#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fxx s SER 9 N 0.00 7.08 0.24 1.69 1.04 -1.26 -4.78 113.70 117.71 1fxx s SER 9 Ca 0.00 1.87 -0.07 0.00 0.48 0.00 0.00 55.95 58.23 1fxx s SER 9 Cb 0.00 -2.57 -0.02 0.00 0.10 0.00 0.00 66.02 63.53 1fxx s SER 9 CO 0.00 -0.25 0.33 0.42 0.98 0.00 0.00 173.24 174.72 1fxx s THR 10 N -1.74 0.00 -0.05 2.02 -4.23 -0.38 -4.56 115.64 106.71 1fxx s THR 10 Ca 0.55 -1.68 0.03 0.00 -1.18 0.00 0.00 61.69 59.41 1fxx s THR 10 Cb -0.18 -2.37 -0.03 0.00 1.34 0.00 0.00 72.50 71.26 1fxx s THR 10 CO 0.23 0.00 -0.11 -0.36 -0.54 0.00 0.00 174.62 173.84 1fxx s PHE 11 N -3.97 2.80 -0.33 3.99 0.40 -0.85 -0.69 117.98 119.33 1fxx s PHE 11 Ca 0.30 -0.09 0.02 0.00 -0.60 0.00 0.00 56.93 56.57 1fxx s PHE 11 Cb 0.03 -1.65 0.10 0.00 0.51 0.00 0.00 43.02 42.01 1fxx s PHE 11 CO 0.12 0.26 0.06 -1.17 0.70 0.00 0.00 175.22 175.19 1fxx s LEU 12 N -0.87 3.83 0.12 -0.37 2.96 -0.40 -0.92 118.68 123.03 1fxx s LEU 12 Ca 0.13 -1.95 -0.28 0.00 -0.22 0.00 0.00 54.13 51.81 1fxx s LEU 12 Cb -0.11 -1.35 -0.07 0.00 0.50 0.00 0.00 46.19 45.16 1fxx s LEU 12 CO 0.02 -0.39 0.87 -0.36 -1.32 0.00 0.00 176.35 175.17 1fxx s PHE 13 N 1.16 3.84 0.23 5.38 0.40 -0.09 -1.71 117.98 127.19 1fxx s PHE 13 Ca 0.10 1.70 -0.05 0.00 -0.60 0.00 0.00 56.93 58.08 1fxx s PHE 13 Cb -0.18 -2.93 -0.02 0.00 0.51 0.00 0.00 43.02 40.39 1fxx s PHE 13 CO -0.14 0.32 0.29 -3.38 0.70 0.00 0.00 175.22 173.01 1fxx s HIS 14 N -0.41 0.87 -0.19 0.36 -3.43 -0.75 -0.05 115.29 111.70 1fxx s HIS 14 Ca 0.42 -1.14 -0.28 0.00 -0.80 0.00 0.00 55.06 53.26 1fxx s HIS 14 Cb -0.23 -0.25 0.11 0.00 -1.43 0.00 0.00 32.58 30.78 1fxx s HIS 14 CO 0.28 -0.81 0.93 0.34 -2.00 0.00 0.00 174.74 173.48 1fxx s ASP 15 N -3.12 -0.47 0.11 7.38 2.15 -0.39 -4.55 116.67 117.78 1fxx s ASP 15 Ca 0.32 0.68 0.08 0.00 0.43 0.00 0.00 52.55 54.07 1fxx s ASP 15 Cb 0.04 0.61 -0.04 0.00 -0.30 0.00 0.00 42.92 43.23 1fxx s ASP 15 CO 0.12 -0.32 -0.16 -0.31 -0.17 0.00 0.00 175.17 174.32 1fxx s TYR 16 N -0.60 2.58 -0.11 -5.34 1.51 -1.26 -1.79 117.35 112.34 1fxx s TYR 16 Ca -0.02 -0.24 0.03 0.00 -1.01 0.00 0.00 57.07 55.83 1fxx s TYR 16 Cb -0.02 -1.37 0.01 0.00 -0.11 0.00 0.00 41.96 40.47 1fxx s TYR 16 CO 0.01 0.39 -0.20 -1.21 -1.11 0.00 0.00 175.55 173.43 1fxx s GLU 17 N -2.13 2.70 0.42 -0.62 0.41 -0.20 -4.90 118.70 114.38 1fxx s GLU 17 Ca 0.19 -0.75 0.07 0.00 -0.41 0.00 0.00 54.97 54.07 1fxx s GLU 17 Cb -0.11 -2.15 -0.06 0.00 -1.78 0.00 0.00 34.13 30.03 1fxx s GLU 17 CO 0.11 0.04 0.10 0.95 -0.49 0.00 0.00 175.26 175.97 1fxx s THR 18 N 0.68 2.08 -2.43 3.63 -4.23 -1.26 -0.35 115.64 113.76 1fxx s THR 18 Ca -0.12 -1.85 0.24 0.00 -1.18 0.00 0.00 61.69 58.78 1fxx s THR 18 Cb -0.16 -2.93 0.47 0.00 1.34 0.00 0.00 72.50 71.22 1fxx s THR 18 CO 0.02 0.00 1.59 0.49 -0.54 0.00 0.00 174.62 176.18 1fxx n PHE 19 N -1.13 0.14 -3.95 3.99 0.99 0.03 -4.73 117.46 112.79 1fxx n PHE 19 Ca -0.04 -0.07 -0.00 0.00 -0.00 0.00 0.00 57.45 57.34 1fxx n PHE 19 Cb 0.66 0.00 0.02 0.00 -1.00 0.00 0.00 39.48 39.16 1fxx n PHE 19 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.76 176.96 1fxx s GLY 20 N -1.75 0.03 0.11 1.37 0.00 -1.26 -0.93 107.32 104.89 1fxx s GLY 20 Ca 0.35 -0.21 0.20 0.00 0.00 0.00 0.00 44.72 45.05 1fxx s GLY 20 CO 0.30 4.20 0.87 -1.30 0.00 0.00 0.00 173.10 177.17 1fxx n THR 21 N -0.82 0.83 -2.77 0.90 -2.24 -1.26 -4.86 114.28 104.05 1fxx n THR 21 Ca 0.01 -0.61 -0.42 0.00 -2.27 0.00 0.00 64.05 60.75 1fxx n THR 21 Cb 0.59 -0.48 -0.03 0.00 -2.10 0.00 0.00 70.33 68.31 1fxx n THR 21 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1fxx s HIS 22 N -3.17 3.33 0.56 4.78 5.65 -1.26 -4.92 115.29 120.27 1fxx s HIS 22 Ca -0.02 1.31 0.25 0.00 0.25 0.00 0.00 55.06 56.85 1fxx s HIS 22 Cb 0.09 -3.16 1.53 0.00 -1.18 0.00 0.00 32.58 29.87 1fxx s HIS 22 CO 0.81 -0.43 2.13 -1.35 -0.65 0.00 0.00 174.74 175.25 1fxx h PRO 23 N 7.54 0.00 0.00 2.88 0.11 -1.89 -1.06 132.00 139.58 1fxx h PRO 23 Ca -0.22 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.53 1fxx h PRO 23 Cb 1.08 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.13 1fxx h PRO 23 CO 0.92 0.00 -2.31 0.00 -0.21 0.00 0.00 178.00 176.40 1fxx n ALA 24 N -2.44 1.49 0.13 -0.75 0.00 -1.26 -4.43 120.51 113.25 1fxx n ALA 24 Ca 0.01 -0.96 0.07 0.00 0.00 0.00 0.00 53.44 52.56 1fxx n ALA 24 Cb 0.26 0.06 0.04 0.00 0.00 0.00 0.00 19.45 19.81 1fxx n ALA 24 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1fxx h LEU 25 N -0.34 0.00-10.30 0.00 3.38 -1.86 -3.46 115.31 102.73 1fxx h LEU 25 Ca -0.55 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 56.97 1fxx h LEU 25 Cb 1.68 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.44 1fxx h LEU 25 CO -0.19 0.24 -0.30 -1.81 0.09 0.00 0.00 178.44 176.47 1fxx s ASP 26 N -5.98 6.03 0.12 -0.43 1.01 -0.41 -5.00 116.67 112.02 1fxx s ASP 26 Ca 0.02 -0.01 0.07 0.00 0.71 0.00 0.00 52.55 53.35 1fxx s ASP 26 Cb 0.08 -1.46 -0.04 0.00 1.01 0.00 0.00 42.92 42.50 1fxx s ASP 26 CO 0.75 -0.41 -0.05 -0.13 0.21 0.00 0.00 175.17 175.54 1fxx s ARG 27 N -4.22 2.29 0.39 8.23 1.81 -1.26 -4.80 118.95 121.39 1fxx s ARG 27 Ca 0.43 -1.01 -0.25 0.00 -1.72 0.00 0.00 55.73 53.19 1fxx s ARG 27 Cb -0.10 -2.37 -0.09 0.00 -0.45 0.00 0.00 34.95 31.95 1fxx s ARG 27 CO 0.32 0.50 1.06 -1.25 -0.68 0.00 0.00 175.30 175.25 1fxx s PRO 28 N -2.44 4.21 -0.18 3.54 0.04 -1.26 -0.79 135.00 138.11 1fxx s PRO 28 Ca 0.24 1.56 -0.05 0.00 0.04 0.00 0.00 61.00 62.79 1fxx s PRO 28 Cb -0.11 -2.62 -0.09 0.00 0.04 0.00 0.00 34.50 31.72 1fxx s PRO 28 CO 0.16 -0.11 -0.21 0.00 0.04 0.00 0.00 177.00 176.88 1fxx n ALA 29 N 0.07 1.74 -3.06 8.56 0.00 0.52 -4.55 120.51 123.80 1fxx n ALA 29 Ca 0.04 -0.74 -0.11 0.00 0.00 0.00 0.00 53.44 52.64 1fxx n ALA 29 Cb 0.49 0.20 -0.11 0.00 0.00 0.00 0.00 19.45 20.03 1fxx n ALA 29 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1fxx s GLN 30 N -2.34 0.37 -0.01 0.00 0.74 -0.49 -1.73 119.66 116.20 1fxx s GLN 30 Ca -0.25 -0.31 0.03 0.00 0.05 0.00 0.00 55.36 54.88 1fxx s GLN 30 Cb 0.08 0.15 -0.01 0.00 1.10 0.00 0.00 33.01 34.34 1fxx s GLN 30 CO 0.35 -0.08 -0.10 0.12 -0.55 0.00 0.00 175.29 175.03 1fxx s PHE 31 N -1.07 0.92 -0.01 1.67 5.36 -0.25 -1.03 117.98 123.56 1fxx s PHE 31 Ca -0.12 -0.18 -0.01 0.00 -0.96 0.00 0.00 56.93 55.67 1fxx s PHE 31 Cb -0.07 -0.59 0.01 0.00 -0.34 0.00 0.00 43.02 42.03 1fxx s PHE 31 CO 0.01 -0.01 0.03 0.00 -1.46 0.00 0.00 175.22 173.78 1fxx s ALA 32 N -0.27 -0.04 0.01 11.12 0.00 -0.74 -1.61 121.76 130.23 1fxx s ALA 32 Ca 0.04 0.13 -0.01 0.00 0.00 0.00 0.00 51.96 52.12 1fxx s ALA 32 Cb -0.04 -0.09 -0.01 0.00 0.00 0.00 0.00 23.12 22.98 1fxx s ALA 32 CO -0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 175.76 175.72 1fxx s ALA 33 N 0.25 0.03 -0.04 0.00 0.00 -0.24 -1.26 121.76 120.50 1fxx s ALA 33 Ca -0.02 -0.34 -0.01 0.00 0.00 0.00 0.00 51.96 51.59 1fxx s ALA 33 Cb -0.03 0.09 0.03 0.00 0.00 0.00 0.00 23.12 23.21 1fxx s ALA 33 CO -0.01 -0.11 0.06 0.42 0.00 0.00 0.00 175.76 176.12 1fxx s ILE 34 N -0.96 -0.10 -0.07 0.00 1.01 0.92 -1.00 121.20 121.01 1fxx s ILE 34 Ca -0.11 0.33 -0.18 0.00 0.00 0.00 0.00 60.65 60.69 1fxx s ILE 34 Cb -0.07 -0.14 -0.05 0.00 0.01 0.00 0.00 42.46 42.22 1fxx s ILE 34 CO -0.00 0.14 0.50 -0.60 0.00 0.00 0.00 174.94 174.97 1fxx s ARG 35 N 1.70 4.27 0.36 2.79 6.06 -1.26 -0.91 118.95 131.96 1fxx s ARG 35 Ca -0.01 0.53 0.04 0.00 -2.50 0.00 0.00 55.73 53.79 1fxx s ARG 35 Cb -0.12 -3.38 -0.03 0.00 0.06 0.00 0.00 34.95 31.48 1fxx s ARG 35 CO -0.03 0.30 0.17 0.95 -2.50 0.00 0.00 175.30 174.18 1fxx s THR 36 N 0.13 0.40 0.26 4.11 -4.23 -0.10 -0.46 115.64 115.75 1fxx s THR 36 Ca 0.27 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.82 1fxx s THR 36 Cb -0.16 -2.43 0.04 0.00 1.34 0.00 0.00 72.50 71.29 1fxx s THR 36 CO 0.13 0.00 0.34 -0.90 -0.54 0.00 0.00 174.62 173.65 1fxx n ASP 37 N -1.26 0.98 0.14 3.99 3.85 -0.64 -2.00 116.55 121.61 1fxx n ASP 37 Ca -0.01 -1.69 0.19 0.00 -0.71 0.00 0.00 54.79 52.57 1fxx n ASP 37 Cb 0.64 -0.18 0.78 0.00 -1.35 0.00 0.00 41.12 41.01 1fxx n ASP 37 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.20 176.47 1fxx h SER 38 N 0.06 0.00 -0.56 -1.12 0.02 -1.91 0.20 113.55 110.23 1fxx h SER 38 Ca -0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 1fxx h SER 38 Cb 0.55 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.09 1fxx h SER 38 CO 0.18 0.00 0.00 -0.62 -1.14 0.00 0.00 176.83 175.25 1fxx n GLU 39 N -3.79 2.60 -2.08 3.45 -0.58 -1.26 -4.95 120.64 114.03 1fxx n GLU 39 Ca 0.05 -2.46 -0.06 0.00 -0.42 0.00 0.00 57.16 54.26 1fxx n GLU 39 Cb 0.48 -1.54 -0.00 0.00 -0.57 0.00 0.00 31.44 29.80 1fxx n GLU 39 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 1fxx n PHE 40 N 1.57 -0.29 -3.43 -0.32 0.99 0.70 -5.00 117.46 111.67 1fxx n PHE 40 Ca 0.22 0.00 -0.38 0.00 -0.00 0.00 0.00 57.45 57.29 1fxx n PHE 40 Cb 0.61 -1.90 -0.08 0.00 -1.00 0.00 0.00 39.48 37.11 1fxx n PHE 40 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 176.76 175.96 1fxx s ASN 41 N -2.72 6.42 0.22 4.37 0.01 -1.26 -4.77 114.94 117.20 1fxx s ASN 41 Ca 0.00 0.49 -0.32 0.00 -0.71 0.00 0.00 52.86 52.32 1fxx s ASN 41 Cb 0.00 -2.21 -0.13 0.00 0.41 0.00 0.00 41.25 39.32 1fxx s ASN 41 CO 0.00 -0.03 1.61 0.52 -1.51 0.00 0.00 177.10 177.69 1fxx n VAL 42 N 4.19 0.34 -5.01 1.60 0.31 -1.26 -1.62 118.33 116.89 1fxx n VAL 42 Ca -0.09 -0.09 -0.32 0.00 -0.01 0.00 0.00 64.34 63.83 1fxx n VAL 42 Cb 0.51 -1.78 -0.14 0.00 -0.91 0.00 0.00 33.84 31.52 1fxx n VAL 42 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1fxx s ILE 43 N 0.68 2.74 0.00 2.52 1.01 0.39 -4.91 121.20 123.62 1fxx s ILE 43 Ca 0.73 -0.84 0.00 0.00 0.00 0.00 0.00 60.65 60.54 1fxx s ILE 43 Cb -0.57 -2.05 0.00 0.00 0.01 0.00 0.00 42.46 39.85 1fxx s ILE 43 CO 0.40 0.58 0.00 0.61 0.00 0.00 0.00 174.94 176.53 1fxx n GLY 44 N 2.49 -1.10 3.78 6.18 0.00 -1.26 -4.32 105.19 110.96 1fxx n GLY 44 Ca -0.17 -1.11 -0.28 0.00 0.00 0.00 0.00 46.02 44.45 1fxx n GLY 44 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fxx s GLU 45 N 0.00 2.89 0.41 1.61 2.02 -1.26 -4.96 118.70 119.40 1fxx s GLU 45 Ca 0.00 -0.77 -0.27 0.00 0.02 0.00 0.00 54.97 53.95 1fxx s GLU 45 Cb 0.00 -2.69 -0.10 0.00 0.10 0.00 0.00 34.13 31.45 1fxx s GLU 45 CO 0.00 0.53 1.45 -2.14 0.02 0.00 0.00 175.26 175.12 1fxx s PRO 46 N -2.72 3.90 -0.17 0.39 0.02 -1.26 -4.81 135.00 130.35 1fxx s PRO 46 Ca 0.30 2.49 -0.05 0.00 0.02 0.00 0.00 61.00 63.76 1fxx s PRO 46 Cb -0.11 -2.82 -0.03 0.00 0.02 0.00 0.00 34.50 31.56 1fxx s PRO 46 CO 0.23 -0.67 -0.00 -1.21 -0.33 0.00 0.00 177.00 175.01 1fxx s GLU 47 N -2.27 3.72 -0.12 5.54 0.41 -0.17 -4.99 118.70 120.82 1fxx s GLU 47 Ca 0.57 -0.48 -0.05 0.00 -0.41 0.00 0.00 54.97 54.59 1fxx s GLU 47 Cb -0.45 -3.03 0.06 0.00 -1.78 0.00 0.00 34.13 28.93 1fxx s GLU 47 CO 0.60 0.18 0.26 0.08 -0.49 0.00 0.00 175.26 175.89 1fxx s VAL 48 N 0.55 -0.22 0.16 2.63 1.01 -1.26 -1.08 120.40 122.19 1fxx s VAL 48 Ca -0.01 0.21 -0.16 0.00 0.00 0.00 0.00 61.98 62.01 1fxx s VAL 48 Cb -0.14 -0.42 0.03 0.00 0.00 0.00 0.00 36.38 35.85 1fxx s VAL 48 CO 0.02 0.09 0.45 0.72 0.00 0.00 0.00 175.10 176.38 1fxx s PHE 49 N 1.81 -0.13 0.31 5.22 -0.12 -0.64 -5.01 117.98 119.43 1fxx s PHE 49 Ca -0.04 -0.20 0.08 0.00 -0.05 0.00 0.00 56.93 56.71 1fxx s PHE 49 Cb -0.11 0.30 -0.04 0.00 -0.63 0.00 0.00 43.02 42.54 1fxx s PHE 49 CO -0.09 -0.80 0.14 0.71 -0.05 0.00 0.00 175.22 175.13 1fxx s TYR 50 N -3.85 2.79 -0.13 3.49 1.51 -1.26 -1.09 117.35 118.82 1fxx s TYR 50 Ca 0.07 -0.30 0.03 0.00 -1.01 0.00 0.00 57.07 55.86 1fxx s TYR 50 Cb 0.01 -1.53 0.00 0.00 -0.11 0.00 0.00 41.96 40.33 1fxx s TYR 50 CO -0.07 0.40 -0.21 0.00 -1.11 0.00 0.00 175.55 174.56 1fxx s LYS 52 N 0.61 4.44 0.27 0.00 1.02 0.10 -4.61 119.74 121.58 1fxx s LYS 52 Ca -0.12 1.84 -0.29 0.00 0.02 0.00 0.00 55.97 57.42 1fxx s LYS 52 Cb -0.16 -3.30 -0.09 0.00 -0.52 0.00 0.00 37.83 33.75 1fxx s LYS 52 CO 0.03 -0.22 1.02 -2.14 -0.92 0.00 0.00 175.35 173.12 1fxx s PRO 53 N 0.64 4.72 0.72 -1.68 0.02 -1.26 -4.41 135.00 133.74 1fxx s PRO 53 Ca 0.57 1.62 -0.11 0.00 0.02 