.20 0.00 -0.03 0.00 0.00 56.01 56.53 1fwh n LEU 250 Cb 0.15 -0.63 -0.03 0.00 -2.33 0.00 0.00 43.42 40.58 1fwh n LEU 250 CO 0.38 -0.65 -0.23 0.59 -1.33 0.00 0.00 177.39 176.15 1fwh n ASN 251 N -2.28 -5.54 -0.21 -1.43 3.02 -1.00 -4.91 115.26 102.91 1fwh n ASN 251 Ca 0.01 0.11 -0.08 0.00 -0.03 0.00 0.00 54.58 54.59 1fwh n ASN 251 Cb 0.19 -4.63 0.02 0.00 -0.61 0.00 0.00 39.78 34.76 1fwh n ASN 251 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1fwh h GLU 252 N 0.00 0.98 0.00 3.52 4.81 -1.89 -3.18 114.58 118.82 1fwh h GLU 252 Ca -0.45 -0.26 0.00 0.00 -0.13 0.00 0.00 59.36 58.52 1fwh h GLU 252 Cb 1.33 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.59 1fwh h GLU 252 CO 0.56 0.92 -1.02 -1.13 -0.73 0.00 0.00 179.01 177.61 1fwh n SER 253 N -4.31 0.81 0.00 1.04 3.41 -1.26 -5.06 113.62 108.24 1fwh n SER 253 Ca 0.03 -0.73 0.00 0.00 -0.26 0.00 0.00 58.87 57.91 1fwh n SER 253 Cb 0.27 0.97 0.00 0.00 -0.26 0.00 0.00 64.21 65.19 1fwh n SER 253 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fwh n GLY 254 N 1.47 -2.37 4.02 5.00 0.00 -1.20 -4.95 105.19 107.16 1fwh n GLY 254 Ca 0.03 -1.35 -0.22 0.00 0.00 0.00 0.00 46.02 44.48 1fwh n GLY 254 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1fwh s PHE 255 N -2.14 1.24 0.31 1.61 2.99 -1.26 -4.28 117.98 116.45 1fwh s PHE 255 Ca 0.00 -0.58 0.07 0.00 0.00 0.00 0.00 56.93 56.42 1fwh s PHE 255 Cb 0.00 -2.58 0.76 0.00 0.00 0.00 0.00 43.02 41.20 1fwh s PHE 255 CO 0.00 -1.56 1.79 -0.24 -0.00 0.00 0.00 175.22 175.22 1fwh h VAL 256 N -0.24 0.73 -0.21 -0.44 3.04 -1.93 -0.26 116.25 116.93 1fwh h VAL 256 Ca -0.31 -0.26 -0.02 0.00 -1.01 0.00 0.00 66.70 65.10 1fwh h VAL 256 Cb 1.28 -0.09 -0.01 0.00 -2.01 0.00 0.00 31.29 30.45 1fwh h VAL 256 CO 0.39 0.14 0.04 1.05 -1.01 0.00 0.00 177.57 178.17 1fwh h GLU 257 N 0.75 0.30 -0.30 4.17 9.09 -1.96 -0.29 114.58 126.34 1fwh h GLU 257 Ca 0.56 -0.04 -0.16 0.00 0.05 0.00 0.00 59.36 59.77 1fwh h GLU 257 Cb 0.89 -0.06 -0.00 0.00 -1.65 0.00 0.00 28.75 27.93 1fwh h GLU 257 CO -0.35 0.30 -0.42 -0.44 0.05 0.00 0.00 179.01 178.15 1fwh h ASP 258 N 0.30 0.89 -0.28 3.06 3.32 -1.41 -1.16 116.42 121.13 1fwh h ASP 258 Ca 0.07 -0.51 -0.02 0.00 0.02 0.00 0.00 57.03 56.60 1fwh h ASP 258 Cb 0.15 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1fwh h ASP 258 CO -0.00 1.22 0.11 0.74 -1.72 0.00 0.00 179.24 179.59 1fwh h THR 259 N 0.58 1.18 -0.72 0.35 2.02 -1.07 -0.22 112.91 115.02 1fwh h THR 259 Ca 0.03 -0.54 0.01 0.00 0.77 0.00 0.00 66.41 66.68 1fwh h THR 259 Cb 1.02 1.00 -0.04 0.00 -1.74 0.00 0.00 68.15 68.40 1fwh h THR 259 CO 0.10 0.18 0.47 -0.07 0.37 0.00 0.00 175.52 176.58 1fwh h LEU 260 N 0.31 0.84 -0.70 2.58 3.38 -1.03 -0.86 115.31 119.83 1fwh h LEU 260 Ca 0.09 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 1fwh h LEU 260 Cb 0.18 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1fwh h LEU 260 CO -0.01 0.61 0.08 0.00 0.09 0.00 0.00 178.44 179.21 1fwh h ALA 261 N 1.54 0.91 -0.53 1.53 0.00 -0.64 -2.44 119.26 119.64 1fwh h ALA 261 Ca 0.26 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1fwh h ALA 261 Cb -0.11 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 1fwh h ALA 261 CO -0.06 0.66 -0.01 0.00 0.00 0.00 0.00 179.25 179.84 1fwh h ALA 262 N 1.07 0.98 -0.42 0.00 0.00 0.04 -2.53 119.26 118.39 1fwh h ALA 262 Ca 0.20 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1fwh h ALA 262 Cb 0.47 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1fwh h ALA 262 CO 0.02 0.62 0.16 0.82 0.00 0.00 0.00 179.25 180.87 1fwh h ILE 263 N 0.84 1.16 -6.18 0.00 2.04 -0.89 -3.41 117.51 111.07 1fwh h ILE 263 Ca 0.15 -0.51 -0.44 0.00 1.00 0.00 0.00 64.86 65.06 1fwh h ILE 263 Cb 0.52 0.67 0.02 0.00 -0.74 0.00 0.00 36.82 37.29 1fwh h ILE 263 CO 0.03 0.20 -0.81 0.61 0.00 0.00 0.00 178.15 178.18 1fwh n GLY 264 N -1.16 -0.36 2.64 5.37 0.00 -0.95 -2.33 105.19 108.40 1fwh n GLY 264 Ca 0.03 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1fwh n GLY 264 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fwh n GLY 265 N -1.64 0.26 3.86 -0.02 0.00 -1.26 -5.00 105.19 101.38 1fwh n GLY 265 Ca -0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 1fwh n GLY 265 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fwh s ARG 266 N -1.00 3.93 0.28 1.61 0.52 -0.98 -4.79 118.95 118.52 1fwh s ARG 266 Ca 0.00 0.59 -0.30 0.00 -0.52 0.00 0.00 55.73 55.50 1fwh s ARG 266 Cb 0.00 -2.44 -0.11 0.00 0.52 0.00 0.00 34.95 32.92 1fwh s ARG 266 CO 0.00 0.13 1.58 0.99 0.02 0.00 0.00 175.30 178.02 1fwh s THR 267 N -2.06 2.16 -0.18 0.02 2.01 -1.26 -4.77 115.64 111.56 1fwh s THR 267 Ca 0.53 0.13 -0.26 0.00 0.31 0.00 0.00 61.69 62.40 1fwh s THR 267 Cb -0.10 -3.08 0.07 0.00 0.01 0.00 0.00 72.50 69.39 1fwh s THR 267 CO 0.21 0.02 0.67 -0.51 -0.69 0.00 0.00 174.62 174.32 1fwh s ILE 268 N 0.06 0.00 -0.38 1.82 2.07 -0.75 -4.70 121.20 119.32 1fwh s ILE 268 Ca 0.63 -0.01 -0.14 0.00 -1.41 0.00 0.00 60.65 59.72 1fwh s ILE 268 Cb -0.47 -0.96 0.01 0.00 0.13 0.00 0.00 42.46 41.16 1fwh s ILE 268 CO 0.46 -0.01 0.28 -2.28 -1.91 0.00 0.00 174.94 171.48 1fwh s HIS 269 N -0.23 3.24 -0.21 3.50 5.65 -0.35 -1.06 115.29 125.82 1fwh s HIS 269 Ca -0.04 -0.45 -0.22 0.00 0.25 0.00 0.00 55.06 54.60 1fwh s HIS 269 Cb -0.03 -2.54 -0.02 0.00 -1.18 0.00 0.00 32.58 28.80 1fwh s HIS 269 CO 0.04 -0.50 0.68 0.95 -0.65 0.00 0.00 174.74 175.26 1fwh s THR 270 N 1.70 4.98 0.45 0.89 -4.23 -0.69 -0.53 115.64 118.20 1fwh s THR 270 Ca 0.05 1.27 -0.21 0.00 -1.18 0.00 0.00 61.69 61.63 1fwh s THR 270 Cb -0.18 -3.99 -0.10 0.00 1.34 0.00 0.00 72.50 69.57 1fwh s THR 270 CO 0.10 0.07 0.98 -0.36 -0.54 0.00 0.00 174.62 174.87 1fwh s PHE 271 N 2.14 3.20 -0.59 3.99 0.08 -0.42 -2.24 117.98 124.14 1fwh s PHE 271 Ca 0.30 1.60 -0.17 0.00 0.12 0.00 0.00 56.93 58.78 1fwh s PHE 271 Cb -0.16 -2.93 0.02 0.00 -0.57 0.00 0.00 43.02 39.38 1fwh s PHE 271 CO 0.10 -0.38 0.33 -2.39 -0.10 0.00 0.00 175.22 172.78 1fwh n HIS 272 N -0.75 -0.66 0.23 0.36 1.44 -0.95 -4.75 115.22 110.15 1fwh n HIS 272 Ca 0.08 0.02 0.11 0.00 -2.01 0.00 0.00 57.72 55.92 1fwh n HIS 272 Cb 0.53 -1.33 0.60 0.00 0.12 0.00 0.00 29.99 29.91 1fwh n HIS 272 CO 0.00 0.00 0.00 1.15 -2.81 0.00 0.00 176.34 174.68 1fwh h THR 273 N 0.32 0.00 0.00 0.61 2.02 -1.20 -0.99 112.91 113.67 1fwh h THR 273 Ca -0.35 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 66.72 1fwh h THR 273 Cb 0.68 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.56 1fwh h THR 273 CO 0.25 0.00 -0.55 -0.08 0.37 0.00 0.00 175.52 175.51 1fwh h GLU 274 N 0.00 0.00 0.00 6.66 4.22 -1.85 -2.59 114.58 121.01 1fwh h GLU 274 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 1fwh h GLU 274 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1fwh h GLU 274 CO 0.00 0.55 0.00 0.41 -2.18 0.00 0.00 179.01 177.79 1fwh n GLY 275 N 0.32 1.59 0.35 1.92 0.00 -0.38 -4.52 105.19 104.46 1fwh n GLY 275 Ca -0.01 -0.19 0.06 0.00 0.00 0.00 0.00 46.02 45.88 1fwh n GLY 275 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fwh h ALA 276 N 0.00 1.41 0.00 4.61 0.00 -1.81 0.14 119.26 123.61 1fwh h ALA 276 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1fwh h ALA 276 Cb 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1fwh h ALA 276 CO 0.00 0.19 0.00 0.41 0.00 0.00 0.00 179.25 179.85 1fwh n GLY 277 N -1.34 -1.19 0.00 0.00 0.00 -1.26 -4.88 105.19 96.52 1fwh n GLY 277 Ca 0.17 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1fwh n GLY 277 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fwh n GLY 278 N 1.06 4.56 0.00 -0.02 0.00 0.04 -5.02 105.19 105.81 1fwh n GLY 278 Ca 0.13 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.94 1fwh n GLY 278 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fwh n GLY 279 N -1.72 3.93 2.81 -0.02 0.00 -1.24 -4.44 105.19 104.50 1fwh n GLY 279 Ca 0.00 -1.70 -0.51 0.00 0.00 0.00 0.00 46.02 43.81 1fwh n GLY 279 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1fwh n HIS 280 N -1.60 1.25 -3.09 1.61 8.25 -1.22 -4.10 115.22 116.32 1fwh n HIS 280 Ca 0.00 0.82 -0.40 0.00 -0.26 0.00 0.00 57.72 57.88 1fwh n HIS 280 Cb 0.00 -1.74 -0.05 0.00 1.12 0.00 0.00 29.99 29.32 1fwh n HIS 280 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1fwh s ALA 281 N 2.89 3.40 -0.37 -1.41 0.00 -1.14 -1.94 121.76 123.19 1fwh s ALA 281 Ca 0.84 0.01 0.13 0.00 0.00 0.00 0.00 51.96 52.94 1fwh s ALA 281 Cb -1.16 -2.93 0.33 0.00 0.00 0.00 0.00 23.12 19.36 1fwh s ALA 281 CO 0.61 -0.20 1.26 -0.35 0.00 0.00 0.00 175.76 177.07 1fwh n PRO 282 N 4.07 2.64 -0.90 0.00 -0.04 -1.26 -4.95 135.00 134.56 1fwh n PRO 282 Ca -0.02 -2.33 -0.08 0.00 -0.04 0.00 0.00 63.50 61.03 1fwh n PRO 282 Cb 0.51 -1.47 0.19 0.00 -0.04 0.00 0.00 33.50 32.69 1fwh n PRO 282 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1fwh n ASP 283 N -0.35 2.71 0.27 3.54 5.68 -1.10 -4.64 116.55 122.66 1fwh n ASP 283 Ca 0.14 -3.77 0.13 0.00 -0.50 0.00 0.00 54.79 50.78 1fwh n ASP 283 Cb 0.60 -0.67 0.74 0.00 -1.14 0.00 0.00 41.12 40.65 1fwh n ASP 283 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 1fwh h ILE 284 N 1.01 0.59 -0.10 2.12 6.09 -1.66 -2.67 117.51 122.89 1fwh h ILE 284 Ca 0.29 -0.47 0.03 0.00 -1.37 0.00 0.00 64.86 63.35 1fwh h ILE 284 Cb 1.84 1.30 -0.00 0.00 0.47 0.00 0.00 36.82 40.43 1fwh h ILE 284 CO 0.52 0.10 0.10 -0.29 -3.07 0.00 0.00 178.15 175.52 1fwh h ILE 285 N 0.00 0.59 0.00 2.19 2.10 -1.69 -1.98 117.51 118.72 1fwh h ILE 285 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 1fwh h ILE 285 Cb 0.29 0.92 0.00 0.00 -1.09 0.00 0.00 36.82 36.94 1fwh h ILE 285 CO 0.01 0.00 0.00 0.35 -1.08 0.00 0.00 178.15 177.43 1fwh n THR 286 N -3.97 1.58 0.24 2.19 -2.24 -1.01 -2.59 114.28 108.49 1fwh n THR 286 Ca -0.00 0.47 0.08 0.00 -2.27 0.00 0.00 64.05 62.32 1fwh n THR 286 Cb 0.21 -1.42 0.60 0.00 -2.10 0.00 0.00 70.33 67.62 1fwh n THR 286 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fwh h ALA 287 N 2.12 1.69 0.00 6.98 0.00 -1.59 -2.77 119.26 125.69 1fwh h ALA 287 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1fwh h ALA 287 Cb 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1fwh h ALA 287 CO 0.00 0.15 0.00 0.00 0.00 0.00 0.00 179.25 179.40 1fwh h ALA 289 N 2.33 0.65 -2.61 0.00 0.00 -1.70 -3.39 119.26 114.54 1fwh h ALA 289 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 1fwh h ALA 289 Cb 0.02 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 1fwh h ALA 289 CO 0.00 0.00 -0.02 -1.01 0.00 0.00 0.00 179.25 178.22 1fwh s HIS 290 N -3.26 3.68 0.34 0.00 3.76 -0.79 -4.67 115.29 114.35 1fwh s HIS 290 Ca 0.04 1.21 0.23 0.00 -0.15 0.00 0.00 55.06 56.39 1fwh s HIS 290 Cb 0.10 -2.48 1.14 0.00 1.11 0.00 0.00 32.58 32.46 1fwh s HIS 290 CO 0.73 0.45 1.95 -1.00 -0.85 0.00 0.00 174.74 176.03 1fwh h PRO 291 N 3.80 0.00 -0.09 8.40 0.13 -1.92 -3.09 132.00 139.23 1fwh h PRO 291 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1fwh h PRO 291 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1fwh h PRO 