0.00 0.00 61.00 63.11 1fxx s PRO 53 Cb -0.31 -3.18 0.02 0.00 0.02 0.00 0.00 34.50 31.04 1fxx s PRO 53 CO 0.32 0.34 1.08 0.00 -0.33 0.00 0.00 177.00 178.41 1fxx s ALA 54 N -1.21 2.73 -2.00 -1.55 0.00 -1.26 -4.96 121.76 113.50 1fxx s ALA 54 Ca 0.44 -0.22 0.05 0.00 0.00 0.00 0.00 51.96 52.23 1fxx s ALA 54 Cb -0.28 -3.07 0.32 0.00 0.00 0.00 0.00 23.12 20.09 1fxx s ALA 54 CO 0.35 -1.24 1.12 -0.40 0.00 0.00 0.00 175.76 175.59 1fxx n ASP 55 N -3.10 0.00 -1.24 0.00 3.85 -1.26 -3.38 116.55 111.42 1fxx n ASP 55 Ca 0.07 -1.64 -0.05 0.00 -0.71 0.00 0.00 54.79 52.46 1fxx n ASP 55 Cb 0.56 0.00 0.20 0.00 -1.35 0.00 0.00 41.12 40.54 1fxx n ASP 55 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 1fxx n ASP 56 N -0.59 2.74 -3.78 -1.12 3.85 -1.26 -4.95 116.55 111.44 1fxx n ASP 56 Ca 0.04 -3.68 -0.13 0.00 -0.71 0.00 0.00 54.79 50.31 1fxx n ASP 56 Cb 0.02 -0.65 -0.11 0.00 -1.35 0.00 0.00 41.12 39.04 1fxx n ASP 56 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.20 175.72 1fxx s TYR 57 N -3.21 -0.24 -0.04 2.11 5.04 -1.22 -5.00 117.35 114.79 1fxx s TYR 57 Ca 0.46 0.56 0.06 0.00 -2.44 0.00 0.00 57.07 55.71 1fxx s TYR 57 Cb 0.41 0.09 -0.01 0.00 0.35 0.00 0.00 41.96 42.79 1fxx s TYR 57 CO 0.02 -0.21 -0.23 -0.51 -1.34 0.00 0.00 175.55 173.28 1fxx s LEU 58 N -0.29 2.03 0.62 6.97 1.43 -1.26 -4.91 118.68 123.27 1fxx s LEU 58 Ca -0.04 -0.45 -0.15 0.00 -1.03 0.00 0.00 54.13 52.45 1fxx s LEU 58 Cb -0.03 -1.24 -0.02 0.00 0.03 0.00 0.00 46.19 44.93 1fxx s LEU 58 CO 0.01 0.23 1.07 -2.84 0.23 0.00 0.00 176.35 175.06 1fxx s PRO 59 N -0.21 3.16 -0.12 1.29 0.02 -1.26 -4.99 135.00 132.89 1fxx s PRO 59 Ca -0.01 1.24 -0.29 0.00 0.02 0.00 0.00 61.00 61.96 1fxx s PRO 59 Cb -0.12 -2.01 -0.02 0.00 0.02 0.00 0.00 34.50 32.37 1fxx s PRO 59 CO 0.02 -0.94 1.27 -0.65 -0.33 0.00 0.00 177.00 176.37 1fxx s GLN 60 N -4.13 4.26 0.26 5.54 -0.21 -0.10 -4.91 119.66 120.37 1fxx s GLN 60 Ca 0.64 1.71 -0.02 0.00 0.02 0.00 0.00 55.36 57.71 1fxx s GLN 60 Cb -0.17 -3.71 0.52 0.00 1.00 0.00 0.00 33.01 30.65 1fxx s GLN 60 CO 0.39 -0.64 1.75 -1.35 -2.12 0.00 0.00 175.29 173.32 1fxx h PRO 61 N 8.05 0.53 -0.93 2.91 0.11 -1.94 -1.15 132.00 139.57 1fxx h PRO 61 Ca -0.30 -0.03 0.07 0.00 0.11 0.00 0.00 66.00 65.85 1fxx h PRO 61 Cb 1.13 -0.12 -0.06 0.00 0.11 0.00 0.00 31.00 32.05 1fxx h PRO 61 CO 0.94 0.35 0.61 0.78 -0.21 0.00 0.00 178.00 180.47 1fxx h GLY 62 N 0.54 1.38 1.13 -0.55 0.00 -1.94 -1.49 103.07 102.15 1fxx h GLY 62 Ca 0.45 -0.43 -0.10 0.00 0.00 0.00 0.00 47.33 47.26 1fxx h GLY 62 CO -0.39 0.30 -0.05 0.00 0.00 0.00 0.00 176.54 176.40 1fxx h ALA 63 N 1.50 0.84 -0.19 3.60 0.00 -1.49 -2.50 119.26 121.02 1fxx h ALA 63 Ca 0.41 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1fxx h ALA 63 Cb 0.22 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1fxx h ALA 63 CO -0.16 0.66 -0.21 0.28 0.00 0.00 0.00 179.25 179.82 1fxx h VAL 64 N 0.93 1.24 -0.07 0.00 2.07 -0.99 -2.09 116.25 117.33 1fxx h VAL 64 Ca 0.16 -1.09 -0.12 0.00 0.82 0.00 0.00 66.70 66.47 1fxx h VAL 64 Cb 0.60 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 1fxx h VAL 64 CO 0.04 0.34 -0.50 -0.07 0.02 0.00 0.00 177.57 177.40 1fxx h LEU 65 N 0.31 0.21 -0.16 2.57 3.38 -1.01 0.53 115.31 121.13 1fxx h LEU 65 Ca 0.05 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 57.82 1fxx h LEU 65 Cb 0.55 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1fxx h LEU 65 CO 0.04 0.68 -0.29 0.40 0.09 0.00 0.00 178.44 179.36 1fxx h ILE 66 N 0.15 1.35 0.00 1.22 1.08 -1.00 -3.34 117.51 116.98 1fxx h ILE 66 Ca 0.01 -1.53 -0.08 0.00 -0.39 0.00 0.00 64.86 62.87 1fxx h ILE 66 Cb 0.94 1.95 -0.01 0.00 -3.07 0.00 0.00 36.82 36.62 1fxx h ILE 66 CO 0.07 0.46 -1.30 0.35 -0.69 0.00 0.00 178.15 177.04 1fxx n THR 67 N -4.39 0.82 -1.12 -0.27 -2.24 -0.83 -4.91 114.28 101.33 1fxx n THR 67 Ca -0.06 -0.61 -0.04 0.00 -2.27 0.00 0.00 64.05 61.06 1fxx n THR 67 Cb 0.47 -0.47 -0.02 0.00 -2.10 0.00 0.00 70.33 68.20 1fxx n THR 67 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fxx n GLY 68 N 1.29 0.69 3.39 3.38 0.00 0.17 -4.92 105.19 109.20 1fxx n GLY 68 Ca -0.05 -0.41 -0.38 0.00 0.00 0.00 0.00 46.02 45.17 1fxx n GLY 68 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fxx s ILE 69 N -2.01 4.31 0.44 -0.61 1.01 -1.25 -5.07 121.20 118.02 1fxx s ILE 69 Ca 0.00 -0.55 -0.06 0.00 0.00 0.00 0.00 60.65 60.04 1fxx s ILE 69 Cb 0.00 -3.21 -0.04 0.00 0.01 0.00 0.00 42.46 39.22 1fxx s ILE 69 CO 0.00 0.07 0.74 0.42 0.00 0.00 0.00 174.94 176.17 1fxx s THR 70 N 1.56 4.91 0.37 2.92 -4.23 -1.26 -4.74 115.64 115.17 1fxx s THR 70 Ca 0.04 0.21 0.04 0.00 -1.18 0.00 0.00 61.69 60.79 1fxx s THR 70 Cb -0.17 -3.83 0.26 0.00 1.34 0.00 0.00 72.50 70.10 1fxx s THR 70 CO 0.04 -0.72 2.02 -0.65 -0.54 0.00 0.00 174.62 174.77 1fxx h PRO 71 N 0.57 0.75 -0.42 3.99 0.11 -1.98 -1.76 132.00 133.26 1fxx h PRO 71 Ca -0.47 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.56 1fxx h PRO 71 Cb 1.20 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 1fxx h PRO 71 CO 0.62 0.50 0.13 1.96 -0.21 0.00 0.00 178.00 181.01 1fxx h GLN 72 N 0.77 0.66 -0.18 1.05 7.50 -1.94 0.18 115.11 123.15 1fxx h GLN 72 Ca 0.21 -0.14 -0.01 0.00 0.50 0.00 0.00 58.65 59.21 1fxx h GLN 72 Cb -0.08 -0.10 -0.01 0.00 0.05 0.00 0.00 27.48 27.35 1fxx h GLN 72 CO -0.04 0.64 0.09 1.49 -1.50 0.00 0.00 178.83 179.51 1fxx h GLU 73 N 0.54 0.25 -0.94 1.46 4.81 -1.81 -0.83 114.58 118.07 1fxx h GLU 73 Ca 0.14 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1fxx h GLU 73 Cb 0.26 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.55 1fxx h GLU 73 CO -0.00 0.27 0.60 0.00 -0.73 0.00 0.00 179.01 179.15 1fxx h ALA 74 N 0.97 1.19 -0.45 2.92 0.00 -1.13 -0.12 119.26 122.64 1fxx h ALA 74 Ca 0.06 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1fxx h ALA 74 Cb 0.10 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1fxx h ALA 74 CO -0.01 0.61 -0.07 -0.09 0.00 0.00 0.00 179.25 179.69 1fxx h ARG 75 N 1.28 0.78 0.05 0.00 2.43 -0.38 0.12 114.38 118.66 1fxx h ARG 75 Ca 0.34 -0.24 -0.23 0.00 -0.81 0.00 0.00 59.98 59.04 1fxx h ARG 75 Cb -0.11 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 1fxx h ARG 75 CO -0.07 0.84 -1.03 0.00 -1.51 0.00 0.00 179.97 178.19 1fxx h ALA 76 N 1.20 0.32 0.00 2.80 0.00 -0.56 -3.36 119.26 119.67 1fxx h ALA 76 Ca 0.13 -0.81 -0.03 0.00 0.00 0.00 0.00 54.91 54.20 1fxx h ALA 76 Cb 0.54 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1fxx h ALA 76 CO 0.03 0.99 -1.76 1.63 0.00 0.00 0.00 179.25 180.14 1fxx n LYS 77 N -3.57 0.65 -1.45 0.00 5.02 -0.11 -5.03 118.16 113.67 1fxx n LYS 77 Ca -0.05 -0.10 -0.07 0.00 -2.02 0.00 0.00 58.31 56.07 1fxx n LYS 77 Cb 0.91 -1.60 0.03 0.00 -0.02 0.00 0.00 35.03 34.35 1fxx n LYS 77 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1fxx n GLY 78 N 1.27 1.21 3.61 0.72 0.00 0.40 -4.57 105.19 107.83 1fxx n GLY 78 Ca -0.05 -2.05 -0.27 0.00 0.00 0.00 0.00 46.02 43.65 1fxx n GLY 78 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fxx s GLU 79 N -3.16 1.96 0.79 1.61 2.02 -0.94 -4.66 118.70 116.31 1fxx s GLU 79 Ca 0.22 -1.98 -0.12 0.00 0.02 0.00 0.00 54.97 53.11 1fxx s GLU 79 Cb -0.01 -1.73 0.07 0.00 0.10 0.00 0.00 34.13 32.55 1fxx s GLU 79 CO 0.15 0.03 1.12 0.54 0.02 0.00 0.00 175.26 177.11 1fxx s ASN 80 N -3.70 4.16 0.44 -0.19 2.20 -1.26 0.03 114.94 116.61 1fxx s ASN 80 Ca 0.35 2.01 0.16 0.00 -0.94 0.00 0.00 52.86 54.43 1fxx s ASN 80 Cb 0.06 -2.55 1.07 0.00 -2.00 0.00 0.00 41.25 37.83 1fxx s ASN 80 CO 0.18 -2.27 1.95 -0.08 -2.94 0.00 0.00 177.10 173.94 1fxx h GLU 81 N -1.03 0.37 -0.60 3.55 4.81 -1.93 -0.38 114.58 119.36 1fxx h GLU 81 Ca -0.44 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 58.74 1fxx h GLU 81 Cb 1.25 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 30.52 1fxx h GLU 81 CO 0.49 0.25 0.30 0.00 -0.73 0.00 0.00 179.01 179.32 1fxx h ALA 82 N 1.67 0.77 -0.23 2.92 0.00 -1.96 0.26 119.26 122.69 1fxx h ALA 82 Ca 0.32 -0.12 -0.18 0.00 0.00 0.00 0.00 54.91 54.92 1fxx h ALA 82 Cb 0.73 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1fxx h ALA 82 CO -0.09 0.32 -0.56 0.00 0.00 0.00 0.00 179.25 178.92 1fxx h ALA 83 N 1.13 0.38 -0.42 0.00 0.00 -1.70 -1.65 119.26 117.01 1fxx h ALA 83 Ca 0.21 -0.52 0.07 0.00 0.00 0.00 0.00 54.91 54.67 1fxx h ALA 83 Cb 0.10 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 1fxx h ALA 83 CO -0.03 0.61 0.07 0.35 0.00 0.00 0.00 179.25 180.25 1fxx h PHE 84 N 0.55 0.10 -0.31 0.00 3.57 -0.76 -1.78 116.94 118.31 1fxx h PHE 84 Ca -0.00 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.41 1fxx h PHE 84 Cb 1.18 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.92 1fxx h PHE 84 CO 0.08 -0.01 -0.28 0.00 -2.23 0.00 0.00 178.31 175.88 1fxx h ALA 85 N 1.33 0.94 -0.34 2.41 0.00 -0.39 -2.76 119.26 120.45 1fxx h ALA 85 Ca 0.20 -0.38 0.05 0.00 0.00 0.00 0.00 54.91 54.78 1fxx h ALA 85 Cb 0.26 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 1fxx h ALA 85 CO -0.28 0.61 0.07 0.00 0.00 0.00 0.00 179.25 179.65 1fxx h ALA 86 N 1.15 0.36 -0.55 0.00 0.00 -0.48 0.18 119.26 119.93 1fxx h ALA 86 Ca 0.07 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1fxx h ALA 86 Cb 0.76 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1fxx h ALA 86 CO 0.06 -0.33 0.13 0.00 0.00 0.00 0.00 179.25 179.11 1fxx h ARG 87 N 0.19 0.88 -0.49 0.00 3.08 -1.26 -1.91 114.38 114.87 1fxx h ARG 87 Ca 0.16 -0.21 -0.10 0.00 0.07 0.00 0.00 59.98 59.89 1fxx h ARG 87 Cb 0.17 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 1fxx h ARG 87 CO -0.20 0.83 -0.11 0.82 -1.07 0.00 0.00 179.97 180.24 1fxx h ILE 88 N 0.78 1.26 -0.28 2.04 2.04 -1.18 -2.32 117.51 119.85 1fxx h ILE 88 Ca 0.17 -1.22 -0.05 0.00 1.00 0.00 0.00 64.86 64.76 1fxx h ILE 88 Cb 0.34 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 1fxx h ILE 88 CO 0.00 0.43 -0.04 -0.74 0.00 0.00 0.00 178.15 177.80 1fxx h HIS 89 N 0.81 0.46 -0.03 1.37 2.76 -0.37 -0.79 115.15 119.35 1fxx h HIS 89 Ca 0.13 -0.05 -0.01 0.00 -2.20 0.00 0.00 60.37 58.25 1fxx h HIS 89 Cb 0.63 -0.13 -0.00 0.00 1.55 0.00 0.00 27.41 29.46 1fxx h HIS 89 CO 0.04 0.48 -0.01 0.77 -1.30 0.00 0.00 177.93 177.91 1fxx h SER 90 N 0.42 0.06 -0.89 3.26 0.02 -0.99 -1.49 113.55 113.95 1fxx h SER 90 Ca 0.09 -0.35 0.00 0.00 -0.84 0.00 0.00 61.79 60.69 1fxx h SER 90 Cb 0.34 -0.02 -0.04 0.00 0.14 0.00 0.00 62.40 62.82 1fxx h SER 90 CO 0.01 0.40 0.55 -0.07 -1.14 0.00 0.00 176.83 176.59 1fxx h LEU 91 N -0.28 1.05 -0.64 5.07 3.38 -1.20 -2.75 115.31 119.94 1fxx h LEU 91 Ca 0.01 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1fxx h LEU 91 Cb 0.37 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1fxx h LEU 91 CO 0.00 0.79 0.00 -0.26 0.09 0.00 0.00 178.44 179.06 1fxx h PHE 92 N 1.21 0.00 -0.68 1.13 -1.00 -1.10 -3.24 116.94 113.26 1fxx h PHE 92 Ca 0.32 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.10 1fxx h PHE 92 Cb -0.08 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.48 1fxx h PHE 92 CO -0.00 0.00 0.00 0.25 -1.61 0.00 0.00 178.31 176.95 1fxx n THR 93 N -2.91 1.21 -2.38 -1.55 -2.24 -0.57 -4.87 114.28 100.98 1fxx n THR 93 Ca 0.03 -1.01 -0.42 0.00 -2.27 0.00 0.00 64.05 60.38 1fxx n THR 93 Cb 0.40 0.35 -0.03 0.00 -2.10 0.00 0.00 70.33 68.95 1fxx n THR 93 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1fxx s VAL 94 N -1.31 3.91 0.67 2.28 1.01 -1.22 -4.97 120.40 120.77 1fxx s VAL 94 Ca 0.48 1.37 -0.17 0.00 0.00 0.00 0.00 61.98 63.66 1fxx s VAL 94 Cb 0.27 -3.88 -0.03 0.00 0.00 0.00 0.00 36.38 32.74 1fxx s VAL 94 CO 0.29 0.10 0.83 -2.65 0.00 0.00 0.00 175.10 173.68 1fxx n PRO 95 N 3.96 0.57 -3.71 2.72 -0.02 -1.26 -3.58 135.00 133.69 1fxx n PRO 95 Ca 0.09 0.24 -0.28 0.00 -2.02 0.00 0.00 63.50 61.54 1fxx n PRO 95 Cb 0.46 -2.07 0.03 0.00 -0.02 0.00 0.00 33.50 31.89 1fxx n PRO 95 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1fxx n LYS 96 N -1.20 -5.32 -4.27 -0.52 5.02 0.18 -4.77 118.16 107.29 1fxx n LYS 96 Ca 0.13 0.63 -0.34 0.00 -2.02 0.00 0.00 58.31 56.70 1fxx n LYS 96 Cb 0.49 -5.51 -0.10 0.00 -0.02 0.00 0.00 35.03 