291 CO 0.65 0.21 0.00 0.27 -0.23 0.00 0.00 178.00 178.90 1fwh n ASN 292 N -3.70 2.24 -4.61 1.44 6.94 -1.26 -0.51 115.26 115.80 1fwh n ASN 292 Ca -0.01 -1.75 -0.36 0.00 -0.02 0.00 0.00 54.58 52.43 1fwh n ASN 292 Cb 0.32 -0.05 -0.10 0.00 -2.36 0.00 0.00 39.78 37.59 1fwh n ASN 292 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1fwh s ILE 293 N -1.90 4.95 -0.47 1.53 -1.09 -1.17 -1.81 121.20 121.24 1fwh s ILE 293 Ca 0.34 0.03 -0.09 0.00 -2.23 0.00 0.00 60.65 58.70 1fwh s ILE 293 Cb 0.20 -3.28 0.12 0.00 -1.58 0.00 0.00 42.46 37.92 1fwh s ILE 293 CO 0.31 0.38 0.34 -0.76 -1.23 0.00 0.00 174.94 173.98 1fwh s LEU 294 N 0.94 5.67 -0.04 2.97 1.43 -0.23 -4.41 118.68 125.02 1fwh s LEU 294 Ca 0.06 -1.91 -0.20 0.00 -1.03 0.00 0.00 54.13 51.04 1fwh s LEU 294 Cb -0.13 -2.00 -0.05 0.00 0.03 0.00 0.00 46.19 44.03 1fwh s LEU 294 CO 0.03 -0.69 0.59 -2.16 0.23 0.00 0.00 176.35 174.35 1fwh s PRO 295 N 1.36 4.33 0.21 1.29 0.04 -1.26 -1.70 135.00 139.27 1fwh s PRO 295 Ca 0.06 0.69 0.06 0.00 0.04 0.00 0.00 61.00 61.85 1fwh s PRO 295 Cb -0.26 -3.38 -0.05 0.00 0.04 0.00 0.00 34.50 30.85 1fwh s PRO 295 CO -0.01 0.28 -0.09 -1.54 0.04 0.00 0.00 177.00 175.68 1fwh s SER 296 N 0.13 2.31 0.23 6.66 1.04 -0.95 -1.44 113.70 121.67 1fwh s SER 296 Ca 0.31 -1.09 0.10 0.00 0.48 0.00 0.00 55.95 55.74 1fwh s SER 296 Cb -0.17 -0.09 -0.04 0.00 0.10 0.00 0.00 66.02 65.81 1fwh s SER 296 CO 0.16 -0.31 -0.09 -0.44 0.98 0.00 0.00 173.24 173.55 1fwh s SER 297 N -3.31 4.22 0.26 7.02 0.01 -0.66 -0.90 113.70 120.33 1fwh s SER 297 Ca 0.24 -0.69 0.06 0.00 1.31 0.00 0.00 55.95 56.87 1fwh s SER 297 Cb 0.02 -0.68 -0.03 0.00 0.21 0.00 0.00 66.02 65.54 1fwh s SER 297 CO 0.07 0.06 0.32 0.42 0.41 0.00 0.00 173.24 174.51 1fwh s THR 298 N -2.06 4.79 -0.45 1.44 -4.23 -1.26 -0.85 115.64 113.02 1fwh s THR 298 Ca 0.28 -1.14 0.23 0.00 -1.18 0.00 0.00 61.69 59.88 1fwh s THR 298 Cb -0.07 -3.63 0.24 0.00 1.34 0.00 0.00 72.50 70.37 1fwh s THR 298 CO 0.17 -0.31 1.49 -0.55 -0.54 0.00 0.00 174.62 174.88 1fwh h ASN 299 N 1.25 0.00 -0.00 3.99 7.08 -1.10 -3.37 115.58 123.42 1fwh h ASN 299 Ca -0.50 -0.02 0.00 0.00 -3.08 0.00 0.00 56.30 52.71 1fwh h ASN 299 Cb 1.24 0.00 -0.00 0.00 -2.08 0.00 0.00 38.32 37.48 1fwh h ASN 299 CO 0.60 0.01 0.01 1.55 -2.08 0.00 0.00 177.43 177.51 1fwh h PRO 300 N 0.00 0.00 -0.01 4.14 0.13 -1.82 -0.95 132.00 133.49 1fwh h PRO 300 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1fwh h PRO 300 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 1fwh h PRO 300 CO 0.00 0.00 -0.06 0.25 -0.23 0.00 0.00 178.00 177.96 1fwh n THR 301 N -3.49 0.00 -3.74 1.56 -2.24 -1.26 -4.82 114.28 100.29 1fwh n THR 301 Ca -0.03 -0.24 -0.38 0.00 -2.27 0.00 0.00 64.05 61.14 1fwh n THR 301 Cb 0.08 0.54 -0.12 0.00 -2.10 0.00 0.00 70.33 68.73 1fwh n THR 301 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1fwh s LEU 302 N -2.11 3.90 0.57 3.22 1.43 -0.36 -3.24 118.68 122.09 1fwh s LEU 302 Ca 0.34 -0.66 0.10 0.00 -1.03 0.00 0.00 54.13 52.88 1fwh s LEU 302 Cb 0.21 -1.91 0.08 0.00 0.03 0.00 0.00 46.19 44.60 1fwh s LEU 302 CO 0.38 -0.19 0.78 -2.16 0.23 0.00 0.00 176.35 175.38 1fwh s PRO 303 N 1.53 2.31 -0.04 1.29 0.04 -1.26 -4.83 135.00 134.03 1fwh s PRO 303 Ca 0.03 -1.65 -0.30 0.00 0.04 0.00 0.00 61.00 59.12 1fwh s PRO 303 Cb -0.17 -2.63 -0.06 0.00 0.04 0.00 0.00 34.50 31.68 1fwh s PRO 303 CO 0.03 -0.85 1.60 -0.47 0.04 0.00 0.00 177.00 177.36 1fwh s TYR 304 N -2.67 2.16 0.33 0.56 5.04 -1.20 -4.97 117.35 116.59 1fwh s TYR 304 Ca 0.61 0.32 0.03 0.00 -2.44 0.00 0.00 57.07 55.58 1fwh s TYR 304 Cb -0.06 -3.87 -0.05 0.00 0.35 0.00 0.00 41.96 38.33 1fwh s TYR 304 CO 0.38 -3.58 0.09 0.95 -1.34 0.00 0.00 175.55 172.05 1fwh s THR 305 N 3.71 0.81 0.53 4.34 -4.23 -1.26 -1.77 115.64 117.76 1fwh s THR 305 Ca 0.71 -2.00 0.19 0.00 -1.18 0.00 0.00 61.69 59.42 1fwh s THR 305 Cb -0.33 -2.62 0.31 0.00 1.34 0.00 0.00 72.50 71.20 1fwh s THR 305 CO 0.29 0.00 2.11 -0.07 -0.54 0.00 0.00 174.62 176.40 1fwh h LEU 306 N 2.11 0.00 -0.67 4.79 3.38 -1.09 -2.67 115.31 121.16 1fwh h LEU 306 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1fwh h LEU 306 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1fwh h LEU 306 CO 0.63 0.00 -0.53 0.59 0.09 0.00 0.00 178.44 179.21 1fwh n ASN 307 N -4.46 1.58 -0.06 -0.43 3.02 -1.26 -4.67 115.26 108.98 1fwh n ASN 307 Ca 0.01 -1.24 -0.10 0.00 -0.03 0.00 0.00 54.58 53.22 1fwh n ASN 307 Cb 0.25 0.50 -0.03 0.00 -0.61 0.00 0.00 39.78 39.88 1fwh n ASN 307 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 1fwh h THR 308 N 1.64 0.23 -0.54 3.41 2.02 -1.86 -2.14 112.91 115.67 1fwh h THR 308 Ca 0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 1fwh h THR 308 Cb 0.65 0.23 -0.02 0.00 -1.74 0.00 0.00 68.15 67.27 1fwh h THR 308 CO 0.00 0.00 0.18 0.40 0.37 0.00 0.00 175.52 176.47 1fwh h ILE 309 N -0.34 1.23 -0.30 3.11 1.08 -1.83 -0.82 117.51 119.64 1fwh h ILE 309 Ca 0.13 -0.76 -0.00 0.00 -0.39 0.00 0.00 64.86 63.84 1fwh h ILE 309 Cb 0.56 0.70 -0.01 0.00 -3.07 0.00 0.00 36.82 35.00 1fwh h ILE 309 CO -0.46 0.29 0.18 0.44 -0.69 0.00 0.00 178.15 177.91 1fwh h ASP 310 N 0.75 0.36 -0.29 1.72 5.19 -1.83 -0.59 116.42 121.73 1fwh h ASP 310 Ca 0.18 -0.05 -0.16 0.00 -0.62 0.00 0.00 57.03 56.38 1fwh h ASP 310 Cb 0.26 -0.09 -0.01 0.00 0.18 0.00 0.00 39.33 39.67 1fwh h ASP 310 CO -0.01 0.30 -0.43 1.05 -3.12 0.00 0.00 179.24 177.03 1fwh h GLU 311 N 0.38 0.85 -0.30 3.56 4.11 -1.31 -3.21 114.58 118.66 1fwh h GLU 311 Ca 0.11 -0.47 -0.04 0.00 0.07 0.00 0.00 59.36 59.03 1fwh h GLU 311 Cb 0.01 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1fwh h GLU 311 CO -0.02 1.11 0.03 0.45 0.07 0.00 0.00 179.01 180.65 1fwh h HIS 312 N 0.68 0.55 -0.82 2.06 3.86 -0.91 0.10 115.15 120.67 1fwh h HIS 312 Ca 0.05 -0.08 0.10 0.00 -1.16 0.00 0.00 60.37 59.27 1fwh h HIS 312 Cb 1.02 -0.15 -0.07 0.00 1.06 0.00 0.00 27.41 29.26 1fwh h HIS 312 CO 0.06 0.62 0.47 1.25 0.86 0.00 0.00 177.93 181.18 1fwh h LEU 313 N 0.33 0.66 0.00 2.43 7.12 -1.16 -0.24 115.31 124.45 1fwh h LEU 313 Ca 0.09 0.05 -0.21 0.00 0.13 0.00 0.00 57.88 57.94 1fwh h LEU 313 Cb 0.38 -0.07 -0.03 0.00 -0.53 0.00 0.00 40.66 40.41 1fwh h LEU 313 CO 0.01 0.37 -1.02 0.44 -0.13 0.00 0.00 178.44 178.11 1fwh h ASP 314 N 0.77 0.01 -0.19 1.25 5.19 -1.53 -2.78 116.42 119.14 1fwh h ASP 314 Ca 0.40 -0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.79 1fwh h ASP 314 Cb 0.39 -0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.89 1fwh h ASP 314 CO -0.26 1.01 0.07 -0.03 -3.12 0.00 0.00 179.24 176.91 1fwh h MET 315 N 0.00 0.30 -0.80 3.56 4.05 -0.20 -1.18 114.93 120.66 1fwh h MET 315 Ca -0.02 -0.06 -0.00 0.00 -0.28 0.00 0.00 59.70 59.34 1fwh h MET 315 Cb 1.78 -0.05 -0.04 0.00 -0.80 0.00 0.00 31.60 32.50 1fwh h MET 315 CO 0.13 0.38 0.49 1.25 0.23 0.00 0.00 176.91 179.39 1fwh h LEU 316 N 0.15 0.95 -0.20 3.39 7.12 -1.13 0.09 115.31 125.69 1fwh h LEU 316 Ca 0.06 -0.06 0.00 0.00 0.13 0.00 0.00 57.88 58.02 1fwh h LEU 316 Cb 0.21 -0.24 -0.01 0.00 -0.53 0.00 0.00 40.66 40.08 1fwh h LEU 316 CO -0.00 0.73 0.12 0.24 -0.13 0.00 0.00 178.44 179.40 1fwh h MET 317 N 1.09 0.24 -0.23 1.25 2.86 -1.23 -0.99 114.93 117.93 1fwh h MET 317 Ca 0.29 -0.01 -0.08 0.00 -2.06 0.00 0.00 59.70 57.84 1fwh h MET 317 Cb -0.05 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.55 1fwh h MET 317 CO -0.05 0.16 -0.15 0.28 1.06 0.00 0.00 176.91 178.20 1fwh h VAL 318 N 0.25 1.31 -0.77 -2.22 2.07 -0.92 -0.44 116.25 115.53 1fwh h VAL 318 Ca 0.07 -1.26 -0.02 0.00 0.82 0.00 0.00 66.70 66.31 1fwh h VAL 318 Cb -0.02 1.65 -0.04 0.00 -1.52 0.00 0.00 31.29 31.36 1fwh h VAL 318 CO -0.03 0.39 0.39 0.22 0.02 0.00 0.00 177.57 178.56 1fwh h TYR 319 N 0.20 1.08 -0.57 1.57 3.20 -0.88 -2.98 116.97 118.59 1fwh h TYR 319 Ca 0.05 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.88 1fwh h TYR 319 Cb 0.67 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 38.60 1fwh h TYR 319 CO 0.07 0.77 0.00 0.72 -1.64 0.00 0.00 178.16 178.08 1fwh n HIS 320 N -4.33 0.76 -3.76 -3.82 8.25 -0.38 -4.96 115.22 106.96 1fwh n HIS 320 Ca 0.08 -0.38 -0.25 0.00 -0.26 0.00 0.00 57.72 56.91 1fwh n HIS 320 Cb 0.12 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.27 1fwh n HIS 320 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1fwh n HIS 321 N 1.45 -2.19 -3.10 4.41 -0.00 -0.89 -4.97 115.22 109.93 1fwh n HIS 321 Ca 0.22 0.89 -0.38 0.00 -0.00 0.00 0.00 57.72 58.45 1fwh n HIS 321 Cb 0.58 -4.33 -0.06 0.00 -0.00 0.00 0.00 29.99 26.18 1fwh n HIS 321 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1fwh s LEU 322 N -6.98 4.45 -0.49 2.41 1.43 -0.22 -5.03 118.68 114.25 1fwh s LEU 322 Ca 0.33 1.45 -0.21 0.00 -1.03 0.00 0.00 54.13 54.67 1fwh s LEU 322 Cb -0.16 -3.37 0.04 0.00 0.03 0.00 0.00 46.19 42.73 1fwh s LEU 322 CO 0.81 0.13 0.73 -0.62 0.23 0.00 0.00 176.35 177.62 1fwh s ASP 323 N -1.41 6.30 0.55 2.29 -1.08 -1.26 -4.81 116.67 117.25 1fwh s ASP 323 Ca 0.38 -0.53 0.25 0.00 -0.52 0.00 0.00 52.55 52.13 1fwh s ASP 323 Cb -0.19 -2.34 1.46 0.00 -1.46 0.00 0.00 42.92 40.39 1fwh s ASP 323 CO 0.22 -0.95 2.05 1.55 0.52 0.00 0.00 175.17 178.56 1fwh h PRO 324 N 9.04 0.00 0.00 4.34 0.13 -1.96 -2.52 132.00 141.03 1fwh h PRO 324 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1fwh h PRO 324 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1fwh h PRO 324 CO 0.97 0.00 -0.52 -0.44 -0.23 0.00 0.00 178.00 177.79 1fwh h ASP 325 N 0.00 0.00 -2.96 1.44 3.32 -2.02 -3.44 116.42 112.76 1fwh h ASP 325 Ca 0.16 -0.16 -0.65 0.00 0.02 0.00 0.00 57.03 56.40 1fwh h ASP 325 Cb 0.70 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 40.09 1fwh h ASP 325 CO -0.00 0.08 0.34 -0.63 -1.72 0.00 0.00 179.24 177.31 1fwh s ILE 326 N -3.17 4.57 0.39 0.35 1.01 -0.95 -4.93 121.20 118.47 1fwh s ILE 326 Ca 0.07 -0.39 0.27 0.00 0.00 0.00 0.00 60.65 60.59 1fwh s ILE 326 Cb 0.13 -4.52 0.42 0.00 0.01 0.00 0.00 42.46 38.49 1fwh s ILE 326 CO 0.70 -1.17 1.46 0.00 0.00 0.00 0.00 174.94 175.94 1fwh n ALA 327 N 7.01 1.17 0.24 9.38 0.00 -1.26 -0.57 120.51 136.49 1fwh n ALA 327 Ca -0.05 0.86 0.09 0.00 0.00 0.00 0.00 53.44 54.35 1fwh n ALA 327 Cb 0.45 -0.98 0.62 0.00 0.00 0.00 0.00 19.45 19.55 1fwh n ALA 327 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1fwh h GLU 328 N 0.00 0.00 0.12 0.00 3.07 -1.93 -2.93 114.58 112.91 1fwh h GLU 328 Ca 0.81 0.00 -0.33 0.00 -0.50 0.00 0.00 59.36 59.34 1fwh h GLU 328 Cb 2.46 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 30.36 1fwh h GLU 328 CO -0.53 0.15 -1.76 -0.44 -1.40 0.00 0.00 179.01 175.03 1fwh h ASP 329 N 0.00 0.39 0.71 1.42 3.32 -1.11 -3.34 116.42 117.81 1fwh h ASP 329 Ca -0.00 -0.68 0.00 0.00 0.02 0.00 0.00 57.03 56.37 1fwh h ASP 329 Cb 0.32 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.74 1fwh h ASP 329 CO 0.02 1.59 0.00 1.33 -1.72 0.00 0.00 179.24 180.46 1fwh n VAL 330 N -3.43 0.71 0.07 -1.35 0.24 -1.19 -2.46 118.33 110.93 1fwh n VAL 330 Ca -0.23 0.16 -0.20 0.00 -2.04 0.00 0.00 64.34 62.02 1fwh n VAL 330 Cb 1.05 -0.88 -0.11 0.00 -1.47 0.00 0.00 33.84 32.44 1fwh n VAL 330 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1fwh h ALA 331 N 2.59 0.11 -0.02 2.33 0.00 -1.64 -1.35 119.26 121.28 1fwh h ALA 331 Ca 0.00 -0.74 -0.11 0.00 0.00 0.00 0.00 54.91 54.06 1fwh h ALA 331 Cb 0.35 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1fwh h ALA 331 CO 0.00 0.72 -0.51 0.35 0.00 0.00 0.00 179.25 179.82 1fwh h PHE 332 N 0.31 0.06 -0.29 0.00 3.57 -1.65 -2.01 116.94 116.92 1fwh h PHE 332 Ca -0.15 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.29 1fwh h PHE 332 Cb 1.79 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 40.51 1fwh h PHE 332 CO 0.10 0.55 0.03 0.00 -2.23 0.00 0.00 178.31 176.76 1fwh h ALA 333 N 1.45 0.39 -0.16 2.41 0.00 -1.22 -2.43 119.26 119.70 1fwh h ALA 333 Ca -0.00 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 1fwh h ALA 333 Cb 0.91 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1fwh h ALA 333 CO 0.07 0.10 -0.07 0.93 0.00 0.00 0.00 179.25 180.27 1fwh h GLU 334 N 0.31 0.24 -0.04 0.00 5.08 -0.98 -2.33 114.58 116.86 1fwh h GLU 334 Ca 0.09 -0.04 -0.15 0.00 -1.00 0.00 0.00 59.36 58.26 1fwh h GLU 334 Cb 0.37 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 1fwh h GLU 334 CO 0.01 0.33 -0.63 0.66 -1.00 0.00 0.00 179.01 178.37 1fwh h SER 335 N 0.23 0.18 0.19 1.42 4.64 -0.98 -3.34 113.55 115.90 1fwh h SER 335 Ca 0.05 -0.11 -0.30 0.00 -0.47 0.00 0.00 61.79 60.97 1fwh h SER 335 Cb 0.28 -0.05 0.02 0.00 -0.31 0.00 0.00 62.40 62.34 1fwh h SER 335 CO 0.01 0.77 -1.40 0.03 -0.87 0.00 0.00 176.83 175.37 1fwh h ARG 336 N 0.11 0.39 -4.50 4.77 3.08 -1.14 -3.43 114.38 113.66 1fwh h ARG 336 Ca -0.01 -0.67 -0.72 0.00 0.07 0.00 0.00 59.98 58.64 1fwh h ARG 336 Cb 1.14 0.25 -0.21 0.00 0.08 0.00 0.00 29.97 31.23 1fwh h ARG 336 CO 0.09 1.32 -0.17 0.42 -1.07 0.00 0.00 179.97 180.57 1fwh s ILE 337 N -2.53 5.09 -0.15 2.04 1.01 -0.90 -3.90 121.20 121.85 1fwh s ILE 337 Ca -0.14 -0.94 0.01 0.00 0.00 0.00 0.00 60.65 59.58 1fwh s ILE 337 Cb 0.04 -4.23 0.02 0.00 0.01 0.00 0.00 42.46 38.30 1fwh s ILE 337 CO 0.86 -0.73 -0.16 -0.13 0.00 0.00 0.00 174.94 174.79 1fwh s ARG 338 N 2.01 2.52 0.33 2.79 0.52 -1.26 -4.79 118.95 121.07 1fwh s ARG 338 Ca 0.08 -0.65 0.05 0.00 -0.52 0.00 0.00 55.73 54.69 1fwh s ARG 338 Cb -0.23 -2.24 0.69 0.00 0.52 0.00 0.00 34.95 33.68 1fwh s ARG 338 CO 0.08 -0.21 1.88 -0.09 0.02 0.00 0.00 175.30 176.98 1fwh h ARG 339 N 7.96 0.82 -0.34 3.54 2.43 -1.96 -1.25 114.38 125.59 1fwh h ARG 339 Ca -0.40 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 58.74 1fwh h ARG 339 Cb 1.14 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 30.48 1fwh h ARG 339 CO 0.56 0.54 0.19 0.93 -1.51 0.00 0.00 179.97 180.68 1fwh h GLU 340 N 0.84 0.38 0.06 0.20 3.07 -1.92 -1.12 114.58 116.09 1fwh h GLU 340 Ca 0.43 -0.02 -0.24 0.00 -0.50 0.00 0.00 59.36 59.03 1fwh h GLU 340 Cb 0.50 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.30 1fwh h GLU 340 CO -0.19 0.25 -1.12 1.79 -1.40 0.00 0.00 179.01 178.34 1fwh h THR 341 N 0.39 1.60 -0.74 1.13 1.35 -1.66 -3.08 112.91 111.91 1fwh h THR 341 Ca 0.13 -3.25 -0.06 0.00 -0.55 0.00 0.00 66.41 62.68 1fwh h THR 341 Cb 0.01 2.88 -0.03 0.00 -1.73 0.00 0.00 68.15 69.28 1fwh h THR 341 CO -0.07 0.93 0.24 0.40 -0.25 0.00 0.00 175.52 176.78 1fwh h ILE 342 N 0.03 1.26 -0.20 6.82 2.04 -1.06 -1.88 117.51 124.53 1fwh h ILE 342 Ca -0.07 -0.90 -0.19 0.00 1.00 0.00 0.00 64.86 64.70 1fwh h ILE 342 Cb 1.86 0.45 0.00 0.00 -0.74 0.00 0.00 36.82 38.39 1fwh h ILE 342 CO 0.16 0.35 -0.64 0.00 0.00 0.00 0.00 178.15 178.03 1fwh h ALA 343 N 1.12 0.49 -0.49 1.87 0.00 -1.30 -3.26 119.26 117.68 1fwh h ALA 343 Ca 0.24 -0.55 -0.08 0.00 0.00 0.00 0.00 54.91 54.51 1fwh h ALA 343 Cb 0.30 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1fwh h ALA 343 CO -0.01 0.69 -0.03 0.00 0.00 0.00 0.00 179.25 179.90 1fwh h ALA 344 N 0.75 1.01 -0.97 0.00 0.00 -1.43 -3.11 119.26 115.50 1fwh h ALA 344 Ca -0.01 -0.29 0.18 0.00 0.00 0.00 0.00 54.91 54.79 1fwh h ALA 344 Cb 1.23 -0.19 -0.09 0.00 0.00 0.00 0.00 17.79 18.74 1fwh h ALA 344 CO 0.13 0.60 0.61 1.49 0.00 0.00 0.00 179.25 182.09 1fwh h GLU 345 N 0.78 0.68 -0.28 0.00 4.81 -1.38 -0.21 114.58 118.97 1fwh h GLU 345 Ca 0.14 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.32 1fwh h GLU 345 Cb 0.52 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 1fwh h GLU 345 CO 0.03 0.45 0.13 -0.44 -0.73 0.00 0.00 179.01 178.45 1fwh h ASP 346 N 0.70 0.38 -0.46 1.04 5.19 -1.68 -1.93 116.42 119.65 1fwh h ASP 346 Ca 0.53 -0.14 -0.04 0.00 -0.62 0.00 0.00 57.03 56.76 1fwh h ASP 346 Cb 0.91 -0.10 -0.02 0.00 0.18 0.00 0.00 39.33 40.31 1fwh h ASP 346 CO -0.30 0.41 0.12 0.58 -3.12 0.00 0.00 179.24 176.92 1fwh h VAL 347 N 0.32 1.23 0.00 -1.35 2.07 -1.35 -2.08 116.25 115.09 1fwh h VAL 347 Ca 0.10 -0.81 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 1fwh h VAL 347 Cb 0.14 0.88 -0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1fwh h VAL 347 CO -0.01 0.29 -0.03 -0.07 0.02 0.00 0.00 177.57 177.76 1fwh h LEU 348 N 0.61 0.00 -0.14 2.57 3.38 -0.90 0.40 115.31 121.24 1fwh h LEU 348 Ca 0.15 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.89 1fwh h LEU 348 Cb 0.31 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.07 1fwh h LEU 348 CO 0.00 0.03 -0.81 0.45 0.09 0.00 0.00 178.44 178.21 1fwh h HIS 349 N 0.00 1.08 -0.13 1.13 3.86 -0.86 0.21 115.15 120.45 1fwh h HIS 349 Ca -0.00 -0.49 -0.07 0.00 -1.16 0.00 0.00 60.37 58.65 1fwh h HIS 349 Cb 0.06 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.36 1fwh h HIS 349 CO 0.00 1.32 -0.23 0.22 0.86 0.00 0.00 177.93 180.11 1fwh h ASP 350 N 0.52 0.21 1.18 2.45 3.58 -0.39 -2.08 116.42 121.89 1fwh h ASP 350 Ca -0.06 -0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.33 1fwh h ASP 350 Cb 1.44 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 42.43 1fwh h ASP 350 CO 0.17 0.45 -0.31 0.18 -2.88 0.00 0.00 179.24 176.84 1fwh n LEU 351 N -4.19 0.77 0.00 2.28 4.77 -0.05 -4.95 117.00 115.63 1fwh n LEU 351 Ca -0.01 0.40 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 1fwh n LEU 351 Cb 0.34 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 1fwh n LEU 351 CO 0.39 -0.12 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 1fwh n GLY 352 N 1.32 0.70 0.08 -0.72 0.00 -0.78 -4.70 105.19 101.09 1fwh n GLY 352 Ca 0.04 -0.36 -0.05 0.00 0.00 0.00 0.00 46.02 45.65 1fwh n GLY 352 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fwh h ALA 353 N 0.00 0.46 -3.22 4.61 0.00 -0.80 -2.77 119.26 117.53 1fwh h ALA 353 Ca 0.00 -0.80 -0.63 0.00 0.00 0.00 0.00 54.91 53.48 1fwh h ALA 353 Cb 0.00 -0.14 -0.15 0.00 0.00 0.00 0.00 17.79 17.50 1fwh h ALA 353 CO 0.00 1.10 -0.57 -0.06 0.00 0.00 0.00 179.25 179.72 1fwh s PHE 354 N -2.84 3.26 -0.59 0.00 0.40 -1.08 -4.83 117.98 112.29 1fwh s PHE 354 Ca 0.01 0.12 0.14 0.00 -0.60 0.00 0.00 56.93 56.60 1fwh s PHE 354 Cb 0.10 -2.01 -0.16 0.00 0.51 0.00 0.00 43.02 41.46 1fwh s PHE 354 CO 0.80 0.26 0.56 0.43 0.70 0.00 0.00 175.22 177.97 1fwh n SER 355 N 3.14 0.76 -4.05 1.36 7.64 -0.52 -4.69 113.62 117.26 1fwh n SER 355 Ca -0.17 -0.75 -0.08 0.00 1.01 0.00 0.00 58.87 58.88 1fwh n SER 355 Cb 0.53 1.07 -0.10 0.00 -1.01 0.00 0.00 64.21 64.69 1fwh n SER 355 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1fwh s LEU 356 N -2.79 2.39 0.05 -3.43 1.02 -1.07 -4.28 118.68 110.56 1fwh s LEU 356 Ca 0.04 -0.80 0.07 0.00 0.02 0.00 0.00 54.13 53.46 1fwh s LEU 356 Cb 0.10 0.15 -0.03 0.00 0.02 0.00 0.00 46.19 46.44 1fwh s LEU 356 CO 0.57 -0.48 -0.20 0.42 0.02 0.00 0.00 176.35 176.69 1fwh s THR 357 N -2.94 1.59 0.33 5.49 -4.23 -0.87 -1.65 115.64 113.37 1fwh s THR 357 Ca -0.02 -1.19 -0.07 0.00 -1.18 0.00 0.00 61.69 59.23 1fwh s THR 357 Cb 0.01 -1.39 0.01 0.00 1.34 0.00 0.00 72.50 72.46 1fwh s THR 357 CO -0.06 0.16 0.52 -0.94 -0.54 0.00 0.00 174.62 173.76 1fwh s SER 358 N -1.21 0.56 -0.07 3.99 1.04 -0.03 -4.71 113.70 113.27 1fwh s SER 358 Ca 0.07 -1.32 -0.05 0.00 0.48 0.00 0.00 55.95 55.13 1fwh s SER 358 Cb -0.09 0.67 -0.02 0.00 0.10 0.00 0.00 66.02 66.69 1fwh s SER 358 CO 0.02 -1.32 -0.10 -1.54 0.98 0.00 0.00 173.24 171.28 1fwh n SER 359 N -1.19 0.83 -0.52 7.02 3.41 -1.26 -1.52 113.62 120.40 1fwh n SER 359 Ca -0.01 0.37 0.00 0.00 -0.26 0.00 0.00 58.87 58.97 1fwh n SER 359 Cb 0.61 -0.66 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 1fwh n SER 359 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1fwh n ASP 360 N -3.34 -1.05 -4.61 4.04 -0.08 -0.76 -2.81 116.55 107.92 1fwh n ASP 360 Ca -0.04 0.00 -0.66 0.00 -1.51 0.00 0.00 54.79 52.59 1fwh n ASP 360 Cb 0.14 -0.26 -0.10 0.00 2.34 0.00 0.00 41.12 43.23 1fwh n ASP 360 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1fwh n SER 361 N -0.50 1.12 -2.06 1.67 3.41 -1.17 -1.78 113.62 114.31 1fwh n SER 361 Ca 0.00 1.05 -0.15 0.00 -0.26 0.00 0.00 58.87 59.51 1fwh n SER 361 Cb 0.26 -0.89 -0.03 0.00 -0.26 0.00 0.00 64.21 63.29 1fwh n SER 361 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fwh n GLN 362 N 4.98 -1.78 -2.72 4.33 6.02 -0.79 -4.16 117.38 123.26 1fwh n GLN 362 Ca 0.37 0.80 -0.05 0.00 -0.01 0.00 0.00 57.00 58.11 1fwh n GLN 362 Cb -0.05 -5.29 0.06 0.00 1.02 0.00 0.00 30.24 25.98 1fwh n GLN 362 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1fwh n ALA 363 N -1.07 2.74 -1.01 -1.58 0.00 -0.73 -4.89 120.51 113.97 1fwh n ALA 363 Ca -0.17 -2.44 0.00 0.00 0.00 0.00 0.00 53.44 50.83 1fwh n ALA 363 Cb 0.59 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 19.12 1fwh n ALA 363 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1fwh n MET 364 N -0.51 0.00 -3.60 0.00 2.81 -1.24 -4.97 117.12 109.61 1fwh n MET 364 Ca 0.03 0.00 -0.07 0.00 -1.81 0.00 0.00 57.70 55.85 1fwh n MET 364 Cb 0.83 -1.26 -0.04 0.00 -0.71 0.00 0.00 33.22 32.03 1fwh n MET 364 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1fwh s GLY 365 N -2.01 -0.15 -0.33 3.03 0.00 -0.98 -4.41 107.32 102.47 1fwh s GLY 365 Ca 0.00 2.25 -0.06 0.00 0.00 0.00 0.00 44.72 46.91 1fwh s GLY 365 CO 0.00 1.00 0.10 0.50 0.00 0.00 0.00 173.10 174.70 1fwh s ARG 366 N -1.24 2.67 0.47 2.90 0.52 -1.26 -1.88 118.95 121.13 1fwh s ARG 366 Ca 0.03 -1.14 0.17 0.00 -0.52 0.00 0.00 55.73 54.27 1fwh s ARG 366 Cb -0.01 -3.44 1.16 0.00 0.52 0.00 0.00 34.95 33.18 1fwh s ARG 366 CO -0.03 -0.64 2.00 -0.24 0.02 0.00 0.00 175.30 176.42 1fwh h VAL 367 N 6.14 0.86 -0.59 3.52 3.04 -1.91 -1.77 116.25 125.55 1fwh h VAL 367 Ca -0.24 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 65.36 1fwh h VAL 367 Cb 1.09 0.59 0.00 0.00 -2.01 0.00 0.00 31.29 30.95 1fwh h VAL 367 CO 0.60 0.05 0.00 0.61 -1.01 0.00 0.00 177.57 177.82 1fwh n GLY 368 N -1.56 2.12 0.34 3.17 0.00 -1.26 -4.33 105.19 103.67 1fwh n GLY 368 Ca 0.09 -0.70 0.08 0.00 0.00 0.00 0.00 46.02 45.48 1fwh n GLY 368 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1fwh n GLU 369 N 1.12 1.20 -0.02 1.61 1.02 -0.66 -4.78 120.64 