29.89 1fxx n LYS 96 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1fxx s THR 97 N -3.23 4.35 -0.48 -0.18 2.01 -1.23 -1.25 115.64 115.63 1fxx s THR 97 Ca 0.58 -0.21 -0.13 0.00 0.31 0.00 0.00 61.69 62.24 1fxx s THR 97 Cb -0.29 -2.89 0.10 0.00 0.01 0.00 0.00 72.50 69.43 1fxx s THR 97 CO 0.72 0.53 0.39 0.00 -0.69 0.00 0.00 174.62 175.57 1fxx s ILE 99 N 1.54 4.78 0.22 0.00 1.09 0.03 -1.27 121.20 127.60 1fxx s ILE 99 Ca 0.04 1.94 -0.08 0.00 -1.10 0.00 0.00 60.65 61.45 1fxx s ILE 99 Cb -0.26 -4.27 -0.02 0.00 -1.06 0.00 0.00 42.46 36.86 1fxx s ILE 99 CO 0.04 -0.03 0.32 -1.48 -0.10 0.00 0.00 174.94 173.68 1fxx s LEU 100 N 2.33 0.72 0.00 2.97 2.34 -0.70 -2.03 118.68 124.32 1fxx s LEU 100 Ca 0.45 -1.11 0.00 0.00 0.06 0.00 0.00 54.13 53.53 1fxx s LEU 100 Cb -0.17 1.15 0.00 0.00 -0.56 0.00 0.00 46.19 46.61 1fxx s LEU 100 CO 0.14 -1.00 0.00 0.61 -1.06 0.00 0.00 176.35 175.04 1fxx n GLY 101 N -0.32 2.49 2.92 -3.48 0.00 -1.25 -1.81 105.19 103.75 1fxx n GLY 101 Ca -0.01 -0.41 -0.30 0.00 0.00 0.00 0.00 46.02 45.30 1fxx n GLY 101 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1fxx s TYR 102 N -1.12 2.48 -0.66 1.61 5.04 -1.26 -1.57 117.35 121.86 1fxx s TYR 102 Ca 0.00 -1.91 0.00 0.00 -2.44 0.00 0.00 57.07 52.72 1fxx s TYR 102 Cb 0.00 -1.77 0.00 0.00 0.35 0.00 0.00 41.96 40.54 1fxx s TYR 102 CO 0.00 -0.81 0.00 -1.71 -1.34 0.00 0.00 175.55 171.69 1fxx n ASN 103 N 4.64 -3.77 0.16 4.32 5.15 -1.26 -4.93 115.26 119.57 1fxx n ASN 103 Ca -0.09 0.15 0.01 0.00 -0.60 0.00 0.00 54.58 54.06 1fxx n ASN 103 Cb 0.43 -1.82 0.32 0.00 -0.53 0.00 0.00 39.78 38.19 1fxx n ASN 103 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1fxx h ASN 104 N 0.00 0.08 -0.30 1.20 -1.07 -1.90 -2.06 115.58 111.52 1fxx h ASN 104 Ca -0.13 -0.03 -0.07 0.00 0.07 0.00 0.00 56.30 56.14 1fxx h ASN 104 Cb 0.41 -0.02 -0.02 0.00 -2.07 0.00 0.00 38.32 36.62 1fxx h ASN 104 CO 0.19 0.45 -0.04 0.58 0.07 0.00 0.00 177.43 178.67 1fxx h VAL 105 N 0.07 1.24 0.00 6.14 2.07 -1.92 0.67 116.25 124.52 1fxx h VAL 105 Ca 0.01 -1.00 0.00 0.00 0.82 0.00 0.00 66.70 66.53 1fxx h VAL 105 Cb 0.69 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 1fxx h VAL 105 CO 0.05 0.34 -1.04 -1.14 0.02 0.00 0.00 177.57 175.81 1fxx n ARG 106 N -4.21 0.55 0.00 1.57 3.00 -1.15 -4.65 116.66 111.76 1fxx n ARG 106 Ca 0.02 0.08 0.00 0.00 -0.00 0.00 0.00 57.85 57.95 1fxx n ARG 106 Cb 0.31 -1.77 0.00 0.00 0.00 0.00 0.00 32.46 31.00 1fxx n ARG 106 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1fxx n PHE 107 N -2.52 0.00 -0.30 -0.14 7.35 -0.78 -4.82 117.46 116.24 1fxx n PHE 107 Ca 0.00 0.00 0.12 0.00 -0.76 0.00 0.00 57.45 56.81 1fxx n PHE 107 Cb 0.53 0.16 0.29 0.00 0.35 0.00 0.00 39.48 40.81 1fxx n PHE 107 CO 0.00 0.00 0.00 -0.44 -0.76 0.00 0.00 176.76 175.56 1fxx h ASP 108 N 0.00 0.32 0.36 -2.13 5.19 -1.64 0.01 116.42 118.54 1fxx h ASP 108 Ca 0.00 0.15 -0.06 0.00 -0.62 0.00 0.00 57.03 56.50 1fxx h ASP 108 Cb 0.00 0.13 -0.01 0.00 0.18 0.00 0.00 39.33 39.63 1fxx h ASP 108 CO 0.00 0.01 -0.26 0.44 -3.12 0.00 0.00 179.24 176.31 1fxx h ASP 109 N 0.41 0.00 0.11 6.45 3.32 0.09 0.03 116.42 126.82 1fxx h ASP 109 Ca 0.54 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 57.42 1fxx h ASP 109 Cb 1.01 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.55 1fxx h ASP 109 CO -0.52 0.26 -0.62 -0.33 -1.72 0.00 0.00 179.24 176.32 1fxx h GLU 110 N 0.00 0.50 -0.11 3.56 4.39 -1.20 -0.70 114.58 121.02 1fxx h GLU 110 Ca -0.00 -0.35 -0.01 0.00 0.34 0.00 0.00 59.36 59.34 1fxx h GLU 110 Cb 0.52 0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.22 1fxx h GLU 110 CO 0.03 0.96 0.02 0.28 -1.16 0.00 0.00 179.01 179.15 1fxx h VAL 111 N 0.37 1.22 -0.34 3.13 2.07 -0.79 -1.91 116.25 120.00 1fxx h VAL 111 Ca -0.01 -0.68 0.06 0.00 0.82 0.00 0.00 66.70 66.89 1fxx h VAL 111 Cb 1.17 1.47 -0.06 0.00 -1.52 0.00 0.00 31.29 32.35 1fxx h VAL 111 CO 0.11 0.20 -0.02 0.74 0.02 0.00 0.00 177.57 178.62 1fxx h THR 112 N -0.05 0.73 -0.94 2.57 2.02 -0.86 -0.01 112.91 116.37 1fxx h THR 112 Ca 0.03 -0.03 0.05 0.00 0.77 0.00 0.00 66.41 67.24 1fxx h THR 112 Cb 0.29 0.65 -0.06 0.00 -1.74 0.00 0.00 68.15 67.29 1fxx h THR 112 CO 0.00 0.01 0.62 0.03 0.37 0.00 0.00 175.52 176.55 1fxx h ARG 113 N 0.07 1.11 -0.07 6.66 3.08 -1.00 -0.62 114.38 123.61 1fxx h ARG 113 Ca 0.16 -0.07 -0.20 0.00 0.07 0.00 0.00 59.98 59.95 1fxx h ARG 113 Cb 0.23 -0.25 -0.00 0.00 0.08 0.00 0.00 29.97 30.03 1fxx h ARG 113 CO -0.29 0.73 -0.78 -0.91 -1.07 0.00 0.00 179.97 177.65 1fxx h ASN 114 N 1.14 0.52 -0.32 7.04 2.35 -0.65 -0.79 115.58 124.88 1fxx h ASN 114 Ca 0.39 -0.36 -0.06 0.00 -0.55 0.00 0.00 56.30 55.72 1fxx h ASN 114 Cb 0.09 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 1fxx h ASN 114 CO -0.13 1.12 -0.02 0.40 -1.65 0.00 0.00 177.43 177.14 1fxx h ILE 115 N 0.28 1.27 -0.58 2.81 2.04 -0.60 -0.75 117.51 121.98 1fxx h ILE 115 Ca -0.04 -1.01 -0.03 0.00 1.00 0.00 0.00 64.86 64.78 1fxx h ILE 115 Cb 1.37 1.29 -0.03 0.00 -0.74 0.00 0.00 36.82 38.71 1fxx h ILE 115 CO 0.14 0.33 0.24 -0.26 0.00 0.00 0.00 178.15 178.59 1fxx h PHE 116 N 0.37 0.88 -0.28 1.37 0.05 -1.11 -2.46 116.94 115.76 1fxx h PHE 116 Ca 0.09 -0.06 0.01 0.00 3.82 0.00 0.00 57.97 61.83 1fxx h PHE 116 Cb 0.48 -0.26 -0.02 0.00 2.00 0.00 0.00 35.95 38.15 1fxx h PHE 116 CO 0.04 0.70 0.16 -0.92 -0.18 0.00 0.00 178.31 178.11 1fxx h TYR 117 N 0.80 0.29 0.00 -0.55 3.20 -0.98 0.10 116.97 119.83 1fxx h TYR 117 Ca 0.19 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.05 1fxx h TYR 117 Cb 0.19 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 38.37 1fxx h TYR 117 CO 0.01 0.17 -0.11 0.00 -1.64 0.00 0.00 178.16 176.59 1fxx h ARG 118 N 0.32 0.00 -0.18 1.82 3.08 -1.00 -3.24 114.38 115.17 1fxx h ARG 118 Ca 0.11 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.10 1fxx h ARG 118 Cb 0.01 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.02 1fxx h ARG 118 CO -0.06 0.11 -0.13 0.09 -1.07 0.00 0.00 179.97 178.91 1fxx n ASN 119 N -3.33 2.61 -1.75 7.04 3.02 -0.94 -4.77 115.26 117.15 1fxx n ASN 119 Ca -0.00 -3.48 -0.15 0.00 -0.03 0.00 0.00 54.58 50.91 1fxx n ASN 119 Cb 0.31 -0.55 -0.01 0.00 -0.61 0.00 0.00 39.78 38.93 1fxx n ASN 119 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1fxx n PHE 120 N -1.06 -0.72 -4.09 3.10 3.01 -0.84 -5.01 117.46 111.86 1fxx n PHE 120 Ca 0.24 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.40 1fxx n PHE 120 Cb 0.85 -3.19 -0.07 0.00 -0.01 0.00 0.00 39.48 37.06 1fxx n PHE 120 CO 0.00 0.00 0.00 0.71 1.01 0.00 0.00 176.76 178.48 1fxx s TYR 121 N -2.76 3.09 0.18 1.38 1.51 0.29 -4.77 117.35 116.26 1fxx s TYR 121 Ca 0.00 0.02 -0.32 0.00 -1.01 0.00 0.00 57.07 55.76 1fxx s TYR 121 Cb 0.00 -1.57 -0.11 0.00 -0.11 0.00 0.00 41.96 40.17 1fxx s TYR 121 CO 0.00 0.50 1.74 0.34 -1.11 0.00 0.00 175.55 177.03 1fxx s ASP 122 N -2.45 6.41 0.21 2.29 -1.08 -1.26 -3.91 116.67 116.87 1fxx s ASP 122 Ca 0.28 2.82 0.23 0.00 -0.52 0.00 0.00 52.55 55.36 1fxx s ASP 122 Cb -0.12 -2.59 0.91 0.00 -1.46 0.00 0.00 42.92 39.67 1fxx s ASP 122 CO 0.20 -0.97 1.70 -2.65 0.52 0.00 0.00 175.17 173.97 1fxx n PRO 123 N 4.50 0.17 0.00 4.34 -0.02 -1.26 -4.36 135.00 138.37 1fxx n PRO 123 Ca 0.16 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 1fxx n PRO 123 Cb 0.36 -1.80 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 1fxx n PRO 123 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1fxx n TYR 124 N -2.12 0.00 -0.31 6.00 4.02 -1.26 -4.61 117.16 118.88 1fxx n TYR 124 Ca 0.03 0.00 0.16 0.00 -0.01 0.00 0.00 57.90 58.08 1fxx n TYR 124 Cb 0.26 0.00 0.30 0.00 -0.02 0.00 0.00 39.34 39.89 1fxx n TYR 124 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1fxx n ALA 125 N -2.44 0.53 -0.23 -0.72 0.00 -1.26 -1.47 120.51 114.92 1fxx n ALA 125 Ca 0.00 0.97 0.29 0.00 0.00 0.00 0.00 53.44 54.71 1fxx n ALA 125 Cb 0.45 -0.74 0.71 0.00 0.00 0.00 0.00 19.45 19.86 1fxx n ALA 125 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 1fxx h TRP 126 N 0.00 0.07 -0.00 0.00 5.08 -1.89 -1.19 115.95 118.01 1fxx h TRP 126 Ca 0.58 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.55 1fxx h TRP 126 Cb 1.26 -0.02 0.00 0.00 -3.00 0.00 0.00 29.16 27.40 1fxx h TRP 126 CO -0.41 0.01 -0.14 -1.13 -1.28 0.00 0.00 178.44 175.49 1fxx n SER 127 N -4.28 0.35 0.00 0.11 3.41 -0.54 -4.49 113.62 108.18 1fxx n SER 127 Ca 0.21 -0.28 0.00 0.00 -0.26 0.00 0.00 58.87 58.54 1fxx n SER 127 Cb 1.02 -0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.85 1fxx n SER 127 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 175.04 172.21 1fxx n TRP 128 N -1.17 0.00 -1.77 7.33 2.14 -0.65 -3.40 117.44 119.91 1fxx n TRP 128 Ca 0.11 0.00 -0.34 0.00 2.07 0.00 0.00 57.50 59.34 1fxx n TRP 128 Cb 0.30 0.00 0.05 0.00 -0.81 0.00 0.00 31.31 30.85 1fxx n TRP 128 CO 0.00 0.00 0.00 -0.65 2.07 0.00 0.00 177.69 179.11 1fxx s GLN 129 N -1.23 2.70 -1.35 -2.67 -0.21 -0.54 -3.35 119.66 113.01 1fxx s GLN 129 Ca 0.00 1.62 -0.06 0.00 0.02 0.00 0.00 55.36 56.95 1fxx s GLN 129 Cb 0.00 -1.92 0.02 0.00 1.00 0.00 0.00 33.01 32.12 1fxx s GLN 129 CO 0.00 -1.37 0.96 0.72 -2.12 0.00 0.00 175.29 173.48 1fxx n HIS 130 N -2.19 -2.32 -2.27 0.91 8.25 -1.26 -2.15 115.22 114.18 1fxx n HIS 130 Ca 0.12 0.93 -0.15 0.00 -0.26 0.00 0.00 57.72 58.36 1fxx n HIS 130 Cb 0.51 -4.64 -0.02 0.00 1.12 0.00 0.00 29.99 26.97 1fxx n HIS 130 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1fxx n ASP 131 N -3.01 -4.44 -4.90 0.41 8.00 -1.24 -0.64 116.55 110.73 1fxx n ASP 131 Ca -0.14 0.17 -0.28 0.00 0.71 0.00 0.00 54.79 55.24 1fxx n ASP 131 Cb 0.61 -3.79 0.01 0.00 -0.02 0.00 0.00 41.12 37.93 1fxx n ASP 131 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1fxx s ASN 132 N -2.07 6.05 0.36 -2.24 -0.87 -0.91 -4.12 114.94 111.14 1fxx s ASN 132 Ca 0.00 1.05 -0.13 0.00 -1.57 0.00 0.00 52.86 52.21 1fxx s ASN 132 Cb 0.00 -2.18 0.04 0.00 -0.02 0.00 0.00 41.25 39.09 1fxx s ASN 132 CO 0.00 -0.82 0.69 -0.94 -2.57 0.00 0.00 177.10 173.46 1fxx s SER 133 N -4.19 0.22 0.08 -1.22 1.04 -0.49 -4.17 113.70 104.97 1fxx s SER 133 Ca 0.52 -1.19 -0.02 0.00 0.48 0.00 0.00 55.95 55.74 1fxx s SER 133 Cb -0.11 0.79 -0.04 0.00 0.10 0.00 0.00 66.02 66.76 1fxx s SER 133 CO 0.48 -1.55 0.02 0.00 0.98 0.00 0.00 173.24 173.17 1fxx s ARG 134 N -2.67 0.73 0.31 4.02 1.70 -1.26 -0.79 118.95 120.99 1fxx s ARG 134 Ca 0.19 -1.26 -0.09 0.00 -0.47 0.00 0.00 55.73 54.10 1fxx s ARG 134 Cb -0.04 0.23 0.01 0.00 -0.57 0.00 0.00 34.95 34.58 1fxx s ARG 134 CO 0.13 -0.17 0.53 -0.46 -1.08 0.00 0.00 175.30 174.25 1fxx s TRP 135 N -3.95 0.59 -0.20 5.89 -0.00 -0.86 -4.88 118.94 115.52 1fxx s TRP 135 Ca 0.12 -0.95 -0.07 0.00 -0.00 0.00 0.00 56.10 55.20 1fxx s TRP 135 Cb 0.07 0.19 0.10 0.00 -0.00 0.00 0.00 33.47 33.83 1fxx s TRP 135 CO -0.07 -1.14 0.42 0.34 -0.00 0.00 0.00 176.95 176.51 1fxx s ASP 136 N -3.11 -0.25 0.57 5.86 3.68 -1.26 -3.74 116.67 118.42 1fxx s ASP 136 Ca 0.24 0.95 0.35 0.00 2.13 0.00 0.00 52.55 56.23 1fxx s ASP 136 Cb -0.01 1.36 1.51 0.00 -1.45 0.00 0.00 42.92 44.33 1fxx s ASP 136 CO 0.14 -0.24 2.04 -0.07 0.13 0.00 0.00 175.17 177.17 1fxx h LEU 137 N 8.17 0.00 0.13 -1.34 3.38 -1.68 -3.32 115.31 120.64 1fxx h LEU 137 Ca -0.16 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.82 1fxx h LEU 137 Cb 1.11 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.81 1fxx h LEU 137 CO 0.13 0.00 -0.50 0.25 0.09 0.00 0.00 178.44 178.41 1fxx h LEU 138 N 0.00 -1.51 -1.67 1.67 5.85 -1.92 -0.73 115.31 117.00 1fxx h LEU 138 Ca 0.00 0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.88 1fxx h LEU 138 Cb 0.44 0.56 0.00 0.00 0.37 0.00 0.00 40.66 42.03 1fxx h LEU 138 CO 0.00 -0.55 0.00 0.44 -0.34 0.00 0.00 178.44 177.99 1fxx h ASP 139 N -0.74 0.00 -0.33 1.25 3.32 -1.98 -1.49 116.42 116.45 1fxx h ASP 139 Ca 0.00 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.88 1fxx h ASP 139 Cb 0.75 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.30 1fxx h ASP 139 CO -0.28 0.00 -0.48 0.58 -1.72 0.00 0.00 179.24 177.35 1fxx h VAL 140 N 0.00 1.27 -0.49 -1.35 2.07 -1.40 -0.75 116.25 115.60 1fxx h VAL 140 Ca 0.00 -1.65 -0.06 0.00 0.82 0.00 0.00 66.70 65.81 1fxx h VAL 140 Cb 0.34 1.