120.13 1fwh n GLU 369 Ca 0.21 -2.64 -0.13 0.00 -0.02 0.00 0.00 57.16 54.58 1fwh n GLU 369 Cb 0.65 -1.38 -0.09 0.00 -0.02 0.00 0.00 31.44 30.60 1fwh n GLU 369 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1fwh h VAL 370 N 1.26 1.37 0.17 2.62 2.07 -1.75 -2.43 116.25 119.56 1fwh h VAL 370 Ca -0.01 -1.17 -0.01 0.00 0.82 0.00 0.00 66.70 66.33 1fwh h VAL 370 Cb 1.08 2.08 0.00 0.00 -1.52 0.00 0.00 31.29 32.93 1fwh h VAL 370 CO 0.00 0.31 -0.08 0.40 0.02 0.00 0.00 177.57 178.23 1fwh h ILE 371 N -0.37 0.95 -0.50 4.57 2.04 -1.89 -2.70 117.51 119.61 1fwh h ILE 371 Ca 0.01 -0.83 0.10 0.00 1.00 0.00 0.00 64.86 65.14 1fwh h ILE 371 Cb 0.52 1.43 -0.10 0.00 -0.74 0.00 0.00 36.82 37.93 1fwh h ILE 371 CO 0.01 0.18 -0.16 0.25 0.00 0.00 0.00 178.15 178.43 1fwh h LEU 372 N -0.65 -0.58 -0.93 1.44 6.46 -1.67 -1.89 115.31 117.49 1fwh h LEU 372 Ca -0.02 0.16 -0.11 0.00 -0.12 0.00 0.00 57.88 57.79 1fwh h LEU 372 Cb 0.48 0.35 -0.01 0.00 -0.73 0.00 0.00 40.66 40.75 1fwh h LEU 372 CO 0.04 -0.20 -0.38 0.03 -0.62 0.00 0.00 178.44 177.31 1fwh h ARG 373 N -0.04 0.31 -0.96 1.25 3.08 -1.50 -2.35 114.38 114.17 1fwh h ARG 373 Ca 0.24 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 60.15 1fwh h ARG 373 Cb 0.41 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.41 1fwh h ARG 373 CO -0.54 0.65 0.59 1.15 -1.07 0.00 0.00 179.97 180.75 1fwh h THR 374 N 0.26 1.26 0.00 2.04 2.02 -1.00 -1.82 112.91 115.66 1fwh h THR 374 Ca 0.03 -0.55 -0.15 0.00 0.77 0.00 0.00 66.41 66.51 1fwh h THR 374 Cb 0.79 -0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1fwh h THR 374 CO 0.06 0.27 -0.73 -0.50 0.37 0.00 0.00 175.52 174.99 1fwh h TRP 375 N 1.32 0.00 -0.48 3.16 4.06 -1.25 -2.76 115.95 119.99 1fwh h TRP 375 Ca 0.34 0.00 -0.09 0.00 2.06 0.00 0.00 58.89 61.20 1fwh h TRP 375 Cb -0.07 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.07 1fwh h TRP 375 CO 0.00 0.73 -0.07 1.96 -3.56 0.00 0.00 178.44 177.51 1fwh h GLN 376 N 0.00 0.85 -0.08 0.49 4.20 -0.92 -1.01 115.11 118.63 1fwh h GLN 376 Ca -0.01 -0.27 -0.01 0.00 0.06 0.00 0.00 58.65 58.43 1fwh h GLN 376 Cb 1.34 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 29.04 1fwh h GLN 376 CO 0.10 0.89 0.03 0.28 -0.67 0.00 0.00 178.83 179.45 1fwh h VAL 377 N 0.77 1.16 -0.91 -0.54 2.07 -1.24 -0.83 116.25 116.74 1fwh h VAL 377 Ca 0.14 -0.49 0.07 0.00 0.82 0.00 0.00 66.70 67.23 1fwh h VAL 377 Cb 0.56 1.35 -0.07 0.00 -1.52 0.00 0.00 31.29 31.62 1fwh h VAL 377 CO 0.03 0.14 0.57 0.00 0.02 0.00 0.00 177.57 178.33 1fwh h ALA 378 N 0.84 1.27 0.21 1.67 0.00 -1.27 0.16 119.26 122.14 1fwh h ALA 378 Ca 0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1fwh h ALA 378 Cb 0.20 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1fwh h ALA 378 CO -0.00 0.30 -0.10 1.25 0.00 0.00 0.00 179.25 180.70 1fwh h HIS 379 N 1.01 -0.26 -0.47 0.00 6.17 -1.00 -0.86 115.15 119.75 1fwh h HIS 379 Ca 0.40 -0.01 -0.00 0.00 0.71 0.00 0.00 60.37 61.48 1fwh h HIS 379 Cb 0.22 0.09 -0.02 0.00 2.52 0.00 0.00 27.41 30.21 1fwh h HIS 379 CO -0.02 -0.07 0.28 0.00 0.71 0.00 0.00 177.93 178.83 1fwh h ARG 380 N -0.40 0.63 -0.02 5.26 2.47 -0.48 -1.31 114.38 120.53 1fwh h ARG 380 Ca -0.03 -0.05 -0.19 0.00 -1.26 0.00 0.00 59.98 58.45 1fwh h ARG 380 Cb 0.31 -0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 28.48 1fwh h ARG 380 CO 0.05 0.44 -0.82 0.52 0.56 0.00 0.00 179.97 180.71 1fwh h MET 381 N 0.64 0.27 -0.17 0.04 2.86 -0.55 -1.94 114.93 116.09 1fwh h MET 381 Ca 0.17 -0.26 -0.03 0.00 -2.06 0.00 0.00 59.70 57.51 1fwh h MET 381 Cb -0.02 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 1fwh h MET 381 CO -0.03 0.95 -0.02 -0.22 1.06 0.00 0.00 176.91 178.65 1fwh h LYS 382 N 0.16 0.32 -0.88 1.72 3.64 -0.55 0.40 116.57 121.38 1fwh h LYS 382 Ca -0.04 -0.11 0.05 0.00 -1.27 0.00 0.00 60.65 59.27 1fwh h LYS 382 Cb 1.43 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 33.17 1fwh h LYS 382 CO 0.13 0.56 0.56 0.28 -2.27 0.00 0.00 179.45 178.71 1fwh h VAL 383 N 0.04 1.10 0.15 2.00 2.07 -1.25 0.11 116.25 120.47 1fwh h VAL 383 Ca 0.05 -0.36 -0.35 0.00 0.82 0.00 0.00 66.70 66.86 1fwh h VAL 383 Cb 0.44 -0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 30.15 1fwh h VAL 383 CO 0.01 0.19 -1.80 1.56 0.02 0.00 0.00 177.57 177.55 1fwh h GLN 384 N 1.05 0.32 -0.00 1.57 4.20 -1.24 -3.41 115.11 117.60 1fwh h GLN 384 Ca 0.37 -0.54 0.00 0.00 0.06 0.00 0.00 58.65 58.53 1fwh h GLN 384 Cb 0.08 0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.07 1fwh h GLN 384 CO -0.14 1.22 -0.51 0.54 -0.67 0.00 0.00 178.83 179.27 1fwh n ARG 385 N -3.51 2.52 0.00 1.46 1.74 0.14 -5.08 116.66 113.92 1fwh n ARG 385 Ca -0.26 -0.20 0.00 0.00 -0.77 0.00 0.00 57.85 56.62 1fwh n ARG 385 Cb 1.06 -1.13 0.00 0.00 -1.02 0.00 0.00 32.46 31.37 1fwh n ARG 385 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1fwh n GLY 386 N 1.23 -0.90 3.77 -0.13 0.00 0.37 -4.86 105.19 104.67 1fwh n GLY 386 Ca 0.03 -1.19 -0.38 0.00 0.00 0.00 0.00 46.02 44.49 1fwh n GLY 386 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fwh s ALA 387 N -1.13 3.10 0.61 4.61 0.00 -1.26 -4.56 121.76 123.13 1fwh s ALA 387 Ca 0.00 0.89 -0.14 0.00 0.00 0.00 0.00 51.96 52.70 1fwh s ALA 387 Cb 0.00 -3.35 -0.03 0.00 0.00 0.00 0.00 23.12 19.74 1fwh s ALA 387 CO 0.00 -0.47 1.05 -0.51 0.00 0.00 0.00 175.76 175.83 1fwh s LEU 388 N -2.63 3.41 0.62 0.00 1.43 -1.26 -4.92 118.68 115.34 1fwh s LEU 388 Ca 0.58 1.71 0.38 0.00 -1.03 0.00 0.00 54.13 55.77 1fwh s LEU 388 Cb -0.28 -4.52 2.10 0.00 0.03 0.00 0.00 46.19 43.52 1fwh s LEU 388 CO 0.35 -1.14 2.29 0.00 0.23 0.00 0.00 176.35 178.09 1fwh h ALA 389 N 0.19 1.21 0.00 4.21 0.00 -1.99 -2.05 119.26 120.84 1fwh h ALA 389 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1fwh h ALA 389 Cb 1.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1fwh h ALA 389 CO 0.58 0.01 -0.36 0.39 0.00 0.00 0.00 179.25 179.87 1fwh n GLU 390 N -3.41 0.01 -1.93 0.00 4.71 -1.26 -4.93 120.64 113.84 1fwh n GLU 390 Ca -0.03 0.01 -0.37 0.00 -0.01 0.00 0.00 57.16 56.75 1fwh n GLU 390 Cb 0.10 -1.51 0.03 0.00 -1.01 0.00 0.00 31.44 29.05 1fwh n GLU 390 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 1fwh s GLU 391 N -3.01 3.15 -0.00 3.49 0.41 -0.77 -4.93 118.70 117.04 1fwh s GLU 391 Ca 0.12 2.03 0.01 0.00 -0.41 0.00 0.00 54.97 56.72 1fwh s GLU 391 Cb 0.18 -2.16 -0.00 0.00 -1.78 0.00 0.00 34.13 30.36 1fwh s GLU 391 CO 0.65 -1.12 -0.04 -0.08 -0.49 0.00 0.00 175.26 174.19 1fwh s THR 392 N -1.43 0.32 0.07 3.63 -1.32 -1.26 -5.00 115.64 110.66 1fwh s THR 392 Ca 0.73 -0.20 0.00 0.00 -1.21 0.00 0.00 61.69 61.00 1fwh s THR 392 Cb -0.35 -0.28 0.00 0.00 -1.51 0.00 0.00 72.50 70.35 1fwh s THR 392 CO 0.41 0.07 0.00 0.61 -2.21 0.00 0.00 174.62 173.50 1fwh n GLY 393 N 2.92 -1.82 2.84 6.08 0.00 -1.26 -4.47 105.19 109.48 1fwh n GLY 393 Ca -0.13 -1.45 -0.42 0.00 0.00 0.00 0.00 46.02 44.02 1fwh n GLY 393 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1fwh n ASP 394 N -2.37 6.20 -3.13 1.61 2.03 -1.26 -4.90 116.55 114.73 1fwh n ASP 394 Ca -0.00 -3.28 -0.10 0.00 0.52 0.00 0.00 54.79 51.92 1fwh n ASP 394 Cb 0.11 -1.36 0.00 0.00 -0.72 0.00 0.00 41.12 39.16 1fwh n ASP 394 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1fwh s ASN 395 N -0.40 0.20 -0.23 1.67 6.03 -1.26 -5.01 114.94 115.94 1fwh s ASN 395 Ca 0.38 -1.17 0.14 0.00 -1.03 0.00 0.00 52.86 51.18 1fwh s ASN 395 Cb 0.10 0.79 0.51 0.00 -3.03 0.00 0.00 41.25 39.61 1fwh s ASN 395 CO 0.02 -1.55 1.43 0.47 -2.03 0.00 0.00 177.10 175.44 1fwh n ASP 396 N -1.28 3.20 -0.21 3.54 8.00 -0.36 -4.78 116.55 124.66 1fwh n ASP 396 Ca -0.06 -3.34 -0.00 0.00 0.71 0.00 0.00 54.79 52.10 1fwh n ASP 396 Cb 0.60 -0.58 0.07 0.00 -0.02 0.00 0.00 41.12 41.20 1fwh n ASP 396 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 1fwh h ASN 397 N 1.33 -0.50 -0.61 -2.24 4.21 -1.91 -0.47 115.58 115.39 1fwh h ASN 397 Ca 0.10 0.18 -0.08 0.00 1.21 0.00 0.00 56.30 57.71 1fwh h ASN 397 Cb 1.53 0.36 -0.02 0.00 -1.12 0.00 0.00 38.32 39.06 1fwh h ASN 397 CO 0.29 -0.19 0.07 0.15 -1.29 0.00 0.00 177.43 176.47 1fwh h PHE 398 N 0.03 1.10 -0.79 1.19 3.04 -1.92 -1.25 116.94 118.33 1fwh h PHE 398 Ca 0.31 -0.16 -0.04 0.00 3.98 0.00 0.00 57.97 62.05 1fwh h PHE 398 Cb 0.48 -0.30 -0.04 0.00 2.56 0.00 0.00 35.95 38.65 1fwh h PHE 398 CO -0.47 0.95 0.35 -0.09 -2.02 0.00 0.00 178.31 177.03 1fwh h ARG 399 N 0.93 1.16 -0.70 1.11 2.43 -1.76 -0.78 114.38 116.77 1fwh h ARG 399 Ca 0.18 -0.19 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 1fwh h ARG 399 Cb 0.46 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.78 1fwh h ARG 399 CO 0.02 0.91 0.30 0.28 -1.51 0.00 0.00 179.97 179.97 1fwh h VAL 400 N 1.14 1.24 -0.48 0.20 2.07 -0.72 -1.66 116.25 118.04 1fwh h VAL 400 Ca 0.27 -0.74 -0.11 0.00 0.82 0.00 0.00 66.70 66.95 1fwh h VAL 400 Cb 0.16 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 1fwh h VAL 400 CO -0.03 0.30 -0.13 0.11 0.02 0.00 0.00 177.57 177.84 1fwh h LYS 401 N 0.99 0.90 -0.47 1.57 1.57 -0.73 -1.13 116.57 119.27 1fwh h LYS 401 Ca 0.24 -0.32 -0.04 0.00 -1.87 0.00 0.00 60.65 58.65 1fwh h LYS 401 Cb 0.18 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 1fwh h LYS 401 CO -0.02 0.97 0.14 -0.09 -0.57 0.00 0.00 179.45 179.88 1fwh h ARG 402 N 0.80 0.74 -0.01 3.15 2.43 -0.86 -3.00 114.38 117.63 1fwh h ARG 402 Ca 0.13 -0.16 -0.23 0.00 -0.81 0.00 0.00 59.98 58.91 1fwh h ARG 402 Cb 0.65 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 1fwh h ARG 402 CO 0.05 0.71 -0.94 1.88 -1.51 0.00 0.00 179.97 180.16 1fwh h TYR 403 N 0.63 0.67 0.00 2.20 -1.99 -1.19 -3.23 116.97 114.06 1fwh h TYR 403 Ca 0.15 -0.36 -0.07 0.00 2.00 0.00 0.00 58.73 60.45 1fwh h TYR 403 Cb 0.28 -0.08 -0.01 0.00 2.00 0.00 0.00 36.73 38.92 1fwh h TYR 403 CO 0.01 1.18 -0.33 0.97 -0.00 0.00 0.00 178.16 179.99 1fwh h ILE 404 N 0.26 1.09 0.00 -2.88 2.10 -1.26 -2.15 117.51 114.67 1fwh h ILE 404 Ca -0.08 -1.19 -0.03 0.00 1.08 0.00 0.00 64.86 64.64 1fwh h ILE 404 Cb 1.57 1.67 -0.00 0.00 -1.09 0.00 0.00 36.82 38.96 1fwh h ILE 404 CO 0.17 0.32 -0.13 0.00 -1.08 0.00 0.00 178.15 177.43 1fwh h ALA 405 N 1.67 1.22 0.00 0.18 0.00 -1.54 -2.83 119.26 117.95 1fwh h ALA 405 Ca -0.00 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1fwh h ALA 405 Cb 0.64 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1fwh h ALA 405 CO 0.04 0.16 -0.18 0.87 0.00 0.00 0.00 179.25 180.15 1fwh h LYS 406 N 0.00 0.00 0.00 0.00 1.57 -1.45 -2.11 116.57 114.57 1fwh h LYS 406 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1fwh h LYS 406 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.71 1fwh h LYS 406 CO 0.02 0.18 -0.01 2.48 -0.57 0.00 0.00 179.45 181.54 1fwh n TYR 407 N -4.00 0.00 0.00 -1.35 0.18 -1.08 -2.04 117.16 108.87 1fwh n TYR 407 Ca -0.02 -0.62 0.00 0.00 1.88 0.00 0.00 57.90 59.14 1fwh n TYR 407 Cb 0.26 -0.08 0.00 0.00 -0.38 0.00 0.00 39.34 39.14 1fwh n TYR 407 CO 0.00 0.00 0.00 0.25 -2.08 0.00 0.00 176.86 175.03 1fwh n THR 408 N -0.77 0.00 -0.18 -3.48 -2.24 -1.14 -0.26 114.28 106.22 1fwh n THR 408 Ca 0.05 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.73 1fwh n THR 408 Cb 0.40 -0.11 0.01 0.00 -2.10 0.00 0.00 70.33 68.53 1fwh n THR 408 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 1fwh h ILE 409 N 0.00 1.27 -0.41 2.28 6.09 -1.39 -3.12 117.51 122.22 1fwh h ILE 409 Ca 0.00 -1.18 -0.02 0.00 -1.37 0.00 0.00 64.86 62.29 1fwh h ILE 409 Cb 0.00 0.99 -0.02 0.00 0.47 0.00 0.00 36.82 38.26 1fwh h ILE 409 CO 0.00 0.41 0.19 0.78 -3.07 0.00 0.00 178.15 176.46 1fwh h ASN 410 N 0.80 0.55 0.03 2.19 2.35 -1.69 -1.01 115.58 118.80 1fwh h ASN 410 Ca 0.14 -0.14 -0.06 0.00 -0.55 0.00 0.00 56.30 55.68 1fwh h ASN 410 Cb 0.60 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.82 1fwh h ASN 410 CO 0.04 0.54 -0.17 -0.65 -1.65 0.00 0.00 177.43 175.54 1fwh h PRO 411 N 0.52 0.29 -0.47 0.81 0.11 -1.78 -0.45 132.00 131.03 1fwh h PRO 411 Ca 0.14 -0.08 -0.05 0.00 0.11 0.00 0.00 66.00 66.12 1fwh h PRO 411 Cb 0.15 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.21 1fwh h PRO 411 CO -0.02 0.46 0.09 0.00 -0.21 0.00 0.00 178.00 178.33 1fwh h ALA 412 N 1.56 0.63 -0.36 -0.75 0.00 -1.39 -2.09 119.26 116.86 1fwh h ALA 412 Ca 0.05 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 1fwh h ALA 412 Cb 0.47 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1fwh h ALA 412 CO 0.03 0.34 -0.06 -0.07 0.00 0.00 0.00 179.25 179.49 1fwh h LEU 413 N 0.65 0.68 -1.30 0.00 3.38 -0.78 -0.27 115.31 117.67 1fwh h LEU 413 Ca 0.15 -0.35 0.01 0.00 0.09 0.00 0.00 57.88 57.78 1fwh h LEU 413 Cb 0.36 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.89 1fwh h LEU 413 CO 0.01 0.87 0.48 0.74 0.09 0.00 0.00 178.44 180.62 1fwh h THR 414 N 0.47 1.18 -0.62 0.22 2.02 -0.99 -2.95 112.91 112.24 1fwh h THR 414 Ca 0.09 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 66.94 1fwh h THR 414 Cb 0.56 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 67.10 1fwh h THR 414 CO 0.03 0.18 0.00 1.41 0.37 0.00 0.00 175.52 177.51 1fwh n HIS 415 N -4.43 1.01 -2.56 3.16 8.25 -0.79 -4.87 115.22 114.99 1fwh n HIS 415 Ca 0.08 -0.54 -0.12 0.00 -0.26 0.00 0.00 57.72 56.87 1fwh n HIS 415 Cb 0.04 -0.08 0.01 0.00 1.12 0.00 0.00 29.99 31.09 1fwh n HIS 415 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fwh n GLY 416 N 1.22 -0.04 0.02 -1.41 0.00 -0.92 -4.76 105.19 99.30 1fwh n GLY 416 Ca 0.22 -0.30 0.01 0.00 0.00 0.00 0.00 46.02 45.95 1fwh n GLY 416 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1fwh n ILE 417 N -3.98 0.76 0.26 -0.61 -5.35 -0.16 -2.08 119.36 108.20 1fwh n ILE 417 Ca -0.09 -0.79 0.08 0.00 -0.27 0.00 0.00 62.75 61.69 1fwh n ILE 417 Cb 0.58 0.59 0.36 0.00 -1.74 0.00 0.00 39.64 39.43 1fwh n ILE 417 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1fwh n ALA 418 N -0.41 1.33 0.42 -1.28 0.00 -1.00 -1.39 120.51 118.17 1fwh n ALA 418 Ca 0.01 0.07 0.13 0.00 0.00 0.00 0.00 53.44 53.65 1fwh n ALA 418 Cb 0.35 -1.24 0.35 0.00 0.00 0.00 0.00 19.45 18.91 1fwh n ALA 418 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 1fwh h HIS 419 N 0.00 0.00 0.00 0.00 2.07 -1.90 -3.36 115.15 111.96 1fwh h HIS 419 Ca 0.00 0.00 -0.27 0.00 -2.85 0.00 0.00 60.37 57.25 1fwh h HIS 419 Cb 0.15 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.08 1fwh h HIS 419 CO 0.00 0.00 -1.98 0.39 -3.07 0.00 0.00 177.93 173.27 1fwh n GLU 420 N -2.66 0.41 -3.16 5.12 -0.58 -0.49 -4.74 120.64 114.54 1fwh n GLU 420 Ca 0.04 0.12 -0.10 0.00 -0.42 0.00 0.00 57.16 56.80 1fwh n GLU 420 Cb 0.44 -1.27 -0.04 0.00 -0.57 0.00 0.00 31.44 29.99 1fwh n GLU 420 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 1fwh n VAL 421 N -3.26 0.00 0.00 2.62 0.24 -0.94 -0.11 118.33 116.89 1fwh n VAL 421 Ca -0.32 -1.24 0.00 0.00 -2.04 0.00 0.00 64.34 60.74 1fwh n VAL 421 Cb 0.80 0.59 0.00 0.00 -1.47 0.00 0.00 33.84 33.76 1fwh n VAL 421 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1fwh n GLY 422 N -0.15 2.76 3.73 7.63 0.00 -1.26 -4.23 105.19 113.67 1fwh n GLY 422 Ca 0.03 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.00 1fwh n GLY 422 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fwh s SER 423 N -1.52 -0.21 -0.95 1.61 1.04 -1.26 -1.76 113.70 110.65 1fwh s SER 423 Ca 0.00 -0.36 -0.17 0.00 0.48 0.00 0.00 55.95 55.90 1fwh s SER 423 Cb 0.00 0.49 0.16 0.00 0.10 0.00 0.00 66.02 66.77 1fwh s SER 423 CO 0.00 -0.90 1.10 -0.63 0.98 0.00 0.00 173.24 173.79 1fwh s ILE 424 N -3.31 4.99 0.04 -1.02 1.01 -1.26 -4.91 121.20 116.74 1fwh s ILE 424 Ca 0.11 -1.96 0.01 0.00 0.00 0.00 0.00 60.65 58.81 1fwh s ILE 424 Cb -0.02 -4.73 -0.03 0.00 0.01 0.00 0.00 42.46 37.70 1fwh s ILE 424 CO 0.01 -1.42 -0.05 -1.61 0.00 0.00 0.00 174.94 171.87 1fwh s GLU 425 N 1.89 0.49 0.51 2.79 2.02 -1.26 -5.08 118.70 120.07 1fwh s GLU 425 Ca 0.31 -0.84 -0.23 0.00 0.02 0.00 0.00 54.97 54.23 1fwh s GLU 425 Cb -0.06 -0.05 -0.06 0.00 0.10 0.00 0.00 34.13 34.06 1fwh s GLU 425 CO -0.08 -0.02 1.35 1.33 0.02 0.00 0.00 175.26 177.86 1fwh n VAL 426 N 1.13 3.42 0.00 2.63 0.24 -1.26 -2.73 118.33 121.76 1fwh n VAL 426 Ca -0.21 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.59 1fwh n VAL 426 Cb 0.56 -1.68 0.00 0.00 -1.47 0.00 0.00 33.84 31.25 1fwh n VAL 426 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1fwh n GLY 427 N 0.74 2.66 3.86 7.63 0.00 0.46 -4.95 105.19 115.59 1fwh n GLY 427 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 1fwh n GLY 427 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fwh s LYS 428 N -0.37 3.83 0.30 1.61 1.02 -1.11 -4.75 119.74 120.27 1fwh s LYS 428 Ca 0.00 0.61 -0.29 0.00 0.02 0.00 0.00 55.97 56.31 1fwh s LYS 428 Cb 0.00 -2.32 -0.13 0.00 -0.52 0.00 0.00 37.83 34.86 1fwh s LYS 428 CO 0.00 -0.10 1.35 -0.11 -0.92 0.00 0.00 175.35 175.57 1fwh n LEU 429 N -1.36 3.40 -3.77 3.17 7.94 0.84 -0.81 117.00 126.41 1fwh n LEU 429 Ca 0.04 1.18 -0.42 0.00 -1.11 0.00 0.00 56.01 55.69 1fwh n LEU 429 Cb 0.54 -1.47 -0.01 0.00 0.53 0.00 0.00 43.42 43.02 1fwh n LEU 429 CO 0.47 -0.46 2.59 0.00 -1.11 0.00 0.00 177.39 178.88 1fwh n ALA 430 N 1.08 5.21 -3.34 1.96 0.00 0.27 -4.67 120.51 121.01 1fwh n ALA 430 Ca 0.08 -3.82 -0.45 0.00 0.00 0.00 0.00 53.44 49.24 1fwh n ALA 430 Cb 0.34 -3.55 -0.05 0.00 0.00 0.00 0.00 19.45 16.19 1fwh n ALA 430 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1fwh s ASP 431 N 3.45 6.14 0.14 0.00 1.01 -1.26 -2.14 116.67 124.01 1fwh s ASP 431 Ca 0.48 -1.83 0.09 0.00 0.71 0.00 0.00 52.55 52.01 1fwh s ASP 431 Cb 0.13 -2.19 -0.04 0.00 1.01 0.00 0.00 42.92 41.84 1fwh s ASP 431 CO -0.06 -0.83 -0.21 -0.76 0.21 0.00 0.00 175.17 173.52 1fwh s LEU 432 N 1.54 2.37 -0.08 1.23 1.43 -0.63 -1.40 118.68 123.13 1fwh s LEU 432 Ca 0.04 -0.78 0.01 0.00 -1.03 0.00 0.00 54.13 52.37 1fwh s LEU 432 Cb -0.29 -0.94 0.02 0.00 0.03 0.00 0.00 46.19 45.01 1fwh s LEU 432 CO 0.02 0.05 -0.11 -0.69 0.23 0.00 0.00 176.35 175.85 1fwh s VAL 433 N -1.53 1.15 -0.20 -1.59 1.01 0.13 -0.24 120.40 119.14 1fwh s VAL 433 Ca 0.12 -0.45 -0.09 0.00 0.00 0.00 0.00 61.98 61.57 1fwh s VAL 433 Cb -0.08 -1.08 -0.05 0.00 0.00 0.00 0.00 36.38 35.17 1fwh s VAL 433 CO 0.06 0.37 0.10 -0.69 0.00 0.00 0.00 175.10 174.94 1fwh s VAL 434 N 0.97 5.09 0.09 2.92 1.01 -0.39 -1.05 120.40 129.04 1fwh s VAL 434 Ca -0.09 0.08 0.08 0.00 0.00 0.00 0.00 61.98 62.05 1fwh s VAL 434 Cb -0.15 -3.32 -0.03 0.00 0.00 0.00 0.00 36.38 32.88 1fwh s VAL 434 CO -0.00 0.43 -0.19 0.26 0.00 0.00 0.00 175.10 175.60 1fwh s TRP 435 N 0.49 1.67 -0.08 5.22 0.52 0.13 -0.48 118.94 126.41 1fwh s TRP 435 Ca 0.06 -0.42 -0.13 0.00 0.02 0.00 0.00 56.10 55.62 1fwh s TRP 435 Cb -0.12 -0.92 -0.05 0.00 -1.15 0.00 0.00 33.47 31.23 1fwh s TRP 435 CO -0.00 0.17 0.33 0.45 0.02 0.00 0.00 176.95 177.92 1fwh s SER 436 N -1.84 6.61 0.38 2.95 0.15 -1.26 -0.37 113.70 120.32 1fwh s SER 436 Ca 0.05 0.72 0.15 0.00 0.70 0.00 0.00 55.95 57.56 1fwh s SER 436 Cb -0.10 -2.20 0.99 0.00 -1.71 0.00 0.00 66.02 63.00 1fwh s SER 436 CO 0.04 0.24 1.82 -0.65 1.20 0.00 0.00 173.24 175.89 1fwh h PRO 437 N 5.53 0.49 0.00 5.44 0.11 -1.91 -0.10 132.00 141.56 1fwh h PRO 437 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1fwh h PRO 437 Cb 1.20 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1fwh h PRO 437 CO 0.66 0.33 0.00 0.00 -0.21 0.00 0.00 178.00 178.78 1fwh h ALA 438 N 1.62 1.00 0.00 -0.75 0.00 -1.88 0.45 119.26 119.70 1fwh h ALA 438 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.43 1fwh h ALA 438 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1fwh h ALA 438 CO -0.25 0.00 -0.01 1.19 0.00 0.00 0.00 179.25 180.17 1fwh n PHE 439 N -2.55 0.00 -1.62 0.00 3.72 -0.14 -4.54 117.46 112.33 1fwh n PHE 439 Ca 0.01 -0.54 -0.49 0.00 -0.05 0.00 0.00 57.45 56.38 1fwh n PHE 439 Cb 0.22 -0.07 -0.05 0.00 -0.94 0.00 0.00 39.48 38.65 1fwh n PHE 439 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1fwh n PHE 440 N -0.63 1.75 -0.40 1.38 7.35 -0.64 -0.92 117.46 125.34 1fwh n PHE 440 Ca 0.03 0.52 0.00 0.00 -0.76 0.00 0.00 57.45 57.25 1fwh n PHE 440 Cb 0.37 -2.39 0.00 0.00 0.35 0.00 0.00 39.48 37.80 1fwh n PHE 440 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1fwh n GLY 441 N 2.63 1.45 0.59 7.13 0.00 -1.26 -4.58 105.19 111.15 1fwh n GLY 441 Ca 0.17 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.14 1fwh n GLY 441 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1fwh n VAL 442 N -2.00 1.33 -3.66 1.61 0.31 -0.10 -3.59 118.33 112.24 1fwh n VAL 442 Ca 0.00 0.25 -0.27 0.00 -0.01 0.00 0.00 64.34 64.32 1fwh n VAL 442 Cb 0.00 -1.94 -0.17 0.00 -0.91 0.00 0.00 33.84 30.82 1fwh n VAL 442 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1fwh s LYS 443 N -2.43 0.30 0.66 5.55 1.02 -0.91 -4.90 119.74 119.04 1fwh s LYS 443 Ca -0.14 -0.25 -0.16 0.00 0.02 0.00 0.00 55.97 55.44 1fwh s LYS 443 Cb 0.02 -1.92 0.00 0.00 -0.52 0.00 0.00 37.83 35.42 1fwh s LYS 443 CO 0.21 -0.68 1.18 -2.14 -0.92 0.00 0.00 175.35 173.00 1fwh s PRO 444 N 2.02 2.63 -0.07 -1.68 0.02 -1.26 -4.74 135.00 131.93 1fwh s PRO 444 Ca 0.01 1.69 0.03 0.00 0.02 0.00 0.00 61.00 62.75 1fwh s PRO 444 Cb -0.16 -1.90 -0.25 0.00 0.02 0.00 0.00 34.50 32.21 1fwh s PRO 444 CO -0.10 -1.44 0.56 0.00 -0.33 0.00 0.00 177.00 175.69 1fwh h ALA 445 N 0.25 0.59 -2.38 -1.55 0.00 -1.14 -3.42 119.26 111.61 1fwh h ALA 445 Ca -0.48 -1.40 -0.07 0.00 0.00 0.00 0.00 54.91 52.95 1fwh h ALA 445 Cb 1.28 0.56 -0.23 0.00 0.00 0.00 0.00 17.79 19.40 1fwh h ALA 445 CO 0.53 1.43 -0.09 0.99 0.00 0.00 0.00 179.25 182.11 1fwh s THR 446 N -2.58 -0.00 -0.23 0.00 2.01 -1.13 -4.11 115.64 109.59 1fwh s THR 446 Ca -0.12 0.02 0.02 0.00 0.31 0.00 0.00 61.69 61.91 1fwh s THR 446 Cb 0.07 -0.78 0.04 0.00 0.01 0.00 0.00 72.50 71.85 1fwh s THR 446 CO 0.80 0.01 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.91 1fwh s VAL 447 N 0.71 2.17 -0.21 3.82 1.01 -0.76 -1.27 120.40 125.88 1fwh s VAL 447 Ca -0.03 -1.35 -0.10 0.00 0.00 0.00 0.00 61.98 60.50 1fwh s VAL 447 Cb -0.05 -2.14 -0.05 0.00 