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 1fxx h VAL 140 CO 0.00 0.55 0.08 0.24 0.02 0.00 0.00 177.57 178.46 1fxx h MET 141 N 0.72 0.81 -0.48 1.57 2.86 -0.15 -0.95 114.93 119.31 1fxx h MET 141 Ca 0.04 -0.22 -0.04 0.00 -2.06 0.00 0.00 59.70 57.41 1fxx h MET 141 Cb 1.08 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.63 1fxx h MET 141 CO 0.11 0.81 0.12 0.00 1.06 0.00 0.00 176.91 179.01 1fxx h ARG 142 N 0.68 0.76 -0.39 1.72 3.08 -1.33 -1.00 114.38 117.90 1fxx h ARG 142 Ca 0.15 -0.18 -0.07 0.00 0.07 0.00 0.00 59.98 59.95 1fxx h ARG 142 Cb 0.39 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 1fxx h ARG 142 CO 0.01 0.74 -0.04 0.00 -1.07 0.00 0.00 179.97 179.61 1fxx h ALA 143 N 0.99 1.20 -0.24 0.04 0.00 -1.01 -0.62 119.26 119.61 1fxx h ALA 143 Ca 0.15 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1fxx h ALA 143 Cb 0.31 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1fxx h ALA 143 CO 0.00 0.52 -0.06 0.00 0.00 0.00 0.00 179.25 179.71 1fxx h TYR 145 N 0.21 0.88 -0.23 0.00 3.20 -0.99 0.50 116.97 120.54 1fxx h TYR 145 Ca 0.06 -0.04 -0.20 0.00 3.14 0.00 0.00 58.73 61.69 1fxx h TYR 145 Cb 0.52 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 38.52 1fxx h TYR 145 CO 0.05 0.67 -0.63 0.00 -1.64 0.00 0.00 178.16 176.61 1fxx h ALA 146 N 1.13 0.38 0.01 1.82 0.00 -1.02 -3.35 119.26 118.24 1fxx h ALA 146 Ca 0.21 -0.55 -0.39 0.00 0.00 0.00 0.00 54.91 54.18 1fxx h ALA 146 Cb 0.11 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.79 1fxx h ALA 146 CO -0.03 0.66 -2.42 1.28 0.00 0.00 0.00 179.25 178.74 1fxx n LEU 147 N -4.00 2.80 -3.31 0.00 4.77 -0.07 -4.84 117.00 112.36 1fxx n LEU 147 Ca -0.06 -0.04 -0.26 0.00 -0.03 0.00 0.00 56.01 55.63 1fxx n LEU 147 Cb 0.67 -0.92 -0.09 0.00 -2.33 0.00 0.00 43.42 40.75 1fxx n LEU 147 CO 0.51 0.88 -0.30 0.54 -1.33 0.00 0.00 177.39 177.69 1fxx n ARG 148 N -3.42 0.51 -0.22 3.23 5.12 0.13 -4.97 116.66 117.04 1fxx n ARG 148 Ca -0.45 -3.25 -0.01 0.00 -1.93 0.00 0.00 57.85 52.21 1fxx n ARG 148 Cb 0.98 -1.48 0.21 0.00 -1.16 0.00 0.00 32.46 31.01 1fxx n ARG 148 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 1fxx h PRO 149 N 4.83 1.01 -6.08 5.56 0.11 -1.58 -3.42 132.00 132.42 1fxx h PRO 149 Ca 0.17 -0.09 -0.64 0.00 0.11 0.00 0.00 66.00 65.55 1fxx h PRO 149 Cb 0.89 -0.21 0.13 0.00 0.11 0.00 0.00 31.00 31.92 1fxx h PRO 149 CO 0.43 0.71 -0.61 0.39 -0.21 0.00 0.00 178.00 178.71 1fxx n GLU 150 N -4.38 0.18 -0.63 1.05 4.71 -1.26 -2.78 120.64 117.52 1fxx n GLU 150 Ca 0.08 0.07 0.00 0.00 -0.01 0.00 0.00 57.16 57.29 1fxx n GLU 150 Cb 0.07 -1.14 0.00 0.00 -1.01 0.00 0.00 31.44 29.36 1fxx n GLU 150 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1fxx n GLY 151 N 2.03 1.52 2.95 0.62 0.00 -1.26 -4.90 105.19 106.15 1fxx n GLY 151 Ca 0.14 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.00 1fxx n GLY 151 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fxx s ILE 152 N -3.55 0.42 -0.13 -0.61 1.01 -1.12 -4.95 121.20 112.27 1fxx s ILE 152 Ca 0.00 -0.21 -0.20 0.00 0.00 0.00 0.00 60.65 60.24 1fxx s ILE 152 Cb 0.00 -0.36 -0.04 0.00 0.01 0.00 0.00 42.46 42.07 1fxx s ILE 152 CO 0.00 0.12 0.56 0.20 0.00 0.00 0.00 174.94 175.83 1fxx s ASN 153 N -0.03 6.74 -0.25 3.58 0.01 -1.26 -5.03 114.94 118.69 1fxx s ASN 153 Ca 0.01 0.88 -0.03 0.00 -0.71 0.00 0.00 52.86 53.01 1fxx s ASN 153 Cb -0.03 -2.33 0.01 0.00 0.41 0.00 0.00 41.25 39.32 1fxx s ASN 153 CO -0.00 -0.10 -0.02 0.26 -1.51 0.00 0.00 177.10 175.73 1fxx s TRP 154 N 1.04 3.06 0.32 2.20 0.52 -1.26 -4.73 118.94 120.09 1fxx s TRP 154 Ca 0.29 -1.26 -0.29 0.00 0.02 0.00 0.00 56.10 54.86 1fxx s TRP 154 Cb -0.16 -2.12 -0.12 0.00 -1.15 0.00 0.00 33.47 29.92 1fxx s TRP 154 CO 0.12 -0.65 1.40 -2.30 0.02 0.00 0.00 176.95 175.54 1fxx n PRO 155 N 4.75 2.31 -4.08 4.98 -0.02 -1.26 -4.90 135.00 136.78 1fxx n PRO 155 Ca -0.16 0.81 -0.27 0.00 -2.02 0.00 0.00 63.50 61.86 1fxx n PRO 155 Cb 0.48 -2.47 -0.04 0.00 -0.02 0.00 0.00 33.50 31.45 1fxx n PRO 155 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1fxx n GLU 156 N 1.11 0.83 -3.52 -0.52 0.28 -1.26 -1.15 120.64 116.42 1fxx n GLU 156 Ca 0.06 -3.25 -0.41 0.00 -0.16 0.00 0.00 57.16 53.40 1fxx n GLU 156 Cb 0.36 0.66 -0.05 0.00 1.43 0.00 0.00 31.44 33.84 1fxx n GLU 156 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1fxx s GLY 160 N -3.72 2.79 0.41 -1.84 0.00 -1.26 -4.63 107.32 99.07 1fxx s GLY 160 Ca 0.12 -3.50 0.03 0.00 0.00 0.00 0.00 44.72 41.38 1fxx s GLY 160 CO 0.07 1.21 0.10 1.08 0.00 0.00 0.00 173.10 175.56 1fxx s LEU 161 N -0.44 2.06 0.12 0.66 1.43 -1.26 -5.11 118.68 116.14 1fxx s LEU 161 Ca 0.22 -1.63 -0.31 0.00 -1.03 0.00 0.00 54.13 51.38 1fxx s LEU 161 Cb -0.13 -0.22 -0.09 0.00 0.03 0.00 0.00 46.19 45.78 1fxx s LEU 161 CO -0.08 -0.87 1.52 -2.84 0.23 0.00 0.00 176.35 174.31 1fxx s PRO 162 N -3.76 4.25 -0.14 1.29 0.02 -1.26 -4.98 135.00 130.42 1fxx s PRO 162 Ca 0.24 2.25 -0.05 0.00 0.02 0.00 0.00 61.00 63.46 1fxx s PRO 162 Cb 0.03 -3.28 -0.04 0.00 0.02 0.00 0.00 34.50 31.23 1fxx s PRO 162 CO 0.13 -0.58 0.04 0.45 -0.33 0.00 0.00 177.00 176.72 1fxx s SER 163 N 1.40 5.53 -0.19 2.53 0.15 -0.30 -4.99 113.70 117.83 1fxx s SER 163 Ca 0.69 0.14 0.15 0.00 0.70 0.00 0.00 55.95 57.62 1fxx s SER 163 Cb -0.40 -1.80 0.44 0.00 -1.71 0.00 0.00 66.02 62.55 1fxx s SER 163 CO 0.31 0.27 1.33 0.49 1.20 0.00 0.00 173.24 176.84 1fxx n PHE 164 N 2.86 0.60 -2.31 3.44 3.01 -1.26 -4.48 117.46 119.31 1fxx n PHE 164 Ca -0.18 -1.15 -0.41 0.00 1.01 0.00 0.00 57.45 56.72 1fxx n PHE 164 Cb 0.53 -0.30 -0.03 0.00 -0.01 0.00 0.00 39.48 39.67 1fxx n PHE 164 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1fxx s ARG 165 N -2.99 4.46 0.18 -1.08 0.52 -1.26 -4.92 118.95 113.86 1fxx s ARG 165 Ca 0.39 1.95 -0.15 0.00 -0.52 0.00 0.00 55.73 57.41 1fxx s ARG 165 Cb 0.34 -3.21 0.15 0.00 0.52 0.00 0.00 34.95 32.76 1fxx s ARG 165 CO 0.03 -0.12 1.66 1.25 0.02 0.00 0.00 175.30 178.14 1fxx h LEU 166 N 5.01 -0.36 -0.61 2.53 5.85 -2.00 -2.16 115.31 123.58 1fxx h LEU 166 Ca -0.45 0.13 0.11 0.00 0.84 0.00 0.00 57.88 58.51 1fxx h LEU 166 Cb 1.21 0.26 -0.08 0.00 0.37 0.00 0.00 40.66 42.43 1fxx h LEU 166 CO 0.74 -0.13 0.17 -0.33 -0.34 0.00 0.00 178.44 178.55 1fxx h GLU 167 N 0.04 0.30 -0.57 1.25 3.07 -1.98 -1.54 114.58 115.15 1fxx h GLU 167 Ca 0.23 -0.02 -0.05 0.00 -0.50 0.00 0.00 59.36 59.02 1fxx h GLU 167 Cb 0.36 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.18 1fxx h GLU 167 CO -0.46 0.20 0.14 0.45 -1.40 0.00 0.00 179.01 177.94 1fxx h HIS 168 N 0.31 0.95 -0.51 4.33 3.86 -1.80 -2.26 115.15 120.03 1fxx h HIS 168 Ca 0.32 -0.11 -0.04 0.00 -1.16 0.00 0.00 60.37 59.38 1fxx h HIS 168 Cb 0.45 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.63 1fxx h HIS 168 CO -0.22 0.81 0.18 -0.07 0.86 0.00 0.00 177.93 179.49 1fxx h LEU 169 N 0.81 0.73 -0.32 2.43 3.38 -0.80 -1.22 115.31 120.33 1fxx h LEU 169 Ca 0.18 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1fxx h LEU 169 Cb 0.34 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1fxx h LEU 169 CO 0.00 0.73 0.02 0.71 0.09 0.00 0.00 178.44 179.99 1fxx h THR 170 N 0.69 1.25 -0.12 0.22 1.35 -1.25 -2.77 112.91 112.29 1fxx h THR 170 Ca 0.17 -0.90 -0.01 0.00 -0.55 0.00 0.00 66.41 65.12 1fxx h THR 170 Cb 0.25 1.22 -0.01 0.00 -1.73 0.00 0.00 68.15 67.88 1fxx h THR 170 CO -0.01 0.30 0.04 0.11 -0.25 0.00 0.00 175.52 175.71 1fxx h LYS 171 N 0.36 0.19 0.00 4.72 1.57 -1.37 0.32 116.57 122.36 1fxx h LYS 171 Ca 0.09 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1fxx h LYS 171 Cb 0.41 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1fxx h LYS 171 CO 0.01 0.33 0.00 0.00 -0.57 0.00 0.00 179.45 179.22 1fxx n ALA 172 N -2.24 1.02 -1.96 3.86 0.00 -0.46 -2.13 120.51 118.60 1fxx n ALA 172 Ca -0.05 0.07 -0.01 0.00 0.00 0.00 0.00 53.44 53.45 1fxx n ALA 172 Cb 0.14 -1.12 0.12 0.00 0.00 0.00 0.00 19.45 18.59 1fxx n ALA 172 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1fxx n ASN 173 N -1.78 2.21 -1.96 0.00 3.02 -0.94 -4.62 115.26 111.19 1fxx n ASN 173 Ca -0.00 -3.35 -0.15 0.00 -0.03 0.00 0.00 54.58 51.04 1fxx n ASN 173 Cb 0.01 -0.44 -0.04 0.00 -0.61 0.00 0.00 39.78 38.71 1fxx n ASN 173 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fxx n GLY 174 N -0.67 0.44 3.65 7.41 0.00 -0.91 -4.96 105.19 110.16 1fxx n GLY 174 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 1fxx n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fxx s ILE 175 N -2.55 5.32 -0.17 -0.61 1.01 0.06 -5.03 121.20 119.23 1fxx s ILE 175 Ca 0.00 0.28 -0.29 0.00 0.00 0.00 0.00 60.65 60.64 1fxx s ILE 175 Cb 0.00 -3.55 -0.05 0.00 0.01 0.00 0.00 42.46 38.87 1fxx s ILE 175 CO 0.00 0.31 2.00 -1.83 0.00 0.00 0.00 174.94 175.42 1fxx s GLU 176 N 1.22 3.51 -0.46 2.79 -1.05 -1.26 -4.17 118.70 119.28 1fxx s GLU 176 Ca 0.10 2.02 0.08 0.00 -0.15 0.00 0.00 54.97 57.01 1fxx s GLU 176 Cb -0.14 -4.24 0.27 0.00 -0.44 0.00 0.00 34.13 29.58 1fxx s GLU 176 CO 0.06 -1.66 0.62 1.58 0.95 0.00 0.00 175.26 176.81 1fxx n HIS 177 N 9.95 0.87 -3.36 4.83 -0.00 -1.26 -4.91 115.22 121.34 1fxx n HIS 177 Ca 0.25 -3.75 -0.26 0.00 0.46 0.00 0.00 57.72 54.41 1fxx n HIS 177 Cb 0.44 -0.41 -0.02 0.00 -0.12 0.00 0.00 29.99 29.88 1fxx n HIS 177 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 1fxx s SER 178 N -1.74 6.36 -1.11 0.26 0.15 -1.26 -4.26 113.70 112.10 1fxx s SER 178 Ca 0.37 0.57 -0.04 0.00 0.70 0.00 0.00 55.95 57.56 1fxx s SER 178 Cb 0.19 -2.08 0.00 0.00 -1.71 0.00 0.00 66.02 62.42 1fxx s SER 178 CO -0.08 -0.24 0.48 0.59 1.20 0.00 0.00 173.24 175.19 1fxx n ASN 179 N -1.36 -4.89 -4.45 5.45 3.02 -1.26 -4.93 115.26 106.85 1fxx n ASN 179 Ca -0.03 -0.22 -0.31 0.00 -0.03 0.00 0.00 54.58 53.98 1fxx n ASN 179 Cb 0.55 -3.72 0.17 0.00 -0.61 0.00 0.00 39.78 36.18 1fxx n ASN 179 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1fxx n ALA 180 N -3.19 -2.69 -1.49 5.41 0.00 -1.26 -3.17 120.51 114.12 1fxx n ALA 180 Ca -0.07 -0.89 -0.16 0.00 0.00 0.00 0.00 53.44 52.32 1fxx n ALA 180 Cb 0.58 -1.85 -0.06 0.00 0.00 0.00 0.00 19.45 18.12 1fxx n ALA 180 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1fxx n HIS 181 N -4.24 -0.03 -3.91 0.00 8.25 -1.26 -4.97 115.22 109.05 1fxx n HIS 181 Ca 0.05 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.16 1fxx n HIS 181 Cb 0.56 -2.76 -0.14 0.00 1.12 0.00 0.00 29.99 28.77 1fxx n HIS 181 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1fxx s ASP 182 N -2.81 4.31 0.16 0.41 -1.08 -1.19 -4.74 116.67 111.72 1fxx s ASP 182 Ca 0.00 -0.51 -0.19 0.00 -0.52 0.00 0.00 52.55 51.33 1fxx s ASP 182 Cb 0.00 -1.73 0.08 0.00 -1.46 0.00 0.00 42.92 39.82 1fxx s ASP 182 CO 0.00 -0.05 1.26 0.00 0.52 0.00 0.00 175.17 176.90 1fxx n ALA 183 N 4.77 -0.29 -0.10 3.66 0.00 -1.26 -1.12 120.51 126.18 1fxx n ALA 183 Ca -0.18 0.76 -0.06 0.00 0.00 0.00 0.00 53.44 53.97 1fxx n ALA 183 Cb 0.50 -0.25 0.01 0.00 0.00 0.00 0.00 19.45 19.70 1fxx n ALA 183 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1fxx h MET 184 N 0.00 -0.08 -0.74 0.00 1.85 -1.90 -1.39 114.93 112.66 1fxx h MET 184 Ca 0.22 0.01 -0.03 0.00 -0.61 0.00 0.00 59.70 59.29 1fxx h MET 184 Cb 0.42 0.02 -0.03 0.00 0.43 0.00 0.00 31.60 32.43 1fxx h MET 184 CO -0.79 -0.05 0.36 0.00 -0.40 0.00 0.00 176.91 176.03 1fxx h ALA 185 N 1.21 0.96 -0.31 0.39 0.00 -1.41 -2.15 119.26 117.94 1fxx h ALA 185 Ca 0.18 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1fxx h ALA 185 Cb 0.36 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1fxx h ALA 185 CO -0.42 0.52 -0.07 -0.44 0.00 0.00 0.00 179.25 178.84 1fxx h ASP 186 N 1.04 0.48 -0.43 0.00 3.45 -0.77 -1.41 116.42 118.77 1fxx h ASP 186 Ca 0.26 -0.11 -0.10 0.00 0.43 0.00 0.00 57.03 57.51 1fxx h ASP 186 Cb 0.11 -0.13 -0.01 0.00 -0.56 0.00 0.00 39.33 38.74 1fxx h ASP 186 CO -0.03 0.60 -0.11 0.58 -1.57 0.00 0.00 179.24 178.71 1fxx h VAL 187 N 0.48 1.27 -0.57 -1.35 2.07 -0.90 -1.13 116.25 116.13 1fxx h VAL 187 Ca 0.10 -1.22 -0.06 0.00 0.82 0.00 0.00 66.70 66.34 1fxx h VAL 187 Cb 0.41 1.17 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 1fxx h VAL 187 CO 0.02 0.41 0.13 1.88 0.02 0.00 0.00 177.57 180.03 1fxx h TYR 188 N 0.66 0.91 0.00 1.57 0.99 -1.00 -1.69 116.97 118.42 1fxx h TYR 188 Ca 0.11 -0.09 -0.11 0.00 2.00 0.00 0.00 58.73 60.64 1fxx h TYR 188 Cb 0.64 -0.26 -0.02 0.00 1.00 0.00 0.00 36.73 38.09 1fxx h TYR 188 CO 0.05 0.77 -0.51 0.00 -0.00 0.00 0.00 178.16 178.47 1fxx h ALA 189 N 1.29 1.04 -0.13 3.88 0.00 -1.07 -1.64 119.26 122.62 1fxx h ALA 189 Ca 0.18 -0.46 -0.12 0.00 0.00 0.00 0.00 54.91 54.51 1fxx h ALA 189 Cb 0.32 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1fxx h ALA 189 CO 0.00 0.63 -0.38 1.15 0.00 0.00 0.00 179.25 180.66 1fxx h THR 190 N 0.00 1.37 -0.61 0.00 2.02 -0.74 -1.35 112.91 113.59 1fxx h THR 190 Ca -0.01 -1.67 0.05 0.00 0.77 0.00 0.00 66.41 65.55 1fxx h THR 190 Cb 0.97 2.08 -0.05 0.00 -1.74 0.00 0.00 68.15 69.41 1fxx h THR 190 CO 0.07 0.50 0.35 0.40 0.37 0.00 0.00 175.52 177.20 1fxx h ILE 191 N 0.09 1.00 -0.68 3.11 2.04 -1.19 0.40 117.51 122.28 1fxx h ILE 191 Ca -0.01 -0.23 0.02 0.00 1.00 0.00 0.00 64.86 65.64 1fxx h ILE 191 Cb 0.99 0.28 -0.04 0.00 -0.74 0.00 0.00 36.82 37.32 1fxx h ILE 191 CO 0.08 0.12 0.44 0.00 0.00 0.00 0.00 178.15 178.79 1fxx h ALA 192 N 1.31 0.88 -0.60 1.87 0.00 -1.16 -1.07 119.26 120.49 1fxx h ALA 192 Ca 0.27 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 1fxx h ALA 192 Cb 0.12 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1fxx h ALA 192 CO -0.15 0.24 0.05 0.52 0.00 0.00 0.00 179.25 179.90 1fxx h MET 193 N 0.87 1.00 -0.16 0.00 2.86 -0.48 -0.74 114.93 118.30 1fxx h MET 193 Ca 0.26 -0.28 -0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1fxx h MET 193 Cb -0.04 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.50 1fxx h MET 193 CO -0.08 0.96 0.09 0.00 1.06 0.00 0.00 176.91 178.93 1fxx h ALA 194 N 1.11 0.20 -0.80 6.32 0.00 -0.38 -1.86 119.26 123.85 1fxx h ALA 194 Ca 0.18 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.05 1fxx h ALA 194 Cb 0.48 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 1fxx h ALA 194 CO 0.02 -0.27 0.52 0.87 0.00 0.00 0.00 179.25 180.39 1fxx h LYS 195 N 0.15 1.02 0.09 0.00 1.57 -1.00 -1.45 116.57 116.95 1fxx h LYS 195 Ca 0.05 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1fxx h LYS 195 Cb 0.07 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.14 1fxx h LYS 195 CO -0.01 0.67 -0.06 1.25 -0.57 0.00 0.00 179.45 180.73 1fxx h LEU 196 N 1.05 -0.16 -0.70 2.94 5.85 -0.84 -1.97 115.31 121.47 1fxx h LEU 196 Ca 0.31 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.97 1fxx h LEU 196 Cb -0.07 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 1fxx h LEU 196 CO -0.09 -0.10 0.18 0.58 -0.34 0.00 0.00 178.44 178.67 1fxx h VAL 197 N -0.16 1.26 -0.04 1.05 2.07 -1.12 -1.11 116.25 118.20 1fxx h VAL 197 Ca -0.00 -0.96 -0.04 0.00 0.82 0.00 0.00 66.70 66.52 1fxx h VAL 197 Cb 0.14 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 1fxx h VAL 197 CO 0.00 0.37 -0.17 0.50 0.02 0.00 0.00 177.57 178.29 1fxx h LYS 198 N 1.06 0.07 0.01 1.57 3.64 -1.18 -0.31 116.57 121.43 1fxx h LYS 198 Ca 0.22 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.59 1fxx h LYS 198 Cb 0.36 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 1fxx h LYS 198 CO 0.00 0.24 -0.01 1.15 -2.27 0.00 0.00 179.45 178.56 1fxx h THR 199 N 0.06 1.53 0.00 1.00 2.02 -0.94 -3.08 112.91 113.49 1fxx h THR 199 Ca 0.01 -1.84 0.00 0.00 0.77 0.00 0.00 66.41 65.35 1fxx h THR 199 Cb 0.34 2.74 0.00 0.00 -1.74 0.00 0.00 68.15 69.49 1fxx h THR 199 CO 0.02 0.46 -0.12 0.54 0.37 0.00 0.00 175.52 176.79 1fxx n ARG 200 N -4.71 0.25 -2.81 6.66 5.12 -0.46 -4.38 116.66 116.33 1fxx n ARG 200 Ca -0.09 0.17 -0.10 0.00 -1.93 0.00 0.00 57.85 55.90 1fxx n ARG 200 Cb 0.38 -1.76 0.06 0.00 -1.16 0.00 0.00 32.46 29.98 1fxx n ARG 200 CO 0.00 0.00 0.00 0.94 -1.93 0.00 0.00 177.63 176.64 1fxx n GLN 201 N -2.17 1.09 -0.26 5.56 -0.06 -0.13 -4.87 117.38 116.53 1fxx n GLN 201 Ca 0.05 -2.53 -0.01 0.00 -2.00 0.00 0.00 57.00 52.51 1fxx n GLN 201 Cb 0.42 -0.95 0.05 0.00 -4.06 0.00 0.00 30.24 25.71 1fxx n GLN 201 CO 0.00 0.00 0.00 -1.35 -0.20 0.00 0.00 177.06 175.51 1fxx h PRO 202 N 2.72 -0.06 -0.54 3.69 0.11 -1.66 -1.37 132.00 134.88 1fxx h PRO 202 Ca -0.11 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.96 1fxx h PRO 202 Cb 1.15 0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 1fxx h PRO 202 CO 0.24 -0.04 0.16 0.00 -0.21 0.00 0.00 178.00 178.15 1fxx h ARG 203 N -0.07 0.85 -0.25 1.05 2.47 -1.94 -0.94 114.38 115.55 1fxx h ARG 203 Ca 0.32 -0.19 -0.15 0.00 -1.26 0.00 0.00 59.98 58.70 1fxx h ARG 203 Cb 0.57 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 28.76 1fxx h ARG 203 CO -0.79 0.78 -0.46 1.25 0.56 0.00 0.00 179.97 181.31 1fxx h LEU 204 N 0.75 0.70 0.34 3.04 5.85 -1.90 -1.86 115.31 122.24 1fxx h LEU 204 Ca 0.17 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 1fxx h LEU 204 Cb 0.30 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 1fxx h LEU 204 CO -0.00 1.05 -0.22 0.15 -0.34 0.00 0.00 178.44 179.08 1fxx h PHE 205 N 0.52 -0.58 -0.89 1.25 3.57 -0.99 -0.88 116.94 118.94 1fxx h PHE 205 Ca 0.03 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 1fxx h PHE 205 Cb 1.00 0.21 -0.04 0.00 2.79 0.00 0.00 35.95 39.91 1fxx h PHE 205 CO 0.05 -0.34 0.54 -0.44 -2.23 0.00 0.00 178.31 175.88 1fxx h ASP 206 N -0.55 1.07 -0.03 0.41 3.32 -1.17 -0.29 116.42 119.18 1fxx h ASP 206 Ca -0.03 -0.07 0.02 0.00 0.02 0.00 0.00 57.03 56.96 1fxx h ASP 206 Cb 0.46 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 1fxx h ASP 206 CO 0.03 0.83 -0.07 0.22 -1.72 0.00 0.00 179.24 178.53 1fxx h TYR 207 N 1.23 -0.16 -0.81 4.55 3.20 -1.03 0.51 116.97 124.46 1fxx h TYR 207 Ca 0.32 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.18 1fxx h TYR 207 Cb -0.05 0.08 -0.04 0.00 1.54 0.00 0.00 36.73 38.26 1fxx h TYR 207 CO 0.00 -0.10 0.46 -0.07 -1.64 0.00 0.00 178.16 176.81 1fxx h LEU 208 N -0.10 1.00 -0.15 2.82 3.38 -0.86 -1.98 115.31 119.41 1fxx h LEU 208 Ca 0.04 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1fxx h LEU 208 Cb 0.15 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1fxx h LEU 208 CO -0.09 0.80 0.06 0.15 0.09 0.00 0.00 178.44 179.45 1fxx h PHE 209 N 1.12 0.24 0.00 1.13 3.57 -0.65 -2.78 116.94 119.56 1fxx h PHE 209 Ca 0.29 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.77 1fxx h PHE 209 Cb 0.01 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 38.68 1fxx h PHE 209 CO 0.00 0.31 0.00 0.25 -2.23 0.00 0.00 178.31 176.64 1fxx n THR 210 N -4.87 0.68 -0.92 4.41 -2.24 0.14 -2.86 114.28 108.62 1fxx n THR 210 Ca -0.05 0.05 0.08 0.00 -2.27 0.00 0.00 64.05 61.86 1fxx n THR 210 Cb 0.12 -0.88 0.29 0.00 -2.10 0.00 0.00 70.33 67.76 1fxx n THR 210 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1fxx n HIS 211 N -2.04 1.20 0.07 4.78 8.25 -0.75 -4.51 115.22 122.22 1fxx n HIS 211 Ca 0.04 -0.82 -0.11 0.00 -0.26 0.00 0.00 57.72 56.57 1fxx n HIS 211 Cb 0.29 -0.35 -0.13 0.00 1.12 0.00 0.00 29.99 30.93 1fxx n HIS 211 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 1fxx h ARG 212 N 2.40 0.13 -6.93 -0.41 0.11 -1.35 -3.39 114.38 104.94 1fxx h ARG 212 Ca 0.00 -0.22 -0.48 0.00 0.10 0.00 0.00 59.98 59.38 1fxx h ARG 212 Cb 1.54 0.08 0.01 0.00 1.11 0.00 0.00 29.97 32.71 1fxx h ARG 212 CO 0.28 1.07 0.40 -0.80 0.10 0.00 0.00 179.97 181.01 1fxx s ASN 213 N -6.87 6.96 0.27 0.08 0.01 -1.26 -4.39 114.94 109.75 1fxx s ASN 213 Ca -0.02 2.01 -0.06 0.00 -0.71 0.00 0.00 52.86 54.08 1fxx s ASN 213 Cb 0.08 -2.59 0.52 0.00 0.41 0.00 0.00 41.25 39.67 1fxx s ASN 213 CO 0.85 -0.35 1.59 0.50 -1.51 0.00 0.00 177.10 178.18 1fxx h LYS 214 N 2.80 0.02 -0.02 -0.60 3.64 -1.90 -0.78 116.57 119.72 1fxx h LYS 214 Ca -0.48 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 58.83 1fxx h LYS 214 Cb 1.21 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.01 1fxx h LYS 214 CO 0.63 0.02 -0.34 0.45 -2.27 0.00 0.00 179.45 177.94 1fxx h HIS 215 N 0.02 0.05 0.00 1.91 3.86 -1.93 -0.49 115.15 118.58 1fxx h HIS 215 Ca 0.48 -0.01 -0.24 0.00 -1.16 0.00 0.00 60.37 59.44 1fxx h HIS 215 Cb 0.85 -0.01 -0.04 0.00 1.06 0.00 0.00 27.41 29.27 1fxx h HIS 215 CO -0.59 0.38 -1.27 -0.22 0.86 0.00 0.00 177.93 177.10 1fxx h LYS 216 N 0.04 0.01 -0.40 2.45 3.11 -1.50 -3.18 116.57 117.10 1fxx h LYS 216 Ca 0.00 -0.01 -0.14 0.00 -2.81 0.00 0.00 60.65 57.69 1fxx h LYS 216 Cb 0.62 0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 31.84 1fxx h LYS 216 CO 0.05 0.83 -0.29 -0.07 -2.81 0.00 0.00 179.45 177.15 1fxx h LEU 217 N 0.00 0.89 -1.11 5.20 3.38 -1.01 -3.03 115.31 119.63 1fxx h LEU 217 Ca -0.11 -0.36 0.02 0.00 0.09 0.00 0.00 57.88 57.52 1fxx h LEU 217 Cb 1.86 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 42.32 1fxx h LEU 217 CO 0.11 1.12 0.60 -0.03 0.09 0.00 0.00 178.44 180.33 1fxx h MET 218 N 0.73 1.15 0.00 1.13 4.05 -1.13 -1.43 114.93 119.43 1fxx h MET 218 Ca 0.08 -0.07 -0.01 0.00 -0.28 0.00 0.00 59.70 59.42 1fxx h MET 218 Cb 0.85 -0.26 -0.00 0.00 -0.80 0.00 0.00 31.60 31.39 1fxx h MET 218 CO 0.07 0.76 -0.07 0.00 0.23 0.00 0.00 176.91 177.91 1fxx h ALA 219 N 1.45 1.20 0.00 0.39 0.00 -1.51 -2.52 119.26 118.28 1fxx h ALA 219 Ca 0.35 -0.06 -0.18 0.00 0.00 0.00 0.00 54.91 55.02 1fxx h ALA 219 Cb -0.05 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1fxx h ALA 219 CO -0.09 0.08 -1.10 -0.07 0.00 0.00 0.00 179.25 178.06 1fxx h LEU 220 N 0.00 0.00 -9.08 0.00 3.38 -1.32 -3.45 115.31 104.84 1fxx h LEU 220 Ca -0.00 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.38 1fxx h LEU 220 Cb 0.26 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.92 1fxx h LEU 220 CO 0.01 0.71 0.34 -0.63 0.09 0.00 0.00 178.44 178.96 1fxx s ILE 221 N -2.84 4.90 -0.46 1.22 1.01 -0.95 -4.99 121.20 119.10 1fxx s ILE 221 Ca -0.00 1.45 0.03 0.00 0.00 0.00 0.00 60.65 62.13 1fxx s ILE 221 Cb 0.08 -4.06 0.13 0.00 0.01 0.00 0.00 42.46 38.63 1fxx s ILE 221 CO 0.80 0.00 0.25 -0.62 0.00 0.00 0.00 174.94 175.36 1fxx s ASP 222 N 1.28 3.80 0.06 3.58 3.68 -1.26 -4.95 116.67 122.86 1fxx s ASP 222 Ca 0.33 -2.73 -0.23 0.00 2.13 0.00 0.00 52.55 52.05 1fxx s ASP 222 Cb -0.16 -1.17 -0.15 0.00 -1.45 0.00 0.00 42.92 39.99 1fxx s ASP 222 CO 0.09 -0.26 1.60 0.58 0.13 0.00 0.00 175.17 177.32 1fxx h VAL 223 N 5.29 1.13 -0.71 1.11 2.07 -1.95 -0.55 116.25 122.65 1fxx h VAL 223 Ca -0.02 -0.39 0.14 0.00 0.82 0.00 0.00 66.70 67.25 1fxx h VAL 223 Cb 0.92 1.31 -0.10 0.00 -1.52 0.00 0.00 31.29 31.90 1fxx h VAL 223 CO 0.53 0.11 0.21 -0.65 0.02 0.00 0.00 177.57 177.79 1fxx h PRO 224 N -0.08 0.32 0.00 1.57 0.11 -1.92 -2.20 132.00 129.80 1fxx h PRO 224 Ca 0.01 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.10 1fxx h PRO 224 Cb 0.16 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.19 1fxx h PRO 224 CO -0.00 0.21 -0.52 1.96 -0.21 0.00 0.00 178.00 179.45 1fxx h GLN 225 N 0.33 0.00 -5.06 1.05 4.20 -1.92 -3.48 115.11 110.23 1fxx h GLN 225 Ca 0.39 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.75 1fxx h GLN 225 Cb 0.62 0.00 0.11 0.00 0.30 0.00 0.00 27.48 28.51 1fxx h GLN 225 CO -0.44 0.00 -0.59 -1.33 -0.67 0.00 0.00 178.83 175.80 1fxx n MET 226 N -2.24 -6.61 -1.79 1.46 2.81 -0.22 -4.91 117.12 105.61 1fxx n MET 226 Ca 0.03 0.74 -0.42 0.00 -1.81 0.00 0.00 57.70 56.25 1fxx n MET 226 Cb 0.45 -5.48 -0.03 0.00 -0.71 0.00 0.00 33.22 27.46 1fxx n MET 226 CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 1fxx s LYS 227 N -6.06 4.16 0.49 0.03 2.20 -1.14 -4.62 119.74 114.79 1fxx s LYS 227 Ca 0.48 2.52 -0.23 0.00 -0.36 0.00 0.00 55.97 58.38 1fxx s LYS 227 Cb -0.21 -3.33 -0.06 0.00 -1.51 0.00 0.00 37.83 32.71 1fxx s LYS 227 CO 0.59 -0.75 1.28 -2.14 -0.36 0.00 0.00 175.35 173.97 1fxx s PRO 228 N 1.88 3.50 0.04 4.03 0.02 -1.26 -4.37 135.00 138.84 1fxx s PRO 228 Ca 0.76 2.05 -0.01 0.00 0.02 0.00 0.00 61.00 63.82 1fxx s PRO 228 Cb -0.46 -2.39 -0.03 0.00 0.02 0.00 0.00 34.50 31.64 1fxx s PRO 228 