0.00 0.00 0.00 36.38 34.14 1fwh s VAL 447 CO -0.05 0.19 0.13 -0.63 0.00 0.00 0.00 175.10 174.74 1fwh s ILE 448 N 1.18 5.34 -0.22 2.22 1.01 0.67 -1.06 121.20 130.34 1fwh s ILE 448 Ca -0.03 0.17 0.01 0.00 0.00 0.00 0.00 60.65 60.79 1fwh s ILE 448 Cb -0.17 -3.45 0.03 0.00 0.01 0.00 0.00 42.46 38.88 1fwh s ILE 448 CO -0.08 0.42 -0.14 -0.54 0.00 0.00 0.00 174.94 174.60 1fwh s LYS 449 N 0.51 2.73 -1.72 2.79 1.02 0.90 -1.61 119.74 124.35 1fwh s LYS 449 Ca 0.07 -1.02 -0.00 0.00 0.02 0.00 0.00 55.97 55.04 1fwh s LYS 449 Cb -0.12 -2.75 0.00 0.00 -0.52 0.00 0.00 37.83 34.44 1fwh s LYS 449 CO -0.00 -0.36 0.05 0.41 -0.92 0.00 0.00 175.35 174.53 1fwh n GLY 450 N 4.57 -0.50 0.75 -3.33 0.00 -0.91 -1.82 105.19 103.94 1fwh n GLY 450 Ca -0.18 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1fwh n GLY 450 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fwh n GLY 451 N -1.05 0.68 3.25 -0.02 0.00 -1.05 -4.29 105.19 102.71 1fwh n GLY 451 Ca -0.23 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.51 1fwh n GLY 451 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1fwh s MET 452 N -0.75 1.69 0.05 1.61 1.00 -0.76 -4.98 119.30 117.17 1fwh s MET 452 Ca 0.00 -0.83 -0.31 0.00 0.00 0.00 0.00 55.69 54.55 1fwh s MET 452 Cb 0.00 -1.68 -0.07 0.00 0.00 0.00 0.00 34.83 33.08 1fwh s MET 452 CO 0.00 0.45 1.49 0.42 0.00 0.00 0.00 175.02 177.39 1fwh s ILE 453 N -0.59 3.36 -0.14 2.53 1.01 -1.26 -0.07 121.20 126.05 1fwh s ILE 453 Ca 0.08 0.83 0.16 0.00 0.00 0.00 0.00 60.65 61.72 1fwh s ILE 453 Cb -0.09 -3.53 -0.23 0.00 0.01 0.00 0.00 42.46 38.62 1fwh s ILE 453 CO -0.00 0.01 0.13 0.00 0.00 0.00 0.00 174.94 175.08 1fwh n ALA 454 N 5.16 1.80 -3.56 9.38 0.00 -0.23 -1.41 120.51 131.66 1fwh n ALA 454 Ca 0.14 -0.99 -0.16 0.00 0.00 0.00 0.00 53.44 52.43 1fwh n ALA 454 Cb 0.42 -0.22 -0.06 0.00 0.00 0.00 0.00 19.45 19.59 1fwh n ALA 454 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1fwh s ILE 455 N -2.59 0.00 0.03 0.00 2.07 -1.21 -0.92 121.20 118.58 1fwh s ILE 455 Ca -0.08 0.00 -0.28 0.00 -1.41 0.00 0.00 60.65 58.88 1fwh s ILE 455 Cb 0.06 -1.00 0.09 0.00 0.13 0.00 0.00 42.46 41.75 1fwh s ILE 455 CO 0.72 0.00 0.91 0.00 -1.91 0.00 0.00 174.94 174.66 1fwh s ALA 456 N -0.62 -1.80 0.28 1.50 0.00 -1.18 -1.83 121.76 118.11 1fwh s ALA 456 Ca -0.06 0.83 -0.29 0.00 0.00 0.00 0.00 51.96 52.43 1fwh s ALA 456 Cb -0.02 0.46 -0.10 0.00 0.00 0.00 0.00 23.12 23.46 1fwh s ALA 456 CO 0.06 -0.77 1.33 -2.14 0.00 0.00 0.00 175.76 174.24 1fwh s PRO 457 N -3.14 4.35 -0.02 0.00 0.02 -1.26 -2.28 135.00 132.68 1fwh s PRO 457 Ca 0.07 2.18 -0.00 0.00 0.02 0.00 0.00 61.00 63.26 1fwh s PRO 457 Cb -0.01 -3.11 0.03 0.00 0.02 0.00 0.00 34.50 31.43 1fwh s PRO 457 CO -0.07 -0.24 0.04 1.41 -0.33 0.00 0.00 177.00 177.82 1fwh s MET 458 N -1.06 -0.02 0.03 5.54 1.75 -0.62 -4.91 119.30 120.02 1fwh s MET 458 Ca 0.53 0.20 -0.00 0.00 -1.25 0.00 0.00 55.69 55.17 1fwh s MET 458 Cb -0.39 -0.22 0.01 0.00 2.84 0.00 0.00 34.83 37.06 1fwh s MET 458 CO 0.47 -0.16 0.04 0.41 -0.65 0.00 0.00 175.02 175.13 1fwh n GLY 459 N 4.11 -0.14 3.52 2.11 0.00 -0.25 -2.42 105.19 112.13 1fwh n GLY 459 Ca -0.27 -1.82 -0.64 0.00 0.00 0.00 0.00 46.02 43.29 1fwh n GLY 459 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1fwh n ASP 460 N -3.01 1.09 0.15 1.61 -0.08 -0.56 -4.84 116.55 110.91 1fwh n ASP 460 Ca 0.01 1.07 0.05 0.00 -1.51 0.00 0.00 54.79 54.40 1fwh n ASP 460 Cb 0.02 -0.84 0.48 0.00 2.34 0.00 0.00 41.12 43.12 1fwh n ASP 460 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 1fwh h ILE 461 N 5.06 1.11 -0.01 5.18 1.08 -1.92 -2.44 117.51 125.56 1fwh h ILE 461 Ca -0.37 -0.43 0.00 0.00 -0.39 0.00 0.00 64.86 63.66 1fwh h ILE 461 Cb 1.32 1.03 0.00 0.00 -3.07 0.00 0.00 36.82 36.10 1fwh h ILE 461 CO 0.95 0.14 -0.17 -3.20 -0.69 0.00 0.00 178.15 175.18 1fwh n ASN 462 N -4.39 1.53 -4.68 1.72 5.15 -1.26 -4.97 115.26 108.35 1fwh n ASN 462 Ca -0.01 -1.30 -0.30 0.00 -0.60 0.00 0.00 54.58 52.38 1fwh n ASN 462 Cb 0.18 0.12 0.16 0.00 -0.53 0.00 0.00 39.78 39.70 1fwh n ASN 462 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1fwh s ALA 463 N -2.27 1.23 0.18 5.20 0.00 -0.92 -4.94 121.76 120.24 1fwh s ALA 463 Ca 0.29 -0.05 0.19 0.00 0.00 0.00 0.00 51.96 52.39 1fwh s ALA 463 Cb 0.20 -3.21 0.70 0.00 0.00 0.00 0.00 23.12 20.81 1fwh s ALA 463 CO 0.44 -2.62 1.75 0.66 0.00 0.00 0.00 175.76 175.99 1fwh h SER 464 N -1.74 0.00 -4.56 0.00 4.64 -1.93 -3.45 113.55 106.51 1fwh h SER 464 Ca -0.51 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 60.54 1fwh h SER 464 Cb 1.29 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.24 1fwh h SER 464 CO 0.53 0.36 -0.67 0.27 -0.87 0.00 0.00 176.83 176.45 1fwh s ILE 465 N -3.64 0.66 -1.62 0.95 -4.36 -1.26 -5.06 121.20 106.87 1fwh s ILE 465 Ca -0.00 -1.97 0.26 0.00 -0.26 0.00 0.00 60.65 58.68 1fwh s ILE 465 Cb 0.11 -2.02 0.55 0.00 1.25 0.00 0.00 42.46 42.35 1fwh s ILE 465 CO 0.68 -0.57 1.88 -0.81 0.24 0.00 0.00 174.94 176.37 1fwh n PRO 466 N -0.19 0.52 0.07 0.37 -0.04 -1.26 -4.08 135.00 130.39 1fwh n PRO 466 Ca -0.08 0.03 0.06 0.00 -0.04 0.00 0.00 63.50 63.47 1fwh n PRO 466 Cb 0.63 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.55 1fwh n PRO 466 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1fwh h THR 467 N 0.00 0.26 -4.13 0.52 1.35 -1.91 -0.64 112.91 108.35 1fwh h THR 467 Ca 0.00 -1.50 -0.55 0.00 -0.55 0.00 0.00 66.41 63.80 1fwh h THR 467 Cb 0.16 1.79 0.17 0.00 -1.73 0.00 0.00 68.15 68.53 1fwh h THR 467 CO 0.00 0.15 0.48 -2.84 -0.25 0.00 0.00 175.52 173.06 1fwh s PRO 468 N -3.14 2.32 0.70 4.72 0.02 -1.26 -4.80 135.00 133.56 1fwh s PRO 468 Ca -0.01 2.01 -0.13 0.00 0.02 0.00 0.00 61.00 62.88 1fwh s PRO 468 Cb 0.09 -1.82 0.02 0.00 0.02 0.00 0.00 34.50 32.80 1fwh s PRO 468 CO 0.80 -1.76 1.10 -0.65 -0.33 0.00 0.00 177.00 176.15 1fwh s GLN 469 N -3.55 2.63 0.09 5.54 -1.52 -1.26 -1.50 119.66 120.09 1fwh s GLN 469 Ca 0.81 1.30 -0.27 0.00 -1.95 0.00 0.00 55.36 55.25 1fwh s GLN 469 Cb -0.36 -1.93 -0.06 0.00 -0.22 0.00 0.00 33.01 30.44 1fwh s GLN 469 CO 0.42 -1.37 0.84 -1.25 -0.25 0.00 0.00 175.29 173.68 1fwh s PRO 470 N -4.40 4.59 -0.30 2.91 0.04 -1.26 -4.21 135.00 132.38 1fwh s PRO 470 Ca 0.65 1.23 -0.10 0.00 0.04 0.00 0.00 61.00 62.81 1fwh s PRO 470 Cb -0.19 -3.35 -0.03 0.00 0.04 0.00 0.00 34.50 30.97 1fwh s PRO 470 CO 0.47 0.30 0.17 0.08 0.04 0.00 0.00 177.00 178.06 1fwh s VAL 471 N -0.22 4.93 0.08 -0.36 1.01 -1.26 -3.57 120.40 121.01 1fwh s VAL 471 Ca 0.41 -0.14 -0.09 0.00 0.00 0.00 0.00 61.98 62.16 1fwh s VAL 471 Cb -0.22 -3.43 0.00 0.00 0.00 0.00 0.00 36.38 32.73 1fwh s VAL 471 CO 0.26 0.16 0.20 -1.38 0.00 0.00 0.00 175.10 174.34 1fwh s HIS 472 N 1.69 0.11 0.17 5.22 -3.43 -1.01 -4.86 115.29 113.17 1fwh s HIS 472 Ca 0.06 -0.49 -0.32 0.00 -0.80 0.00 0.00 55.06 53.52 1fwh s HIS 472 Cb -0.16 -0.04 -0.10 0.00 -1.43 0.00 0.00 32.58 30.85 1fwh s HIS 472 CO 0.08 -0.53 1.59 0.71 -2.00 0.00 0.00 174.74 174.59 1fwh s TYR 473 N -3.56 3.02 0.00 0.38 1.51 -1.26 -1.58 117.35 115.87 1fwh s TYR 473 Ca 0.03 0.58 0.01 0.00 -1.01 0.00 0.00 57.07 56.67 1fwh s TYR 473 Cb 0.03 -3.95 -0.00 0.00 -0.11 0.00 0.00 41.96 37.93 1fwh s TYR 473 CO -0.09 -3.53 -0.02 1.03 -1.11 0.00 0.00 175.55 171.82 1fwh s ARG 474 N 1.20 0.17 0.33 -0.62 0.52 -0.96 -4.94 118.95 114.65 1fwh s ARG 474 Ca 0.71 -0.16 -0.29 0.00 -0.52 0.00 0.00 55.73 55.46 1fwh s ARG 474 Cb -0.44 -0.11 -0.11 0.00 0.52 0.00 0.00 34.95 34.81 1fwh s ARG 474 CO 0.31 0.02 1.49 -2.14 0.02 0.00 0.00 175.30 175.01 1fwh s PRO 475 N -0.30 4.17 0.00 3.54 0.02 -1.26 -3.10 135.00 138.07 1fwh s PRO 475 Ca -0.02 2.49 0.00 0.00 0.02 0.00 0.00 61.00 63.49 1fwh s PRO 475 Cb -0.02 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.48 1fwh s PRO 475 CO -0.00 -0.50 0.00 -1.33 -0.33 0.00 0.00 177.00 174.84 1fwh n MET 476 N 1.32 1.54 0.23 5.54 2.81 -0.10 -4.93 117.12 123.53 1fwh n MET 476 Ca 0.04 0.00 0.10 0.00 -1.81 0.00 0.00 57.70 56.03 1fwh n MET 476 Cb 0.39 0.00 0.67 0.00 -0.71 0.00 0.00 33.22 33.57 1fwh n MET 476 CO 0.00 0.00 0.00 0.74 1.51 0.00 0.00 175.97 178.22 1fwh h PHE 477 N 0.36 0.00 0.00 2.03 -1.00 -1.85 -1.38 116.94 115.11 1fwh h PHE 477 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1fwh h PHE 477 Cb 0.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.56 1fwh h PHE 477 CO 0.00 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.11 1fwh n GLY 478 N -1.53 -0.98 0.86 -1.45 0.00 -0.50 -1.69 105.19 99.90 1fwh n GLY 478 Ca -0.01 0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.11 1fwh n GLY 478 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fwh n ALA 479 N -1.60 2.33 -2.74 4.61 0.00 -0.52 -3.81 120.51 118.78 1fwh n ALA 479 Ca 0.02 -1.02 -0.36 0.00 0.00 0.00 0.00 53.44 52.09 1fwh n ALA 479 Cb 0.14 -0.62 -0.07 0.00 0.00 0.00 0.00 19.45 18.90 1fwh n ALA 479 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1fwh s LEU 480 N -1.13 4.25 0.00 0.00 1.43 -0.68 -4.78 118.68 117.77 1fwh s LEU 480 Ca 0.29 0.35 0.00 0.00 -1.03 0.00 0.00 54.13 53.74 1fwh s LEU 480 Cb 0.17 -2.17 0.00 0.00 0.03 0.00 0.00 46.19 44.22 1fwh s LEU 480 CO 0.23 0.19 0.00 0.61 0.23 0.00 0.00 176.35 177.61 1fwh n GLY 481 N 3.25 0.28 0.25 -3.19 0.00 -1.26 -1.01 105.19 103.52 1fwh n GLY 481 Ca -0.15 0.05 0.10 0.00 0.00 0.00 0.00 46.02 46.02 1fwh n GLY 481 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1fwh h SER 482 N 0.00 0.00 -0.09 1.61 0.02 -1.96 -1.84 113.55 111.29 1fwh h SER 482 Ca 0.00 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.82 1fwh h SER 482 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1fwh h SER 482 CO 0.00 0.13 -0.38 0.00 -1.14 0.00 0.00 176.83 175.44 1fwh h ALA 483 N 1.87 0.84 -0.21 3.77 0.00 -1.36 -2.79 119.26 121.38 1fwh h ALA 483 Ca -0.00 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 1fwh h ALA 483 Cb 0.29 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1fwh h ALA 483 CO 0.02 0.64 0.11 -0.09 0.00 0.00 0.00 179.25 179.93 1fwh h ARG 484 N 0.51 0.29 -0.88 0.00 2.43 -0.36 -2.28 114.38 114.08 1fwh h ARG 484 Ca 0.05 -0.03 0.09 0.00 -0.81 0.00 0.00 59.98 59.27 1fwh h ARG 484 Cb 0.89 -0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 30.32 1fwh h ARG 484 CO 0.08 0.28 0.57 0.45 -1.51 0.00 0.00 179.97 179.83 1fwh h HIS 485 N 0.22 0.97 0.00 2.20 3.86 -1.39 -1.25 115.15 119.77 1fwh h HIS 485 Ca 0.07 0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.25 1fwh h HIS 485 Cb 0.07 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.22 1fwh h HIS 485 CO -0.04 0.47 -0.28 1.25 0.86 0.00 0.00 177.93 180.19 1fwh h HIS 486 N 0.91 0.00 -0.51 2.45 -0.00 -1.19 -2.72 115.15 114.09 1fwh h HIS 486 Ca 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.77 1fwh h HIS 486 Cb 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.75 1fwh h HIS 486 CO -0.00 0.28 0.00 0.00 -0.00 0.00 0.00 177.93 178.21 1fwh s ARG 488 N -1.07 1.31 0.02 0.00 1.70 -0.87 -3.42 118.95 116.62 1fwh s ARG 488 Ca 0.37 -1.64 0.06 0.00 -0.47 0.00 0.00 55.73 54.05 1fwh s ARG 488 Cb 0.20 -0.77 -0.02 0.00 -0.57 0.00 0.00 34.95 33.78 1fwh s ARG 488 CO 0.26 -0.00 -0.19 -0.51 -1.08 0.00 0.00 175.30 173.78 1fwh s LEU 489 N -3.30 2.11 -0.22 -1.89 1.43 -1.26 -2.98 118.68 112.57 1fwh s LEU 489 Ca 0.25 -0.43 -0.03 0.00 -1.03 0.00 0.00 54.13 52.89 1fwh s LEU 489 Cb 0.04 -0.91 -0.00 0.00 0.03 0.00 0.00 46.19 45.35 1fwh s LEU 489 CO 0.07 0.17 -0.06 -0.89 0.23 0.00 0.00 176.35 175.87 1fwh s THR 490 N -0.65 3.16 0.08 5.49 2.01 -0.23 -1.58 115.64 123.92 1fwh s THR 490 Ca 0.06 -0.59 -0.23 0.00 0.31 0.00 0.00 61.69 61.25 1fwh s THR 490 Cb -0.08 -2.44 -0.06 0.00 0.01 0.00 0.00 72.50 69.93 1fwh s THR 490 CO 0.01 0.42 0.71 -0.36 -0.69 0.00 0.00 174.62 174.71 1fwh s PHE 491 N 1.44 3.80 0.23 4.92 0.40 -0.05 -1.48 117.98 127.24 1fwh s PHE 491 Ca 0.05 1.45 0.06 0.00 -0.60 0.00 0.00 56.93 57.89 1fwh s PHE 491 Cb -0.14 -2.71 -0.05 0.00 0.51 0.00 0.00 43.02 40.63 1fwh s PHE 491 CO -0.05 0.42 -0.08 -0.51 0.70 0.00 0.00 175.22 175.71 1fwh s LEU 492 N -0.62 2.44 0.55 -0.37 1.43 0.27 -4.60 118.68 117.79 1fwh s LEU 492 Ca 0.35 -1.13 -0.12 0.00 -1.03 0.00 0.00 54.13 52.20 1fwh s LEU 492 Cb -0.21 -0.53 -0.05 0.00 0.03 0.00 0.00 46.19 45.43 1fwh s LEU 492 CO 0.22 -0.33 0.96 -0.94 0.23 0.00 0.00 176.35 176.49 1fwh s SER 493 N -3.35 6.38 0.31 2.29 1.04 -1.25 -1.77 113.70 117.35 1fwh s SER 493 Ca 0.26 1.37 0.01 0.00 0.48 0.00 0.00 55.95 58.07 1fwh s SER 493 Cb 0.03 -2.44 0.55 0.00 0.10 0.00 0.00 66.02 64.26 1fwh s SER 493 CO 0.08 -0.70 1.91 1.56 0.98 0.00 0.00 173.24 177.07 1fwh h GLN 494 N 0.27 0.97 -0.58 4.02 4.20 -1.83 -1.72 115.11 120.44 1fwh h GLN 494 Ca -0.45 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.18 1fwh h GLN 494 Cb 1.19 -0.22 -0.03 0.00 0.30 0.00 0.00 27.48 28.72 1fwh h GLN 494 CO 0.62 0.64 0.29 0.00 -0.67 0.00 0.00 178.83 179.71 1fwh h ALA 495 N 1.52 0.75 -0.33 3.87 0.00 -1.87 -1.82 119.26 121.39 1fwh h ALA 495 Ca 0.39 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 55.12 1fwh h ALA 495 Cb 0.22 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1fwh h ALA 495 CO -0.15 0.30 -0.00 0.00 0.00 0.00 0.00 179.25 179.40 1fwh h ALA 496 N 1.12 0.45 -0.59 0.00 0.00 -1.54 -1.45 119.26 117.25 1fwh h ALA 496 Ca 0.20 -0.24 0.07 0.00 0.00 0.00 0.00 54.91 54.94 1fwh h ALA 496 Cb 0.10 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.71 1fwh h ALA 496 CO -0.03 0.21 0.26 0.00 0.00 0.00 0.00 179.25 179.69 1fwh h ALA 497 N 0.85 0.77 -0.37 0.00 0.00 -1.12 -2.12 119.26 117.27 1fwh h ALA 497 Ca 0.09 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 1fwh h ALA 497 Cb 0.45 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1fwh h ALA 497 CO 0.02 -0.12 -0.20 0.00 0.00 0.00 0.00 179.25 178.95 1fwh h ALA 498 N 1.36 0.96 0.00 0.00 0.00 -1.16 -2.75 119.26 117.67 1fwh h ALA 498 Ca 0.28 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1fwh h ALA 498 Cb 0.27 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1fwh h ALA 498 CO -0.24 0.61 0.00 0.09 0.00 0.00 0.00 179.25 179.71 1fwh n ASN 499 N -4.13 0.00 -0.71 0.00 3.02 -0.56 -4.89 115.26 108.00 1fwh n ASN 499 Ca 0.00 0.07 -0.06 0.00 -0.03 0.00 0.00 54.58 54.56 1fwh n ASN 499 Cb 0.41 -0.30 -0.00 0.00 -0.61 0.00 0.00 39.78 39.27 1fwh n ASN 499 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fwh n GLY 500 N 0.27 0.16 0.36 7.41 0.00 -0.99 -4.94 105.19 107.47 1fwh n GLY 500 Ca 0.08 -0.63 0.02 0.00 0.00 0.00 0.00 46.02 45.49 1fwh n GLY 500 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1fwh h VAL 501 N -0.06 1.10 -0.88 1.61 2.07 -1.70 -0.96 116.25 117.43 1fwh h VAL 501 Ca -0.14 -0.39 0.03 0.00 0.82 0.00 0.00 66.70 67.01 1fwh h VAL 501 Cb 1.10 -0.15 -0.05 0.00 -1.52 0.00 0.00 31.29 30.67 1fwh h VAL 501 CO 0.16 0.21 0.58 0.00 0.02 0.00 0.00 177.57 178.54 1fwh h ALA 502 N 1.43 1.15 -0.14 1.67 0.00 -1.90 -0.68 119.26 120.80 1fwh h ALA 502 Ca 0.41 -0.04 -0.19 0.00 0.00 0.00 0.00 54.91 55.09 1fwh h ALA 502 Cb 0.13 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 17.61 1fwh h ALA 502 CO -0.16 0.45 -0.66 0.93 0.00 0.00 0.00 179.25 179.81 1fwh h GLU 503 N 1.14 0.70 -0.39 0.00 3.07 -1.72 0.57 114.58 117.95 1fwh h GLU 503 Ca 0.34 -0.56 -0.01 0.00 -0.50 0.00 0.00 59.36 58.63 1fwh h GLU 503 Cb -0.04 0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 27.97 1fwh h GLU 503 CO -0.10 1.18 0.21 -0.09 -1.40 0.00 0.00 179.01 178.80 1fwh h ARG 504 N 0.39 0.55 -0.00 2.33 2.43 -0.90 -2.49 114.38 116.69 1fwh h ARG 504 Ca -0.04 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 1fwh h ARG 504 Cb 1.29 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 1fwh h ARG 504 CO 0.14 0.46 -0.13 1.28 -1.51 0.00 0.00 179.97 180.20 1fwh n LEU 505 N -4.73 0.18 -3.27 3.80 4.77 -0.29 -4.93 117.00 112.53 1fwh n LEU 505 Ca -0.00 0.30 -0.17 0.00 -0.03 0.00 0.00 56.01 56.10 1fwh n LEU 505 Cb 0.09 -0.38 0.08 0.00 -2.33 0.00 0.00 43.42 40.88 1fwh n LEU 505 CO 0.36 0.04 0.13 -3.20 -1.33 0.00 0.00 177.39 173.39 1fwh n ASN 506 N -1.41 -2.99 -4.72 -1.43 2.85 -0.61 -4.94 115.26 102.01 1fwh n ASN 506 Ca 0.08 -0.56 -0.42 0.00 -0.11 0.00 0.00 54.58 53.58 1fwh n ASN 506 Cb 0.32 -4.76 -0.03 0.00 1.24 0.00 0.00 39.78 36.55 1fwh n ASN 506 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1fwh s LEU 507 N -6.22 4.38 0.12 1.20 1.02 0.09 -4.95 118.68 114.32 1fwh s LEU 507 Ca 0.13 2.37 0.19 0.00 0.02 0.00 0.00 54.13 56.84 1fwh s LEU 507 Cb -0.06 -3.59 -0.08 0.00 0.02 0.00 0.00 46.19 42.48 1fwh s LEU 507 CO 0.67 -0.64 0.90 0.54 0.02 0.00 0.00 176.35 177.85 1fwh n ARG 508 N 3.61 0.61 -1.94 1.70 3.00 -1.26 -4.89 116.66 117.49 1fwh n ARG 508 Ca 0.10 0.18 -0.29 0.00 -0.01 0.00 0.00 57.85 57.83 1fwh n ARG 508 Cb 0.42 -1.81 0.07 0.00 0.00 0.00 0.00 32.46 31.14 1fwh n ARG 508 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 1fwh s SER 509 N -5.59 4.84 0.52 0.55 0.01 -1.26 -4.74 113.70 108.02 1fwh s SER 509 Ca -0.02 0.85 -0.22 0.00 1.31 0.00 0.00 55.95 57.88 1fwh s SER 509 Cb 0.09 -1.46 -0.06 0.00 0.21 0.00 0.00 66.02 64.80 1fwh s SER 509 CO 0.80 -1.69 1.23 0.00 0.41 0.00 0.00 173.24 174.00 1fwh s ALA 510 N -3.47 2.83 -0.06 1.44 0.00 -1.03 -4.84 121.76 116.63 1fwh s ALA 510 Ca 0.60 1.07 0.02 0.00 0.00 0.00 0.00 51.96 53.66 1fwh s ALA 510 Cb -0.11 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.53 1fwh s ALA 510 CO 0.49 -0.99 -0.10 0.42 0.00 0.00 0.00 175.76 175.58 1fwh s ILE 511 N -1.48 3.43 0.03 0.00 -1.09 -1.26 -1.07 121.20 119.76 1fwh s ILE 511 Ca 0.69 -0.58 0.04 0.00 -2.23 0.00 0.00 60.65 58.57 1fwh s ILE 511 Cb -0.33 -2.38 -0.02 0.00 -1.58 0.00 0.00 42.46 38.15 1fwh s ILE 511 CO 0.38 0.59 -0.12 0.00 -1.23 0.00 0.00 174.94 174.56 1fwh s ALA 512 N -0.73 1.01 -0.09 9.38 0.00 -0.55 -4.90 121.76 125.88 1fwh s ALA 512 Ca 0.11 -0.74 -0.01 0.00 0.00 0.00 0.00 51.96 51.33 1fwh s ALA 512 Cb -0.11 -0.15 -0.03 0.00 0.00 0.00 0.00 23.12 22.83 1fwh s ALA 512 CO 0.01 0.18 -0.05 0.08 0.00 0.00 0.00 175.76 175.99 1fwh s VAL 513 N -0.80 3.89 0.34 0.00 1.01 -1.26 -0.56 120.40 123.01 1fwh s VAL 513 Ca 0.00 -0.40 -0.18 0.00 0.00 0.00 0.00 61.98 61.40 1fwh s VAL 513 Cb -0.07 -2.62 -0.10 0.00 0.00 0.00 0.00 36.38 33.59 1fwh s VAL 513 CO 0.01 0.58 0.82 0.68 0.00 0.00 0.00 175.10 177.18 1fwh s VAL 514 N -0.58 4.54 -0.13 2.92 -7.23 -0.73 -4.93 120.40 114.26 1fwh s VAL 514 Ca 0.09 1.22 -0.29 0.00 -1.81 0.00 0.00 61.98 61.18 1fwh s VAL 514 Cb -0.12 -3.67 0.10 0.00 0.56 0.00 0.00 36.38 33.25 1fwh s VAL 514 CO 0.02 -0.15 0.83 -1.59 -0.31 0.00 0.00 175.10 173.90 1fwh s LYS 515 N -2.85 0.82 0.00 4.82 -2.85 -0.89 -4.42 119.74 114.37 1fwh s LYS 515 Ca 0.55 0.33 0.00 0.00 -1.00 0.00 0.00 55.97 55.85 1fwh s LYS 515 Cb -0.11 0.39 0.00 0.00 -2.06 0.00 0.00 37.83 36.04 1fwh s LYS 515 CO 0.17 -0.23 0.00 0.41 0.10 0.00 0.00 175.35 175.80 1fwh n GLY 516 N 1.15 0.72 0.14 0.59 0.00 -1.26 -4.48 105.19 102.05 1fwh n GLY 516 Ca -0.15 -0.70 0.04 0.00 0.00 0.00 0.00 46.02 45.21 1fwh n GLY 516 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fwh h ARG 518 N 0.00 0.00 -0.00 0.00 2.47 -1.90 -3.37 114.38 111.58 1fwh h ARG 518 Ca -0.02 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.70 1fwh h ARG 518 Cb 1.34 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.66 1fwh h ARG 518 CO 0.05 0.33 -0.40 0.25 0.56 0.00 0.00 179.97 180.76 1fwh n THR 519 N -2.96 0.00 -2.63 2.04 -2.24 -1.25 -4.62 114.28 102.61 1fwh n THR 519 Ca -0.06 -0.05 -0.37 0.00 -2.27 0.00 0.00 64.05 61.30 1fwh n THR 519 Cb 0.80 0.30 -0.05 0.00 -2.10 0.00 0.00 70.33 69.28 1fwh n THR 519 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1fwh s VAL 520 N -2.80 3.88 0.20 2.28 -7.23 -1.25 -5.06 120.40 110.42 1fwh s VAL 520 Ca 0.16 1.53 -0.03 0.00 -1.81 0.00 0.00 61.98 61.83 1fwh s VAL 520 Cb 0.18 -3.83 -0.03 0.00 0.56 0.00 0.00 36.38 33.26 1fwh s VAL 520 CO 0.63 0.09 0.18 0.00 -0.31 0.00 0.00 175.10 175.69 1fwh s GLN 521 N -2.22 1.23 0.40 4.82 -2.07 -1.26 -4.86 119.66 115.69 1fwh s GLN 521 Ca 0.54 -1.55 0.18 0.00 -1.82 0.00 0.00 55.36 52.70 1fwh s GLN 521 Cb -0.22 0.30 1.09 0.00 -1.09 0.00 0.00 33.01 33.09 1fwh s GLN 521 CO 0.27 -0.42 1.80 -0.22 -1.32 0.00 0.00 175.29 175.41 1fwh h LYS 522 N 2.59 0.40 0.00 9.60 1.63 -1.01 0.27 116.57 130.05 1fwh h LYS 522 Ca -0.34 -0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.43 1fwh h LYS 522 Cb 1.25 -0.09 -0.00 0.00 -0.60 0.00 0.00 32.23 32.78 1fwh h LYS 522 CO 0.51 0.26 -0.01 0.00 -3.45 0.00 0.00 179.45 176.76 1fwh h ALA 523 N 1.61 1.03 0.00 5.00 0.00 -1.82 -2.27 119.26 122.82 1fwh h ALA 523 Ca 0.56 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.46 1fwh h ALA 523 Cb 1.39 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1fwh h ALA 523 CO -0.26 0.01 -0.36 -0.25 0.00 0.00 0.00 179.25 178.40 1fwh n ASP 524 N -3.15 0.67 -4.61 0.00 8.00 0.08 -4.84 116.55 112.71 1fwh n ASP 524 Ca -0.02 0.27 -0.43 0.00 0.71 0.00 0.00 54.79 55.32 1fwh n ASP 524 Cb 0.18 -0.20 -0.03 0.00 -0.02 0.00 0.00 41.12 41.05 1fwh n ASP 524 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1fwh s MET 525 N -3.12 3.55 -0.11 -1.24 -1.94 -0.85 -4.91 119.30 110.67 1fwh s MET 525 Ca 0.09 1.53 -0.34 0.00 -1.71 0.00 0.00 55.69 55.26 1fwh s MET 525 Cb 0.14 -4.12 -0.11 0.00 2.01 0.00 0.00 34.83 32.74 1fwh s MET 525 CO 0.66 -1.60 1.94 0.28 -0.01 0.00 0.00 175.02 176.29 1fwh n VAL 526 N 6.97 0.56 -0.93 -6.03 0.31 -1.26 -1.60 118.33 116.35 1fwh n VAL 526 Ca 0.21 -0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 1fwh n VAL 526 Cb 0.46 -1.94 0.00 0.00 -0.91 0.00 0.00 33.84 31.45 1fwh n VAL 526 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1fwh n HIS 527 N 7.29 0.00 -3.14 3.52 8.25 -1.26 -4.81 115.22 125.06 1fwh n HIS 527 Ca 0.24 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.51 1fwh n HIS 527 Cb 0.31 -1.73 -0.03 0.00 1.12 0.00 0.00 29.99 29.66 1fwh n HIS 527 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1fwh n ASN 528 N -0.75 0.27 -0.40 0.41 3.02 -0.63 -4.72 