CO 0.33 -0.84 -0.02 -0.51 -0.33 0.00 0.00 177.00 175.63 1fxx s LEU 229 N -3.17 2.40 -0.02 -5.54 1.43 0.38 -3.64 118.68 110.51 1fxx s LEU 229 Ca 0.66 -0.87 -0.20 0.00 -1.03 0.00 0.00 54.13 52.69 1fxx s LEU 229 Cb -0.36 0.20 -0.05 0.00 0.03 0.00 0.00 46.19 46.01 1fxx s LEU 229 CO 0.43 -0.53 0.58 -0.69 0.23 0.00 0.00 176.35 176.37 1fxx s VAL 230 N -3.33 4.96 -0.04 -1.59 1.01 0.10 -0.54 120.40 120.97 1fxx s VAL 230 Ca 0.02 1.20 0.01 0.00 0.00 0.00 0.00 61.98 63.21 1fxx s VAL 230 Cb 0.04 -3.92 0.02 0.00 0.00 0.00 0.00 36.38 32.52 1fxx s VAL 230 CO -0.08 0.40 -0.04 -2.28 0.00 0.00 0.00 175.10 173.10 1fxx s HIS 231 N -0.04 0.64 -0.22 5.22 2.46 -0.75 -1.30 115.29 121.29 1fxx s HIS 231 Ca 0.31 -0.15 -0.04 0.00 0.47 0.00 0.00 55.06 55.64 1fxx s HIS 231 Cb -0.18 -0.58 -0.01 0.00 -0.13 0.00 0.00 32.58 31.68 1fxx s HIS 231 CO 0.16 -0.16 -0.03 0.08 -2.47 0.00 0.00 174.74 172.32 1fxx s VAL 232 N 0.85 3.51 -0.14 0.89 1.01 -1.00 -2.31 120.40 123.22 1fxx s VAL 232 Ca -0.11 -0.45 -0.12 0.00 0.00 0.00 0.00 61.98 61.30 1fxx s VAL 232 Cb -0.14 -2.60 0.04 0.00 0.00 0.00 0.00 36.38 33.68 1fxx s VAL 232 CO -0.00 0.42 0.36 -0.55 0.00 0.00 0.00 175.10 175.33 1fxx s SER 233 N 1.39 -0.38 0.65 3.32 0.15 0.07 -4.19 113.70 114.71 1fxx s SER 233 Ca 0.05 0.73 0.43 0.00 0.70 0.00 0.00 55.95 57.86 1fxx s SER 233 Cb -0.14 0.74 2.25 0.00 -1.71 0.00 0.00 66.02 67.15 1fxx s SER 233 CO -0.02 -0.13 2.31 1.23 1.20 0.00 0.00 173.24 177.83 1fxx h GLY 234 N 5.67 0.00 2.00 9.45 0.00 -1.97 -1.64 103.07 116.58 1fxx h GLY 234 Ca -0.27 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.05 1fxx h GLY 234 CO 0.28 0.00 -0.05 1.98 0.00 0.00 0.00 176.54 178.75 1fxx h MET 235 N 0.00 0.00 0.00 4.80 -1.53 -1.91 -2.56 114.93 113.73 1fxx h MET 235 Ca -0.00 0.00 -0.02 0.00 -3.44 0.00 0.00 59.70 56.24 1fxx h MET 235 Cb 0.09 0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 31.14 1fxx h MET 235 CO 0.00 0.05 -0.10 0.74 0.14 0.00 0.00 176.91 177.73 1fxx h PHE 236 N 0.00 0.00 0.00 1.39 0.05 -1.58 0.11 116.94 116.91 1fxx h PHE 236 Ca -0.00 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.79 1fxx h PHE 236 Cb 0.28 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.23 1fxx h PHE 236 CO 0.00 0.10 0.00 0.41 -0.18 0.00 0.00 178.31 178.64 1fxx n GLY 237 N 0.98 0.42 0.32 -1.45 0.00 -0.97 -4.60 105.19 99.90 1fxx n GLY 237 Ca 0.03 -1.45 0.21 0.00 0.00 0.00 0.00 46.02 44.81 1fxx n GLY 237 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fxx h ALA 238 N 0.00 1.00 0.00 4.61 0.00 -1.93 -0.30 119.26 122.64 1fxx h ALA 238 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fxx h ALA 238 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1fxx h ALA 238 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 179.25 176.58 1fxx n TRP 239 N -3.06 0.58 -0.04 0.00 4.27 -1.26 -2.04 117.44 115.89 1fxx n TRP 239 Ca -0.02 0.21 0.02 0.00 -3.89 0.00 0.00 57.50 53.82 1fxx n TRP 239 Cb 0.12 -0.84 0.05 0.00 -1.36 0.00 0.00 31.31 29.29 1fxx n TRP 239 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 1fxx n ARG 240 N -2.01 2.60 -1.31 -2.67 1.74 -0.80 -4.95 116.66 109.26 1fxx n ARG 240 Ca 0.04 -1.60 -0.08 0.00 -0.77 0.00 0.00 57.85 55.43 1fxx n ARG 240 Cb 0.27 -1.10 -0.03 0.00 -1.02 0.00 0.00 32.46 30.58 1fxx n ARG 240 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1fxx n GLY 241 N -0.09 0.91 2.46 -0.13 0.00 -0.87 -2.79 105.19 104.68 1fxx n GLY 241 Ca 0.04 -0.67 -0.20 0.00 0.00 0.00 0.00 46.02 45.19 1fxx n GLY 241 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1fxx n ASN 242 N 0.69 -5.57 -4.18 1.61 5.03 -0.19 -4.64 115.26 108.02 1fxx n ASN 242 Ca -0.08 0.20 -0.19 0.00 0.87 0.00 0.00 54.58 55.38 1fxx n ASN 242 Cb 0.29 -4.75 -0.12 0.00 -1.02 0.00 0.00 39.78 34.17 1fxx n ASN 242 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1fxx s THR 243 N -2.89 1.14 0.27 3.41 2.01 -1.12 -0.75 115.64 117.71 1fxx s THR 243 Ca 0.00 -1.30 -0.20 0.00 0.31 0.00 0.00 61.69 60.50 1fxx s THR 243 Cb 0.00 -1.09 0.06 0.00 0.01 0.00 0.00 72.50 71.48 1fxx s THR 243 CO 0.00 -0.20 0.91 -0.55 -0.69 0.00 0.00 174.62 174.09 1fxx s SER 244 N -1.71 -0.04 -0.19 3.53 0.15 -0.98 -4.92 113.70 109.55 1fxx s SER 244 Ca -0.01 -0.82 -0.07 0.00 0.70 0.00 0.00 55.95 55.74 1fxx s SER 244 Cb -0.10 0.65 -0.04 0.00 -1.71 0.00 0.00 66.02 64.82 1fxx s SER 244 CO 0.02 -1.28 0.06 0.26 1.20 0.00 0.00 173.24 173.50 1fxx s TRP 245 N -2.48 3.22 0.22 3.44 0.51 -1.26 -1.81 118.94 120.78 1fxx s TRP 245 Ca 0.17 0.01 0.09 0.00 -2.12 0.00 0.00 56.10 54.26 1fxx s TRP 245 Cb -0.04 -2.10 -0.05 0.00 -0.81 0.00 0.00 33.47 30.48 1fxx s TRP 245 CO 0.07 0.09 -0.17 0.14 -0.51 0.00 0.00 176.95 176.58 1fxx s VAL 246 N 0.53 1.96 -0.06 4.03 -7.23 0.29 -1.42 120.40 118.50 1fxx s VAL 246 Ca 0.03 -2.21 0.03 0.00 -1.81 0.00 0.00 61.98 58.02 1fxx s VAL 246 Cb -0.13 -2.08 0.01 0.00 0.56 0.00 0.00 36.38 34.74 1fxx s VAL 246 CO 0.01 -0.49 -0.14 0.00 -0.31 0.00 0.00 175.10 174.17 1fxx s ALA 247 N -2.66 1.37 -0.02 1.32 0.00 -0.75 -0.47 121.76 120.54 1fxx s ALA 247 Ca 0.23 -0.51 -0.29 0.00 0.00 0.00 0.00 51.96 51.39 1fxx s ALA 247 Cb -0.03 -0.56 -0.03 0.00 0.00 0.00 0.00 23.12 22.50 1fxx s ALA 247 CO 0.09 0.16 0.95 -1.25 0.00 0.00 0.00 175.76 175.71 1fxx s PRO 248 N 0.49 4.53 -0.25 0.00 0.04 -1.26 -0.78 135.00 137.76 1fxx s PRO 248 Ca -0.12 1.35 0.03 0.00 0.04 0.00 0.00 61.00 62.30 1fxx s PRO 248 Cb -0.15 -3.47 -0.18 0.00 0.04 0.00 0.00 34.50 30.75 1fxx s PRO 248 CO 0.04 -0.07 -0.19 1.28 0.04 0.00 0.00 177.00 178.10 1fxx n LEU 249 N 4.02 2.71 -3.56 -3.56 4.77 0.92 -4.35 117.00 117.95 1fxx n LEU 249 Ca 0.05 -0.12 -0.07 0.00 -0.03 0.00 0.00 56.01 55.84 1fxx n LEU 249 Cb 0.51 -0.79 -0.03 0.00 -2.33 0.00 0.00 43.42 40.78 1fxx n LEU 249 CO 0.51 0.90 0.84 0.00 -1.33 0.00 0.00 177.39 178.31 1fxx s ALA 250 N -2.52 -1.95 0.44 -1.18 0.00 -1.21 -4.93 121.76 110.41 1fxx s ALA 250 Ca -0.32 1.40 -0.22 0.00 0.00 0.00 0.00 51.96 52.81 1fxx s ALA 250 Cb 0.09 -0.17 -0.09 0.00 0.00 0.00 0.00 23.12 22.95 1fxx s ALA 250 CO 0.62 -0.53 1.04 -1.58 0.00 0.00 0.00 175.76 175.32 1fxx s TRP 251 N -2.23 3.13 0.24 0.00 0.52 -1.26 -0.01 118.94 119.33 1fxx s TRP 251 Ca 0.05 1.61 -0.30 0.00 0.02 0.00 0.00 56.10 57.47 1fxx s TRP 251 Cb -0.01 -3.09 -0.10 0.00 -1.15 0.00 0.00 33.47 29.12 1fxx s TRP 251 CO -0.05 -0.72 1.47 -1.58 0.02 0.00 0.00 176.95 176.09 1fxx s HIS 252 N -1.83 3.01 0.45 -1.98 5.65 0.08 -4.81 115.29 115.85 1fxx s HIS 252 Ca 0.63 0.96 0.16 0.00 0.25 0.00 0.00 55.06 57.05 1fxx s HIS 252 Cb -0.19 -3.85 1.09 0.00 -1.18 0.00 0.00 32.58 28.45 1fxx s HIS 252 CO 0.23 -2.83 1.98 -1.35 -0.65 0.00 0.00 174.74 172.12 1fxx h PRO 253 N 5.27 0.33 -0.00 2.88 0.11 -1.89 -3.16 132.00 135.54 1fxx h PRO 253 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1fxx h PRO 253 Cb 1.22 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1fxx h PRO 253 CO 0.80 0.22 -0.11 0.39 -0.21 0.00 0.00 178.00 179.09 1fxx n GLU 254 N -4.46 2.11 -3.64 1.05 1.02 -1.26 -4.91 120.64 110.55 1fxx n GLU 254 Ca 0.10 -0.50 -0.28 0.00 -0.02 0.00 0.00 57.16 56.46 1fxx n GLU 254 Cb 0.42 -0.96 -0.16 0.00 -0.02 0.00 0.00 31.44 30.72 1fxx n GLU 254 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1fxx s ASN 255 N -0.93 3.00 0.00 1.62 3.84 -1.19 -5.00 114.94 116.28 1fxx s ASN 255 Ca 0.05 -0.96 0.17 0.00 0.21 0.00 0.00 52.86 52.33 1fxx s ASN 255 Cb 0.05 -0.44 1.00 0.00 -0.55 0.00 0.00 41.25 41.31 1fxx s ASN 255 CO 0.14 -0.37 1.55 -2.11 -2.79 0.00 0.00 177.10 173.52 1fxx n ARG 256 N 5.16 0.86 -0.39 0.43 1.85 -1.26 -2.25 116.66 121.07 1fxx n ARG 256 Ca -0.07 0.00 0.10 0.00 -1.00 0.00 0.00 57.85 56.88 1fxx n ARG 256 Cb 0.46 -1.30 0.29 0.00 -1.05 0.00 0.00 32.46 30.86 1fxx n ARG 256 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1fxx n ASN 257 N -0.80 3.91 -4.12 2.89 3.02 -1.26 -4.92 115.26 113.98 1fxx n ASN 257 Ca 0.13 -2.14 -0.25 0.00 -0.03 0.00 0.00 54.58 52.29 1fxx n ASN 257 Cb 0.06 -0.45 -0.16 0.00 -0.61 0.00 0.00 39.78 38.61 1fxx n ASN 257 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1fxx s ALA 258 N -1.26 1.43 -0.04 5.41 0.00 -0.95 -1.72 121.76 124.63 1fxx s ALA 258 Ca 0.44 -0.66 0.06 0.00 0.00 0.00 0.00 51.96 51.80 1fxx s ALA 258 Cb 0.24 -0.46 -0.01 0.00 0.00 0.00 0.00 23.12 22.90 1fxx s ALA 258 CO 0.27 0.28 -0.23 0.54 0.00 0.00 0.00 175.76 176.61 1fxx s VAL 259 N -0.03 1.88 -0.26 0.00 0.11 -0.62 -0.74 120.40 120.73 1fxx s VAL 259 Ca -0.02 -0.99 -0.26 0.00 -2.93 0.00 0.00 61.98 57.79 1fxx s VAL 259 Cb -0.10 -1.58 0.00 0.00 -1.53 0.00 0.00 36.38 33.17 1fxx s VAL 259 CO 0.01 0.53 0.89 -0.63 -3.33 0.00 0.00 175.10 172.57 1fxx s ILE 260 N -0.28 4.76 0.08 7.04 1.01 0.98 -1.69 121.20 133.11 1fxx s ILE 260 Ca 0.01 1.59 0.06 0.00 0.00 0.00 0.00 60.65 62.31 1fxx s ILE 260 Cb -0.12 -4.19 -0.04 0.00 0.01 0.00 0.00 42.46 38.12 1fxx s ILE 260 CO 0.02 -0.18 -0.07 -0.04 0.00 0.00 0.00 174.94 174.67 1fxx s MET 261 N 3.03 2.30 -0.12 2.79 -1.94 0.58 -0.05 119.30 125.88 1fxx s MET 261 Ca 0.37 -0.93 -0.01 0.00 -1.71 0.00 0.00 55.69 53.42 1fxx s MET 261 Cb -0.15 -2.39 -0.02 0.00 2.01 0.00 0.00 34.83 34.28 1fxx s MET 261 CO 0.09 0.53 -0.10 0.08 -0.01 0.00 0.00 175.02 175.61 1fxx s VAL 262 N -1.20 3.39 -0.50 -6.03 1.01 0.04 -0.94 120.40 116.16 1fxx s VAL 262 Ca 0.22 -0.56 -0.29 0.00 0.00 0.00 0.00 61.98 61.35 1fxx s VAL 262 Cb -0.11 -2.43 0.03 0.00 0.00 0.00 0.00 36.38 33.87 1fxx s VAL 262 CO 0.14 0.53 1.19 -0.62 0.00 0.00 0.00 175.10 176.34 1fxx s ASP 263 N 0.05 6.54 0.18 3.32 -1.08 0.02 -1.81 116.67 123.89 1fxx s ASP 263 Ca -0.03 0.40 0.22 0.00 -0.52 0.00 0.00 52.55 52.62 1fxx s ASP 263 Cb -0.14 -2.55 0.88 0.00 -1.46 0.00 0.00 42.92 39.65 1fxx s ASP 263 CO 0.04 -1.34 1.66 0.18 0.52 0.00 0.00 175.17 176.22 1fxx n LEU 264 N 8.14 0.49 0.18 -1.34 4.77 -0.51 -2.88 117.00 125.86 1fxx n LEU 264 Ca 0.12 0.61 0.12 0.00 -0.03 0.00 0.00 56.01 56.82 1fxx n LEU 264 Cb 0.49 -0.53 0.12 0.00 -2.33 0.00 0.00 43.42 41.17 1fxx n LEU 264 CO 0.72 -0.43 0.55 0.00 -1.33 0.00 0.00 177.39 176.90 1fxx h ALA 265 N 2.38 0.83 -3.02 -1.18 0.00 -1.91 -3.35 119.26 113.02 1fxx h ALA 265 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fxx h ALA 265 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1fxx h ALA 265 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1fxx n GLY 266 N 1.13 -0.56 3.43 0.00 0.00 -1.14 -4.95 105.19 103.11 1fxx n GLY 266 Ca 0.03 -1.68 -0.37 0.00 0.00 0.00 0.00 46.02 44.00 1fxx n GLY 266 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1fxx s ASP 267 N -1.00 5.12 0.00 1.61 2.15 -1.26 -4.99 116.67 118.30 1fxx s ASP 267 Ca 0.00 -0.27 0.27 0.00 0.43 0.00 0.00 52.55 52.98 1fxx s ASP 267 Cb 0.00 -1.92 0.82 0.00 -0.30 0.00 0.00 42.92 41.52 1fxx s ASP 267 CO 0.00 -0.05 1.60 2.30 -0.17 0.00 0.00 175.17 178.85 1fxx n ILE 268 N 4.92 0.00 -0.32 4.11 -5.35 -1.26 -4.38 119.36 117.07 1fxx n ILE 268 Ca -0.16 -0.12 0.16 0.00 -0.27 0.00 0.00 62.75 62.35 1fxx n ILE 268 Cb 0.51 0.34 0.35 0.00 -1.74 0.00 0.00 39.64 39.09 1fxx n ILE 268 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1fxx h SER 269 N 1.14 0.46 -0.83 7.28 4.64 -1.99 0.27 113.55 124.52 1fxx h SER 269 Ca 0.00 0.15 0.16 0.00 -0.47 0.00 0.00 61.79 61.63 1fxx h SER 269 Cb 0.49 0.10 -0.06 0.00 -0.31 0.00 0.00 62.40 62.62 1fxx h SER 269 CO 0.00 0.02 0.54 -0.65 -0.87 0.00 0.00 176.83 175.88 1fxx h PRO 270 N 0.46 0.48 0.00 4.77 0.11 -1.98 0.57 132.00 136.40 1fxx h PRO 270 Ca 0.60 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 66.62 1fxx h PRO 270 Cb 1.17 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 1fxx h PRO 270 CO -0.52 0.32 -0.31 -0.07 -0.21 0.00 0.00 178.00 177.21 1fxx h LEU 271 N 0.49 0.00 0.10 2.35 3.38 -0.78 -2.49 115.31 118.37 1fxx h LEU 271 Ca 0.41 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 58.05 1fxx h LEU 271 Cb 0.88 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 1fxx h LEU 271 CO -0.16 0.31 -1.81 -0.07 0.09 0.00 0.00 178.44 176.80 1fxx h LEU 272 N 0.00 0.34 0.13 1.67 3.38 0.17 -3.42 115.31 117.58 1fxx h LEU 272 Ca -0.00 -0.66 -0.35 0.00 0.09 0.00 0.00 57.88 56.96 1fxx h LEU 272 Cb 0.78 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1fxx h LEU 272 CO 0.04 1.58 -1.86 -0.33 0.09 0.00 0.00 178.44 177.95 1fxx h GLU 273 N 0.06 0.28 -7.19 1.13 5.08 -0.55 -3.48 114.58 109.91 1fxx h GLU 273 Ca -0.35 -0.48 -0.49 0.00 -1.00 0.00 0.00 59.36 57.04 1fxx h GLU 273 Cb 2.03 0.18 0.06 0.00 0.50 0.00 0.00 28.75 31.52 1fxx h GLU 273 CO 0.11 1.23 0.25 -0.51 -1.00 0.00 0.00 179.01 179.09 1fxx s LEU 274 N -7.19 3.26 0.49 1.33 1.43 -0.94 -5.09 118.68 111.98 1fxx s LEU 274 Ca -0.21 0.97 -0.00 0.00 -1.03 0.00 0.00 54.13 53.86 1fxx s LEU 274 Cb 0.06 -3.86 0.01 0.00 0.03 0.00 0.00 46.19 42.43 1fxx s LEU 274 CO 0.78 -0.97 0.73 1.51 0.23 0.00 0.00 176.35 178.63 1fxx s ASP 275 N -4.25 5.65 0.40 2.29 -4.77 -1.26 -4.88 116.67 109.84 1fxx s ASP 275 Ca 0.53 0.26 0.09 0.00 -3.30 0.00 0.00 52.55 50.13 1fxx s ASP 275 Cb -0.11 -1.37 0.87 0.00 -1.09 0.00 0.00 42.92 41.22 1fxx s ASP 275 CO 0.48 -0.87 1.98 0.77 0.70 0.00 0.00 175.17 178.23 1fxx h SER 276 N 0.24 0.52 -0.26 2.11 4.64 -1.98 -1.54 113.55 117.29 1fxx h SER 276 Ca -0.45 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.86 1fxx h SER 276 Cb 1.27 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 63.24 1fxx h SER 276 CO 0.56 0.33 0.09 0.44 -0.87 0.00 0.00 176.83 177.39 1fxx h ASP 277 N 0.59 0.37 0.06 4.97 3.32 -1.94 -0.30 116.42 123.49 1fxx h ASP 277 Ca 0.28 -0.19 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 1fxx h ASP 277 Cb 0.32 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.78 1fxx h ASP 277 CO -0.08 0.46 -0.03 0.74 -1.72 0.00 0.00 179.24 178.61 1fxx h THR 278 N 0.26 1.03 -0.89 0.35 2.02 -1.87 -1.95 112.91 111.86 1fxx h THR 278 Ca 0.08 -0.30 0.13 0.00 0.77 0.00 0.00 66.41 67.09 1fxx h THR 278 Cb 0.22 1.22 -0.09 0.00 -1.74 0.00 0.00 68.15 67.77 1fxx h THR 278 CO -0.00 0.07 0.51 -0.07 0.37 0.00 0.00 175.52 176.40 1fxx h LEU 279 N -0.22 0.69 -0.49 2.58 3.38 -1.21 -1.17 115.31 118.88 1fxx h LEU 279 Ca -0.01 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1fxx h LEU 279 Cb 0.19 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1fxx h LEU 279 CO 0.01 0.35 0.19 -0.09 0.09 0.00 0.00 178.44 178.99 1fxx h ARG 280 N 0.78 0.74 -0.27 1.13 2.43 -0.77 -0.58 114.38 117.84 1fxx h ARG 280 Ca 0.46 -0.14 0.03 0.00 -0.81 0.00 0.00 59.98 59.52 1fxx h ARG 280 Cb 0.54 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.94 1fxx h ARG 280 CO -0.30 0.67 0.11 0.93 -1.51 0.00 0.00 179.97 179.86 1fxx h GLU 281 N 0.65 0.23 -0.20 0.20 5.08 -0.47 0.11 114.58 120.18 1fxx h GLU 281 Ca 0.16 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.41 1fxx h GLU 281 Cb 0.21 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1fxx h GLU 281 CO -0.01 0.15 -0.29 0.00 -1.00 0.00 0.00 179.01 177.86 1fxx h ARG 282 N 0.24 0.39 0.18 2.33 3.08 -1.08 -2.88 114.38 116.64 1fxx h ARG 282 Ca 0.12 -0.15 -0.24 0.00 0.07 0.00 0.00 59.98 59.77 1fxx h ARG 282 Cb 0.08 -0.02 0.03 0.00 0.08 0.00 0.00 29.97 30.13 1fxx h ARG 282 CO -0.11 0.65 -1.07 1.25 -1.07 0.00 0.00 179.97 179.62 1fxx h LEU 283 N 0.34 0.62 -0.54 3.04 5.85 -0.80 -2.74 115.31 121.08 1fxx h LEU 283 Ca 0.05 -0.94 0.00 0.00 0.84 0.00 0.00 57.88 57.83 1fxx h LEU 283 Cb 0.69 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.52 1fxx h LEU 283 CO 0.05 1.51 0.00 1.88 -0.34 0.00 0.00 178.44 181.55 1fxx h TYR 284 N -0.16 0.00 0.00 1.25 -1.99 -0.84 -3.27 116.97 111.95 1fxx h TYR 284 Ca -0.19 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.54 1fxx h TYR 284 Cb 1.84 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.57 1fxx h TYR 284 CO 0.17 0.00 -0.78 0.25 -0.00 0.00 0.00 178.16 177.80 1fxx n THR 285 N -2.34 0.00 -1.53 -2.88 -2.24 -1.09 -5.05 114.28 99.16 1fxx n THR 285 Ca 0.03 -0.25 -0.31 0.00 -2.27 0.00 0.00 64.05 61.24 1fxx n THR 285 Cb 0.30 0.69 0.06 0.00 -2.10 0.00 0.00 70.33 69.28 1fxx n THR 285 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fxx s ALA 286 N -2.01 2.49 0.32 6.98 0.00 -1.03 -5.01 121.76 123.50 1fxx s ALA 286 Ca 0.00 0.26 -0.28 0.00 0.00 0.00 0.00 51.96 51.94 1fxx s ALA 286 Cb 0.04 -3.24 -0.09 0.00 0.00 0.00 0.00 23.12 19.83 1fxx s ALA 286 CO 0.26 -1.40 1.10 0.21 0.00 0.00 0.00 175.76 175.93 1fxx s LYS 287 N -4.74 4.46 -1.27 0.00 2.20 -1.26 -4.92 119.74 114.21 1fxx s LYS 287 Ca 0.61 1.75 -0.19 0.00 -0.36 0.00 0.00 55.97 57.77 1fxx s LYS 287 Cb -0.16 -2.97 0.02 0.00 -1.51 0.00 0.00 37.83 33.20 1fxx s LYS 287 CO 0.51 0.06 1.81 0.25 -0.36 0.00 0.00 175.35 177.63 1fxx n THR 288 N 0.75 3.34 -3.40 3.43 -2.24 -1.26 -4.84 114.28 110.06 1fxx n THR 288 Ca 0.01 -3.45 -0.11 0.00 -2.27 0.00 0.00 64.05 58.23 1fxx n THR 288 Cb 0.46 -2.31 -0.09 0.00 -2.10 0.00 0.00 70.33 66.29 1fxx n THR 288 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1fxx s ASP 289 N 4.83 0.45 -0.25 3.42 1.01 -1.26 -4.78 116.67 120.08 1fxx s ASP 289 Ca 0.58 0.18 -0.10 0.00 0.71 0.00 0.00 52.55 53.92 1fxx s ASP 289 Cb 0.03 0.97 -0.05 0.00 1.01 0.00 0.00 42.92 44.88 1fxx s ASP 289 CO 0.09 -0.30 0.16 -0.76 0.21 0.00 0.00 175.17 174.57 1fxx s LEU 290 N 2.50 4.04 0.00 1.23 1.43 0.37 -5.04 118.68 123.21 1fxx s LEU 290 Ca 0.11 0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.26 1fxx s LEU 290 Cb -0.15 -2.09 0.00 0.00 0.03 0.00 0.00 46.19 43.97 1fxx s LEU 290 CO -0.15 0.03 0.00 0.00 0.23 0.00 0.00 176.35 176.46 1fxx n ALA 295 N 4.52 -0.42 -1.80 4.21 0.00 -1.26 -4.89 120.51 120.88 1fxx n ALA 295 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.87 1fxx n ALA 295 Cb 0.52 -0.07 -0.03 0.00 0.00 0.00 0.00 19.45 19.87 1fxx n ALA 295 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1fxx s VAL 296 N -0.06 3.24 -0.86 0.00 1.01 -1.26 -4.87 120.40 117.59 1fxx s VAL 296 Ca 0.00 0.29 -0.07 0.00 0.00 0.00 0.00 61.98 62.20 1fxx s VAL 296 Cb 0.00 -3.19 -0.12 0.00 0.00 0.00 0.00 36.38 33.08 1fxx s VAL 296 CO 0.00 -0.03 2.69 -0.81 0.00 0.00 0.00 175.10 176.95 1fxx n PRO 297 N 7.40 2.48 -4.24 2.72 -0.04 -1.26 -4.83 135.00 137.23 1fxx n PRO 297 Ca 0.19 -1.50 -0.17 0.00 -0.04 0.00 0.00 63.50 61.99 1fxx n PRO 297 Cb 0.42 -2.39 -0.14 0.00 -0.04 0.00 0.00 33.50 31.35 1fxx n PRO 297 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1fxx s VAL 298 N 2.33 0.63 0.12 0.52 1.01 -1.26 -0.80 120.40 122.94 1fxx s VAL 298 Ca 0.54 -0.54 -0.17 0.00 0.00 0.00 0.00 61.98 61.81 1fxx s VAL 298 Cb 0.18 -0.57 0.04 0.00 0.00 0.00 0.00 36.38 36.03 1fxx s VAL 298 CO -0.03 0.04 0.43 -1.59 0.00 0.00 0.00 175.10 173.94 1fxx s LYS 299 N -0.56 1.08 -0.03 2.72 -2.85 -0.11 -4.97 119.74 115.02 1fxx s LYS 299 Ca 0.00 -0.65 -0.05 0.00 -1.00 0.00 0.00 55.97 54.28 1fxx s LYS 299 Cb -0.05 0.48 -0.04 0.00 -2.06 0.00 0.00 37.83 36.16 1fxx s LYS 299 CO 0.00 -0.42 0.20 -0.51 0.10 0.00 0.00 175.35 174.72 1fxx s LEU 300 N -2.72 4.37 -0.15 2.77 1.43 -1.26 -0.31 118.68 122.81 1fxx s LEU 300 Ca 0.02 0.44 0.01 0.00 -1.03 0.00 0.00 54.13 53.56 1fxx s LEU 300 Cb 0.01 -2.53 0.02 0.00 0.03 0.00 0.00 46.19 43.73 1fxx s LEU 300 CO -0.11 0.29 -0.16 -0.69 0.23 0.00 0.00 176.35 175.91 1fxx s VAL 301 N -1.26 1.69 -0.49 -1.59 1.01 -0.68 -4.96 120.40 114.12 1fxx s VAL 301 Ca 0.25 -0.71 -0.19 0.00 0.00 0.00 0.00 61.98 61.33 1fxx s VAL 301 Cb -0.13 -1.56 0.06 0.00 0.00 0.00 0.00 36.38 34.74 1fxx s VAL 301 CO 0.15 0.48 0.59 -1.00 0.00 0.00 0.00 175.10 175.31 1fxx s HIS 302 N 1.41 3.08 -1.06 5.22 0.09 -1.26 -1.59 115.29 121.18 1fxx s HIS 302 Ca 0.04 -0.55 0.03 0.00 -0.00 0.00 0.00 55.06 54.59 1fxx s HIS 302 Cb -0.13 -3.44 0.14 0.00 -0.00 0.00 0.00 32.58 29.15 1fxx s HIS 302 CO -0.11 -0.97 1.08 0.44 -0.00 0.00 0.00 174.74 175.18 1fxx n ILE 303 N 5.57 1.67 1.10 0.60 -5.35 -0.70 -1.32 119.36 120.93 1fxx n ILE 303 Ca -0.07 0.42 0.12 0.00 -0.27 0.00 0.00 62.75 62.95 1fxx n ILE 303 Cb 0.45 -1.36 0.15 0.00 -1.74 0.00 0.00 39.64 37.14 1fxx n ILE 303 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1fxx n ASN 304 N -1.47 1.89 -1.92 7.28 6.94 -1.26 -4.24 115.26 122.47 1fxx n ASN 304 Ca 0.01 -1.43 -0.22 0.00 -0.02 0.00 0.00 54.58 52.91 1fxx n ASN 304 Cb 0.04 0.29 0.11 0.00 -2.36 0.00 0.00 39.78 37.85 1fxx n ASN 304 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1fxx n LYS 305 N 0.04 2.64 -3.96 -3.83 5.02 -0.43 -4.99 118.16 112.66 1fxx n LYS 305 Ca 0.11 -3.46 -0.30 0.00 -2.02 0.00 0.00 58.31 52.64 1fxx n LYS 305 Cb 0.45 -2.14 0.01 0.00 -0.02 0.00 0.00 35.03 33.33 1fxx n LYS 305 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1fxx s PRO 307 N -6.59 2.93 -0.41 0.00 0.04 -1.26 -4.91 135.00 124.79 1fxx s PRO 307 Ca 0.31 1.11 -0.21 0.00 0.04 0.00 0.00 61.00 62.25 1fxx s PRO 307 Cb -0.17 -1.98 0.02 0.00 0.04 0.00 0.00 34.50 32.40 1fxx s PRO 307 CO 0.63 -1.12 0.67 0.08 0.04 0.00 0.00 177.00 177.30 1fxx s VAL 308 N -2.76 4.81 -0.03 -0.36 1.01 -1.26 -4.91 120.40 116.90 1fxx s VAL 308 Ca 0.61 0.37 0.03 0.00 0.00 0.00 0.00 61.98 62.99 1fxx s VAL 308 Cb -0.16 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 32.04 1fxx s VAL 308 CO 0.48 -0.52 -0.10 -0.76 0.00 0.00 0.00 175.10 174.20 1fxx s LEU 309 N 2.89 1.79 0.02 3.92 1.43 -1.26 -2.38 118.68 125.10 1fxx s LEU 309 Ca 0.25 -0.21 -0.08 0.00 -1.03 0.00 0.00 54.13 53.06 1fxx s LEU 309 Cb -0.14 -0.60 0.00 0.00 0.03 0.00 0.00 46.19 45.48 1fxx s LEU 309 CO 0.18 0.07 0.16 0.00 0.23 0.00 0.00 176.35 176.99 1fxx s ALA 310 N 0.19 -0.30 0.52 4.21 0.00 -0.42 -4.96 121.76 121.00 1fxx s ALA 310 Ca -0.03 -0.27 -0.21 0.00 0.00 0.00 0.00 51.96 51.45 1fxx s ALA 310 Cb -0.09 0.20 -0.08 0.00 0.00 0.00 0.00 23.12 23.16 1fxx s ALA 310 CO 0.01 -0.29 0.96 0.00 0.00 0.00 0.00 175.76 176.43 1fxx n GLN 311 N 1.00 1.10 -0.26 0.00 10.64 -1.26 0.03 117.38 128.63 1fxx n GLN 311 Ca -0.20 0.41 0.07 0.00 -1.83 0.00 0.00 57.00 55.44 1fxx n GLN 311 Cb 0.57 -2.10 0.20 0.00 -0.86 0.00 0.00 30.24 28.06 1fxx n GLN 311 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1fxx h ALA 312 N 0.95 1.02 0.00 2.61 0.00 -1.89 -2.20 119.26 119.75 1fxx h ALA 312 Ca -0.47 0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1fxx h ALA 312 Cb 1.35 0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.38 1fxx h ALA 312 CO 0.53 -0.35 0.00 0.27 0.00 0.00 0.00 179.25 179.70 1fxx n ASN 313 N -5.16 0.00 0.25 0.00 6.94 -1.26 -1.73 115.26 114.29 1fxx n ASN 313 Ca 0.15 0.19 0.11 0.00 -0.02 0.00 0.00 54.58 55.01 1fxx n ASN 313 Cb 0.50 -0.29 0.64 0.00 -2.36 0.00 0.00 39.78 38.27 1fxx n ASN 313 CO 0.00 0.00 0.00 0.74 -1.03 0.00 0.00 177.26 176.97 1fxx h THR 314 N 0.00 0.63 -2.79 5.53 2.02 -1.74 -3.32 112.91 113.25 1fxx h THR 314 Ca 0.00 -0.71 -0.71 0.00 0.77 0.00 0.00 66.41 65.76 1fxx h THR 314 Cb 0.07 1.45 -0.19 0.00 -1.74 0.00 0.00 68.15 67.74 1fxx h THR 314 CO 0.00 0.16 0.55 -0.22 0.37 0.00 0.00 175.52 176.38 1fxx s LEU 315 N -7.27 5.38 0.65 2.58 0.20 -0.71 -5.03 118.68 114.49 1fxx s LEU 315 Ca -0.02 -1.98 -0.14 0.00 0.69 0.00 0.00 54.13 52.68 1fxx s LEU 315 Cb 0.13 -2.35 -0.01 0.00 -0.43 0.00 0.00 46.19 43.53 1fxx s LEU 315 CO 0.61 -1.01 1.07 -0.13 -0.29 0.00 0.00 176.35 176.60 1fxx s ARG 316 N 2.31 3.02 0.30 1.98 0.52 -1.25 -4.76 118.95 121.07 1fxx s ARG 316 Ca 0.25 1.15 0.06 0.00 -0.52 0.00 0.00 55.73 56.68 1fxx s ARG 316 Cb -0.10 -1.99 0.79 0.00 0.52 0.00 0.00 34.95 34.16 1fxx s ARG 316 CO -0.05 -1.05 1.73 -1.35 0.02 0.00 0.00 175.30 174.60 1fxx h PRO 317 N -0.13 0.56 -0.48 3.54 0.11 -1.95 0.20 132.00 133.84 1fxx h PRO 317 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1fxx h PRO 317 Cb 1.22 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1fxx h PRO 317 CO 0.56 0.37 0.31 0.93 -0.21 0.00 0.00 178.00 179.96 1fxx h GLU 318 N 0.57 0.64 -0.34 1.05 3.07 -2.00 -1.63 114.58 115.94 1fxx h GLU 318 Ca 0.59 -0.05 -0.03 0.00 -0.50 0.00 0.00 59.36 59.38 1fxx h GLU 318 Cb 1.07 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 28.83 1fxx h GLU 318 CO -0.46 0.44 0.12 -0.44 -1.40 0.00 0.00 179.01 177.27 1fxx h ASP 319 N 0.65 0.49 -0.05 1.42 3.32 -1.04 -1.58 116.42 119.62 1fxx h ASP 319 Ca 0.18 -0.19 0.04 0.00 0.02 0.00 0.00 57.03 57.07 1fxx h ASP 319 Cb -0.05 -0.13 -0.05 