115.26 112.46 1fwh n ASN 528 Ca 0.00 -2.97 0.04 0.00 -0.03 0.00 0.00 54.58 51.62 1fwh n ASN 528 Cb 0.38 -0.36 0.11 0.00 -0.61 0.00 0.00 39.78 39.30 1fwh n ASN 528 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1fwh n SER 529 N 0.68 2.65 -4.74 6.41 3.41 -1.20 -4.60 113.62 116.23 1fwh n SER 529 Ca 0.22 -2.16 -0.42 0.00 -0.26 0.00 0.00 58.87 56.26 1fwh n SER 529 Cb 0.62 -0.19 -0.03 0.00 -0.26 0.00 0.00 64.21 64.36 1fwh n SER 529 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1fwh s LEU 530 N -1.28 4.38 -0.55 1.04 2.96 -1.05 -4.62 118.68 119.56 1fwh s LEU 530 Ca 0.17 2.62 0.04 0.00 -0.22 0.00 0.00 54.13 56.75 1fwh s LEU 530 Cb 0.11 -3.61 0.14 0.00 0.50 0.00 0.00 46.19 43.32 1fwh s LEU 530 CO 0.09 -0.72 0.30 -1.10 -1.32 0.00 0.00 176.35 173.60 1fwh s GLN 531 N 0.03 2.06 0.45 1.98 -0.21 -1.26 -4.41 119.66 118.30 1fwh s GLN 531 Ca 0.62 -2.75 -0.20 0.00 0.02 0.00 0.00 55.36 53.05 1fwh s GLN 531 Cb -0.42 -3.33 -0.10 0.00 1.00 0.00 0.00 33.01 30.16 1fwh s GLN 531 CO 0.40 -1.14 0.96 -1.25 -2.12 0.00 0.00 175.29 172.14 1fwh s PRO 532 N -0.49 4.15 -1.13 2.91 0.04 -1.26 -4.95 135.00 134.28 1fwh s PRO 532 Ca 0.18 1.08 -0.19 0.00 0.04 0.00 0.00 61.00 62.11 1fwh s PRO 532 Cb -0.22 -2.17 0.09 0.00 0.04 0.00 0.00 34.50 32.24 1fwh s PRO 532 CO -0.03 -0.09 1.49 1.21 0.04 0.00 0.00 177.00 179.62 1fwh s ASN 533 N -2.40 6.73 -0.12 6.66 2.47 -1.26 -4.43 114.94 122.59 1fwh s ASN 533 Ca 0.61 -2.14 -0.05 0.00 0.42 0.00 0.00 52.86 51.69 1fwh s ASN 533 Cb -0.09 -2.52 -0.04 0.00 -1.45 0.00 0.00 41.25 37.15 1fwh s ASN 533 CO 0.18 -1.19 0.08 -0.51 -3.72 0.00 0.00 177.10 171.94 1fwh s ILE 534 N 3.76 5.02 0.08 -5.21 2.07 -1.26 -0.76 121.20 124.91 1fwh s ILE 534 Ca 0.46 0.03 0.04 0.00 -1.41 0.00 0.00 60.65 59.77 1fwh s ILE 534 Cb 0.00 -3.18 -0.03 0.00 0.13 0.00 0.00 42.46 39.38 1fwh s ILE 534 CO -0.02 0.59 -0.11 0.42 -1.91 0.00 0.00 174.94 173.90 1fwh s THR 535 N -0.74 0.96 -0.10 4.00 -4.23 0.90 -4.87 115.64 111.56 1fwh s THR 535 Ca 0.13 -1.43 0.01 0.00 -1.18 0.00 0.00 61.69 59.21 1fwh s THR 535 Cb -0.12 -1.14 0.02 0.00 1.34 0.00 0.00 72.50 72.60 1fwh s THR 535 CO 0.03 -0.40 -0.12 -0.69 -0.54 0.00 0.00 174.62 172.90 1fwh s VAL 536 N -1.83 1.22 -0.11 2.29 1.01 -1.26 -0.80 120.40 120.93 1fwh s VAL 536 Ca 0.00 -0.47 -0.29 0.00 0.00 0.00 0.00 61.98 61.22 1fwh s VAL 536 Cb -0.07 -1.16 -0.03 0.00 0.00 0.00 0.00 36.38 35.12 1fwh s VAL 536 CO 0.01 0.39 1.43 -0.62 0.00 0.00 0.00 175.10 176.31 1fwh s ASP 537 N 1.16 6.83 0.43 3.32 2.15 -0.44 -4.91 116.67 125.21 1fwh s ASP 537 Ca -0.05 1.94 0.14 0.00 0.43 0.00 0.00 52.55 55.01 1fwh s ASP 537 Cb -0.14 -2.54 1.02 0.00 -0.30 0.00 0.00 42.92 40.96 1fwh s ASP 537 CO -0.03 -0.82 1.95 0.00 -0.17 0.00 0.00 175.17 176.10 1fwh h ALA 538 N 8.72 2.04 0.00 3.66 0.00 -1.96 0.32 119.26 132.04 1fwh h ALA 538 Ca -0.32 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.46 1fwh h ALA 538 Cb 1.14 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1fwh h ALA 538 CO 0.96 -0.20 -0.81 1.96 0.00 0.00 0.00 179.25 181.15 1fwh h GLN 539 N 0.44 0.00 0.00 0.00 7.50 -1.99 -3.41 115.11 117.65 1fwh h GLN 539 Ca 0.32 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.47 1fwh h GLN 539 Cb 0.66 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.19 1fwh h GLN 539 CO -0.10 0.67 -0.49 1.79 -1.50 0.00 0.00 178.83 179.20 1fwh h THR 540 N -1.00 0.00 0.00 -0.54 1.35 -1.97 -3.48 112.91 107.27 1fwh h THR 540 Ca -0.19 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 65.06 1fwh h THR 540 Cb 0.97 1.30 0.00 0.00 -1.73 0.00 0.00 68.15 68.69 1fwh h THR 540 CO -0.11 0.00 0.00 -1.22 -0.25 0.00 0.00 175.52 173.94 1fwh n TYR 541 N -2.32 0.00 -2.03 4.73 4.01 0.11 -4.94 117.16 116.72 1fwh n TYR 541 Ca 0.03 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.36 1fwh n TYR 541 Cb 0.46 -0.88 -0.02 0.00 -0.31 0.00 0.00 39.34 38.59 1fwh n TYR 541 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1fwh s GLU 542 N -0.81 4.28 -0.20 -0.72 2.02 -1.26 -4.36 118.70 117.65 1fwh s GLU 542 Ca 0.00 2.29 -0.10 0.00 0.02 0.00 0.00 54.97 57.18 1fwh s GLU 542 Cb 0.00 -3.09 -0.05 0.00 0.10 0.00 0.00 34.13 31.09 1fwh s GLU 542 CO 0.00 -0.36 0.13 0.08 0.02 0.00 0.00 175.26 175.13 1fwh s VAL 543 N -0.43 5.37 0.03 2.63 1.01 -1.26 -1.32 120.40 126.43 1fwh s VAL 543 Ca 0.56 0.18 0.04 0.00 0.00 0.00 0.00 61.98 62.76 1fwh s VAL 543 Cb -0.41 -3.46 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 1fwh s VAL 543 CO 0.48 0.43 -0.12 -0.13 0.00 0.00 0.00 175.10 175.75 1fwh s ARG 544 N 0.46 0.85 -0.19 2.72 0.52 0.02 -1.21 118.95 122.13 1fwh s ARG 544 Ca 0.08 -0.66 0.01 0.00 -0.52 0.00 0.00 55.73 54.64 1fwh s ARG 544 Cb -0.11 -0.83 0.03 0.00 0.52 0.00 0.00 34.95 34.56 1fwh s ARG 544 CO -0.01 0.21 -0.15 0.08 0.02 0.00 0.00 175.30 175.44 1fwh s VAL 545 N -0.76 1.86 -1.50 3.52 1.01 -0.29 -0.07 120.40 124.17 1fwh s VAL 545 Ca 0.01 -0.96 -0.05 0.00 0.00 0.00 0.00 61.98 60.98 1fwh s VAL 545 Cb -0.07 -1.78 0.02 0.00 0.00 0.00 0.00 36.38 34.54 1fwh s VAL 545 CO 0.01 0.37 0.50 0.47 0.00 0.00 0.00 175.10 176.45 1fwh n ASP 546 N 4.65 -5.54 0.00 3.32 8.00 0.06 -1.73 116.55 125.31 1fwh n ASP 546 Ca -0.18 -0.26 0.00 0.00 0.71 0.00 0.00 54.79 55.06 1fwh n ASP 546 Cb 0.48 -4.51 0.00 0.00 -0.02 0.00 0.00 41.12 37.07 1fwh n ASP 546 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fwh n GLY 547 N -1.38 2.98 3.74 0.44 0.00 -1.26 -5.01 105.19 104.70 1fwh n GLY 547 Ca -0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 1fwh n GLY 547 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1fwh s GLU 548 N -0.18 4.78 0.07 1.61 -1.05 -0.70 -4.94 118.70 118.28 1fwh s GLU 548 Ca 0.00 1.47 -0.31 0.00 -0.15 0.00 0.00 54.97 55.98 1fwh s GLU 548 Cb 0.00 -3.33 -0.07 0.00 -0.44 0.00 0.00 34.13 30.30 1fwh s GLU 548 CO 0.00 0.37 1.31 -1.17 0.95 0.00 0.00 175.26 176.71 1fwh s LEU 549 N -0.59 4.36 -0.23 1.83 2.96 -1.26 -1.14 118.68 124.61 1fwh s LEU 549 Ca 0.44 2.16 -0.08 0.00 -0.22 0.00 0.00 54.13 56.42 1fwh s LEU 549 Cb -0.25 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.83 1fwh s LEU 549 CO 0.31 -0.58 0.10 -0.63 -1.32 0.00 0.00 176.35 174.23 1fwh s ILE 550 N 1.27 4.78 0.31 6.68 -1.09 -0.35 -4.94 121.20 127.86 1fwh s ILE 550 Ca 0.62 -0.02 -0.19 0.00 -2.23 0.00 0.00 60.65 58.83 1fwh s ILE 550 Cb -0.33 -3.22 0.05 0.00 -1.58 0.00 0.00 42.46 37.38 1fwh s ILE 550 CO 0.29 0.36 0.82 0.28 -1.23 0.00 0.00 174.94 175.46 1fwh s THR 551 N 1.20 0.00 0.27 2.92 -1.32 -1.26 -4.43 115.64 113.02 1fwh s THR 551 Ca 0.05 -0.92 -0.20 0.00 -1.21 0.00 0.00 61.69 59.42 1fwh s THR 551 Cb -0.14 -2.57 0.02 0.00 -1.51 0.00 0.00 72.50 68.29 1fwh s THR 551 CO 0.04 0.00 0.68 -0.94 -2.21 0.00 0.00 174.62 172.19 1fwh s SER 552 N -3.06 -0.24 -0.05 8.08 1.04 -1.26 -4.83 113.70 113.38 1fwh s SER 552 Ca 0.15 -0.65 -0.03 0.00 0.48 0.00 0.00 55.95 55.90 1fwh s SER 552 Cb -0.05 0.71 -0.04 0.00 0.10 0.00 0.00 66.02 66.74 1fwh s SER 552 CO 0.09 -1.31 0.09 -1.61 0.98 0.00 0.00 173.24 171.48 1fwh s GLU 553 N -3.93 3.19 0.23 4.02 0.41 -1.26 -4.91 118.70 116.44 1fwh s GLU 553 Ca 0.13 -0.36 -0.30 0.00 -0.41 0.00 0.00 54.97 54.03 1fwh s GLU 553 Cb -0.05 -2.96 -0.09 0.00 -1.78 0.00 0.00 34.13 29.25 1fwh s GLU 553 CO 0.07 0.70 1.19 -1.25 -0.49 0.00 0.00 175.26 175.48 1fwh s PRO 554 N -1.41 4.51 0.26 0.39 0.04 -1.26 -4.90 135.00 132.62 1fwh s PRO 554 Ca 0.20 1.91 -0.27 0.00 0.04 0.00 0.00 61.00 62.88 1fwh s PRO 554 Cb -0.12 -3.20 -0.09 0.00 0.04 0.00 0.00 34.50 31.13 1fwh s PRO 554 CO 0.10 -0.03 0.90 0.00 0.04 0.00 0.00 177.00 178.01 1fwh s ALA 555 N -0.47 3.31 -0.13 8.56 0.00 -0.73 -4.60 121.76 127.70 1fwh s ALA 555 Ca 0.50 0.51 0.18 0.00 0.00 0.00 0.00 51.96 53.15 1fwh s ALA 555 Cb -0.34 -3.13 -0.23 0.00 0.00 0.00 0.00 23.12 19.41 1fwh s ALA 555 CO 0.40 0.22 0.41 -0.40 0.00 0.00 0.00 175.76 176.38 1fwh n ASP 556 N 1.08 0.32 -3.86 0.00 5.75 -1.26 -0.57 116.55 118.01 1fwh n ASP 556 Ca -0.01 0.15 -0.12 0.00 -0.01 0.00 0.00 54.79 54.80 1fwh n ASP 556 Cb 0.49 0.84 -0.13 0.00 -1.03 0.00 0.00 41.12 41.29 1fwh n ASP 556 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1fwh s VAL 557 N -2.80 0.02 0.14 2.12 1.01 -1.26 -4.92 120.40 114.71 1fwh s VAL 557 Ca -0.07 -0.16 0.06 0.00 0.00 0.00 0.00 61.98 61.82 1fwh s VAL 557 Cb 0.08 -0.17 -0.04 0.00 0.00 0.00 0.00 36.38 36.25 1fwh s VAL 557 CO 0.84 -0.09 -0.15 -0.76 0.00 0.00 0.00 175.10 174.95 1fwh s LEU 558 N -0.24 2.43 0.97 3.92 1.43 -1.26 -5.14 118.68 120.80 1fwh s LEU 558 Ca -0.03 -0.85 -0.16 0.00 -1.03 0.00 0.00 54.13 52.05 1fwh s LEU 558 Cb -0.02 -0.60 0.21 0.00 0.03 0.00 0.00 46.19 45.80 1fwh s LEU 558 CO 0.00 -0.14 1.32 -2.84 0.23 0.00 0.00 176.35 174.92 1fwh s PRO 559 N -2.87 0.55 -1.54 1.29 0.02 -1.26 -4.19 135.00 127.02 1fwh s PRO 559 Ca 0.12 -0.41 -0.12 0.00 0.02 0.00 0.00 61.00 60.61 1fwh s PRO 559 Cb -0.04 -1.84 0.08 0.00 0.02 0.00 0.00 34.50 32.73 1fwh s PRO 559 CO 0.04 -2.47 0.83 -1.33 -0.33 0.00 0.00 177.00 173.74 1fwh n MET 560 N -3.81 -4.60 0.00 5.54 2.81 -1.26 -4.89 117.12 110.92 1fwh n MET 560 Ca 0.15 0.52 0.00 0.00 -1.81 0.00 0.00 57.70 56.56 1fwh n MET 560 Cb 0.59 -5.24 0.00 0.00 -0.71 0.00 0.00 33.22 27.86 1fwh n MET 560 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1fwh n ALA 561 N -4.53 0.00 0.16 3.04 0.00 -1.26 -4.96 120.51 112.96 1fwh n ALA 561 Ca -0.03 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.50 1fwh n ALA 561 Cb 0.55 0.00 0.48 0.00 0.00 0.00 0.00 19.45 20.48 1fwh n ALA 561 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1fwh n GLN 562 N 0.00 0.11 0.18 0.00 6.02 -1.26 -1.32 117.38 121.11 1fwh n GLN 562 Ca 0.00 0.60 0.12 0.00 -0.01 0.00 0.00 57.00 57.71 1fwh n GLN 562 Cb 0.00 -2.01 0.22 0.00 1.02 0.00 0.00 30.24 29.47 1fwh n GLN 562 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 1fwh h ARG 563 N 0.00 0.00 0.00 -1.09 2.43 -1.93 -3.37 114.38 110.41 1fwh h ARG 563 Ca 0.00 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.06 1fwh h ARG 563 Cb 0.26 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 1fwh h ARG 563 CO 0.00 0.00 -1.60 0.66 -1.51 0.00 0.00 179.97 177.52 1fwh n TYR 564 N -2.83 0.00 -4.09 2.20 4.02 -0.44 -5.03 117.16 110.99 1fwh n TYR 564 Ca 0.04 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.58 1fwh n TYR 564 Cb 0.50 -0.39 -0.07 0.00 -0.02 0.00 0.00 39.34 39.36 1fwh n TYR 564 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1fwh s PHE 565 N -2.41 3.39 0.24 -0.72 0.40 -1.18 -5.00 117.98 112.70 1fwh s PHE 565 Ca -0.04 0.35 0.13 0.00 -0.60 0.00 0.00 56.93 56.76 1fwh s PHE 565 Cb 0.04 -1.84 0.44 0.00 0.51 0.00 0.00 43.02 42.17 1fwh s PHE 565 CO 0.41 0.61 1.64 1.25 0.70 0.00 0.00 175.22 179.84 1fwh h LEU 566 N 4.79 0.00 -0.30 -0.37 5.85 -1.94 -3.47 115.31 119.87 1fwh h LEU 566 Ca -0.52 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.20 1fwh h LEU 566 Cb 1.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1fwh h LEU 566 CO 0.58 0.55 0.00 0.49 -0.34 0.00 0.00 178.44 179.72