0.00 0.22 0.00 0.00 39.33 39.32 1fxx h ASP 319 CO -0.04 0.56 -0.22 0.00 -1.72 0.00 0.00 179.24 177.82 1fxx h ALA 320 N 0.96 -0.25 -0.27 3.45 0.00 -0.73 -1.20 119.26 121.22 1fxx h ALA 320 Ca 0.11 0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.08 1fxx h ALA 320 Cb 0.23 0.41 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 1fxx h ALA 320 CO -0.01 -0.70 0.05 -0.44 0.00 0.00 0.00 179.25 178.15 1fxx h ASP 321 N -0.32 -0.01 -0.98 0.00 3.45 -1.20 0.47 116.42 117.83 1fxx h ASP 321 Ca 0.08 0.05 0.14 0.00 0.43 0.00 0.00 57.03 57.73 1fxx h ASP 321 Cb 0.43 0.07 -0.09 0.00 -0.56 0.00 0.00 39.33 39.18 1fxx h ASP 321 CO -0.24 0.03 0.62 -0.09 -1.57 0.00 0.00 179.24 177.99 1fxx h ARG 322 N 0.15 0.84 0.00 3.56 2.43 -0.79 -2.15 114.38 118.41 1fxx h ARG 322 Ca 0.13 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.16 1fxx h ARG 322 Cb 0.14 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 1fxx h ARG 322 CO -0.17 0.56 -1.01 -0.07 -1.51 0.00 0.00 179.97 177.76 1fxx h LEU 323 N 0.86 0.00 0.00 3.80 3.38 -0.52 -3.48 115.31 119.36 1fxx h LEU 323 Ca 0.51 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.48 1fxx h LEU 323 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1fxx h LEU 323 CO -0.28 0.30 0.00 0.61 0.09 0.00 0.00 178.44 179.17 1fxx n GLY 324 N 1.27 0.87 3.56 0.83 0.00 0.15 -4.74 105.19 107.13 1fxx n GLY 324 Ca -0.03 -0.17 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 1fxx n GLY 324 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fxx s ILE 325 N -2.00 4.68 -0.64 -0.61 1.01 -0.43 -5.00 121.20 118.22 1fxx s ILE 325 Ca 0.00 0.57 -0.27 0.00 0.00 0.00 0.00 60.65 60.95 1fxx s ILE 325 Cb 0.00 -4.28 0.01 0.00 0.01 0.00 0.00 42.46 38.20 1fxx s ILE 325 CO 0.00 -0.62 1.49 0.21 0.00 0.00 0.00 174.94 176.02 1fxx s ASN 326 N 2.04 5.91 0.14 3.58 3.84 -1.26 -4.46 114.94 124.72 1fxx s ASN 326 Ca 0.30 0.04 -0.29 0.00 0.21 0.00 0.00 52.86 53.12 1fxx s ASN 326 Cb -0.12 -2.55 -0.05 0.00 -0.55 0.00 0.00 41.25 37.98 1fxx s ASN 326 CO 0.21 -1.93 1.58 0.03 -2.79 0.00 0.00 177.10 174.19 1fxx h ARG 327 N 11.73 -0.44 -0.71 0.43 3.08 -1.95 -2.44 114.38 124.09 1fxx h ARG 327 Ca -0.27 0.03 0.12 0.00 0.07 0.00 0.00 59.98 59.93 1fxx h ARG 327 Cb 1.10 0.10 -0.09 0.00 0.08 0.00 0.00 29.97 31.16 1fxx h ARG 327 CO 1.22 -0.29 0.28 1.96 -1.07 0.00 0.00 179.97 182.08 1fxx h GLN 328 N -0.45 0.44 -0.41 0.04 1.08 -1.99 -0.94 115.11 112.88 1fxx h GLN 328 Ca 0.09 -0.03 0.05 0.00 -1.45 0.00 0.00 58.65 57.31 1fxx h GLN 328 Cb 0.62 -0.10 -0.04 0.00 -0.05 0.00 0.00 27.48 27.91 1fxx h GLN 328 CO -0.46 0.29 0.16 1.25 -0.95 0.00 0.00 178.83 179.12 1fxx h HIS 329 N 0.45 0.29 -0.75 2.96 2.76 -1.84 0.11 115.15 119.13 1fxx h HIS 329 Ca 0.38 0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.59 1fxx h HIS 329 Cb 0.53 -0.07 -0.04 0.00 1.55 0.00 0.00 27.41 29.38 1fxx h HIS 329 CO -0.16 0.13 0.48 0.00 -1.30 0.00 0.00 177.93 177.07 1fxx h LEU 331 N 0.95 0.03 -0.24 0.00 3.38 -0.67 -1.03 115.31 117.73 1fxx h LEU 331 Ca 0.29 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.22 1fxx h LEU 331 Cb -0.03 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1fxx h LEU 331 CO -0.09 0.51 0.05 0.44 0.09 0.00 0.00 178.44 179.44 1fxx h ASP 332 N 0.03 0.37 -0.49 -0.43 3.45 0.02 -0.74 116.42 118.63 1fxx h ASP 332 Ca -0.00 -0.25 -0.06 0.00 0.43 0.00 0.00 57.03 57.15 1fxx h ASP 332 Cb 0.87 -0.10 -0.02 0.00 -0.56 0.00 0.00 39.33 39.51 1fxx h ASP 332 CO 0.06 0.52 0.09 0.78 -1.57 0.00 0.00 179.24 179.13 1fxx h ASN 333 N 0.21 0.82 -0.32 6.45 2.35 -1.11 -2.07 115.58 121.90 1fxx h ASN 333 Ca 0.07 -0.17 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 1fxx h ASN 333 Cb 0.30 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 1fxx h ASN 333 CO 0.00 0.83 0.21 0.25 -1.65 0.00 0.00 177.43 177.08 1fxx h LEU 334 N 0.82 0.37 -0.53 1.61 5.85 -0.84 -0.12 115.31 122.47 1fxx h LEU 334 Ca 0.17 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.89 1fxx h LEU 334 Cb 0.37 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 1fxx h LEU 334 CO 0.01 0.27 0.34 0.50 -0.34 0.00 0.00 178.44 179.22 1fxx h LYS 335 N 0.44 0.66 0.14 1.25 3.64 -0.87 -2.33 116.57 119.50 1fxx h LYS 335 Ca 0.12 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1fxx h LYS 335 Cb -0.05 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 1fxx h LYS 335 CO -0.03 0.44 -0.11 0.82 -2.27 0.00 0.00 179.45 178.31 1fxx h ILE 336 N 0.68 0.76 -0.98 2.00 2.04 -0.88 -1.57 117.51 119.56 1fxx h ILE 336 Ca 0.20 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.21 1fxx h ILE 336 Cb -0.03 0.76 -0.09 0.00 -0.74 0.00 0.00 36.82 36.72 1fxx h ILE 336 CO -0.07 0.00 0.62 -0.07 0.00 0.00 0.00 178.15 178.63 1fxx h LEU 337 N -0.26 0.82 -0.89 1.44 3.38 -0.83 -0.52 115.31 118.45 1fxx h LEU 337 Ca -0.01 0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 1fxx h LEU 337 Cb 0.23 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1fxx h LEU 337 CO -0.01 0.39 -0.50 0.03 0.09 0.00 0.00 178.44 178.45 1fxx h ARG 338 N 0.86 0.12 -0.07 1.13 3.08 -1.03 -2.87 114.38 115.60 1fxx h ARG 338 Ca 0.51 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.49 1fxx h ARG 338 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.72 1fxx h ARG 338 CO -0.28 0.60 0.00 0.39 -1.07 0.00 0.00 179.97 179.61 1fxx n GLU 339 N -3.94 1.73 -3.45 0.04 1.02 -0.34 -4.45 120.64 111.26 1fxx n GLU 339 Ca -0.02 -1.08 -0.26 0.00 -0.02 0.00 0.00 57.16 55.78 1fxx n GLU 339 Cb 0.53 -1.45 -0.09 0.00 -0.02 0.00 0.00 31.44 30.41 1fxx n GLU 339 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1fxx n ASN 340 N 0.30 1.62 -0.29 1.62 3.02 -0.43 -4.96 115.26 116.15 1fxx n ASN 340 Ca 0.18 -2.94 0.25 0.00 -0.03 0.00 0.00 54.58 52.04 1fxx n ASN 340 Cb 0.36 -0.65 0.57 0.00 -0.61 0.00 0.00 39.78 39.45 1fxx n ASN 340 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1fxx h PRO 341 N 4.70 0.28 -0.19 3.52 0.11 -1.78 -0.81 132.00 137.82 1fxx h PRO 341 Ca 0.17 -0.02 0.06 0.00 0.11 0.00 0.00 66.00 66.32 1fxx h PRO 341 Cb 0.80 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.84 1fxx h PRO 341 CO 0.60 0.18 0.40 -0.56 -0.21 0.00 0.00 178.00 178.41 1fxx h GLN 342 N 0.29 0.00 -0.30 1.05 -0.00 -1.92 -0.91 115.11 113.31 1fxx h GLN 342 Ca 0.54 0.00 -0.13 0.00 -0.00 0.00 0.00 58.65 59.06 1fxx h GLN 342 Cb 1.58 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 29.06 1fxx h GLN 342 CO -0.19 0.00 -0.34 0.28 -0.00 0.00 0.00 178.83 178.58 1fxx h VAL 343 N 0.00 1.30 -0.74 1.86 2.07 -1.47 -2.40 116.25 116.86 1fxx h VAL 343 Ca 0.09 -1.51 0.00 0.00 0.82 0.00 0.00 66.70 66.10 1fxx h VAL 343 Cb 0.88 1.58 -0.04 0.00 -1.52 0.00 0.00 31.29 32.20 1fxx h VAL 343 CO -0.00 0.49 0.47 -0.09 0.02 0.00 0.00 177.57 178.46 1fxx h ARG 344 N 0.51 0.98 0.29 1.57 2.43 -1.35 -1.69 114.38 117.13 1fxx h ARG 344 Ca 0.04 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1fxx h ARG 344 Cb 0.92 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 30.25 1fxx h ARG 344 CO 0.08 0.67 -0.14 0.93 -1.51 0.00 0.00 179.97 180.00 1fxx h GLU 345 N 1.01 -0.38 -0.72 0.20 5.08 -1.48 -2.00 114.58 116.28 1fxx h GLU 345 Ca 0.27 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 1fxx h GLU 345 Cb -0.09 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 1fxx h GLU 345 CO -0.06 -0.17 0.46 0.87 -1.00 0.00 0.00 179.01 179.12 1fxx h LYS 346 N -0.52 0.97 -0.17 2.33 1.57 -1.20 -0.29 116.57 119.26 1fxx h LYS 346 Ca -0.04 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.65 1fxx h LYS 346 Cb 0.39 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 1fxx h LYS 346 CO 0.07 0.66 0.04 0.28 -0.57 0.00 0.00 179.45 179.93 1fxx h VAL 347 N 0.98 1.20 -0.86 0.50 2.07 -1.30 -0.98 116.25 117.87 1fxx h VAL 347 Ca 0.26 -0.64 -0.03 0.00 0.82 0.00 0.00 66.70 67.11 1fxx h VAL 347 Cb -0.08 1.32 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 1fxx h VAL 347 CO -0.05 0.20 0.42 0.58 0.02 0.00 0.00 177.57 178.73 1fxx h VAL 348 N 0.07 1.26 -0.93 2.57 2.07 -1.22 -2.17 116.25 117.90 1fxx h VAL 348 Ca 0.05 -0.72 0.05 0.00 0.82 0.00 0.00 66.70 66.90 1fxx h VAL 348 Cb 0.26 0.15 -0.06 0.00 -1.52 0.00 0.00 31.29 30.12 1fxx h VAL 348 CO 0.00 0.31 0.61 0.00 0.02 0.00 0.00 177.57 178.51 1fxx h ALA 349 N 1.23 1.44 -0.26 1.67 0.00 -0.74 -2.36 119.26 120.24 1fxx h ALA 349 Ca 0.30 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.23 1fxx h ALA 349 Cb 0.11 -0.31 -0.06 0.00 0.00 0.00 0.00 17.79 17.53 1fxx h ALA 349 CO -0.04 0.45 -0.15 0.82 0.00 0.00 0.00 179.25 180.33 1fxx h ILE 350 N 1.12 0.55 -0.00 0.00 2.04 -0.51 -1.97 117.51 118.74 1fxx h ILE 350 Ca 0.38 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.24 1fxx h ILE 350 Cb 0.09 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 1fxx h ILE 350 CO -0.13 0.00 -0.00 0.49 0.00 0.00 0.00 178.15 178.51 1fxx n PHE 351 N -5.32 0.00 1.22 1.37 3.01 -0.92 -3.69 117.46 113.12 1fxx n PHE 351 Ca -0.00 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.49 1fxx n PHE 351 Cb 0.23 -0.03 0.22 0.00 -0.01 0.00 0.00 39.48 39.89 1fxx n PHE 351 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1fxx n ALA 352 N -0.98 2.15 -3.73 4.37 0.00 -0.74 -4.46 120.51 117.12 1fxx n ALA 352 Ca 0.23 -0.05 -0.18 0.00 0.00 0.00 0.00 53.44 53.45 1fxx n ALA 352 Cb 0.14 -1.12 -0.17 0.00 0.00 0.00 0.00 19.45 18.30 1fxx n ALA 352 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1fxx s GLU 353 N -2.00 0.06 0.00 0.00 2.12 -1.24 -5.07 118.70 112.56 1fxx s GLU 353 Ca 0.11 0.22 0.00 0.00 0.36 0.00 0.00 54.97 55.67 1fxx s GLU 353 Cb 0.05 -0.43 0.00 0.00 0.26 0.00 0.00 34.13 34.02 1fxx s GLU 353 CO 0.09 -0.22 0.00 0.00 -0.54 0.00 0.00 175.26 174.58 1fxx n ALA 354 N 4.60 0.00 0.00 6.30 0.00 -1.26 -5.06 120.51 125.09 1fxx n ALA 354 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1fxx n ALA 354 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1fxx n ALA 354 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1fxx n PRO 359 N 0.00 0.00 -4.25 0.00 -0.02 -1.26 -5.16 135.00 124.31 1fxx n PRO 359 Ca 0.00 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.34 1fxx n PRO 359 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 33.50 33.38 1fxx n PRO 359 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1fxx s SER 360 N 0.00 1.34 0.00 2.55 0.01 -1.26 -5.03 113.70 111.31 1fxx s SER 360 Ca 0.00 -1.15 0.22 0.00 1.31 0.00 0.00 55.95 56.33 1fxx s SER 360 Cb 0.00 0.09 0.33 0.00 0.21 0.00 0.00 66.02 66.65 1fxx s SER 360 CO 0.00 -0.53 1.31 -0.67 0.41 0.00 0.00 173.24 173.76 1fxx n ASP 361 N -0.24 3.20 -4.59 2.44 -0.08 -1.26 -4.87 116.55 111.14 1fxx n ASP 361 Ca -0.07 -1.95 -0.41 0.00 -1.51 0.00 0.00 54.79 50.85 1fxx n ASP 361 Cb 0.63 -0.17 -0.06 0.00 2.34 0.00 0.00 41.12 43.85 1fxx n ASP 361 CO 0.00 0.00 0.00 0.21 0.12 0.00 0.00 177.20 177.53 1fxx s ASN 362 N -1.52 6.49 0.55 1.67 3.84 -1.26 -4.95 114.94 119.76 1fxx s ASN 362 Ca 0.33 0.37 0.25 0.00 0.21 0.00 0.00 52.86 54.02 1fxx s ASN 362 Cb 0.20 -2.33 1.46 0.00 -0.55 0.00 0.00 41.25 40.03 1fxx s ASN 362 CO 0.29 -0.52 2.06 1.62 -2.79 0.00 0.00 177.10 177.75 1fxx h VAL 363 N 5.58 0.68 0.00 -5.21 3.04 -1.98 -0.07 116.25 118.30 1fxx h VAL 363 Ca -0.26 0.00 -0.02 0.00 -1.01 0.00 0.00 66.70 65.41 1fxx h VAL 363 Cb 1.11 0.81 -0.00 0.00 -2.01 0.00 0.00 31.29 31.21 1fxx h VAL 363 CO 0.82 0.00 -0.09 0.44 -1.01 0.00 0.00 177.57 177.72 1fxx h ASP 364 N 0.00 0.00 -0.59 3.17 3.32 -1.95 -2.74 116.42 117.63 1fxx h ASP 364 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 1fxx h ASP 364 Cb 0.65 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.20 1fxx h ASP 364 CO -0.00 0.09 0.00 0.00 -1.72 0.00 0.00 179.24 177.61 1fxx n ALA 365 N -2.37 3.60 -1.13 3.45 0.00 -0.04 -4.51 120.51 119.52 1fxx n ALA 365 Ca -0.02 -1.84 0.04 0.00 0.00 0.00 0.00 53.44 51.62 1fxx n ALA 365 Cb 0.18 -1.07 0.24 0.00 0.00 0.00 0.00 19.45 18.80 1fxx n ALA 365 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1fxx n GLN 366 N 0.75 2.56 -0.24 0.00 6.02 -1.03 -4.67 117.38 120.77 1fxx n GLN 366 Ca 0.27 -2.93 0.03 0.00 -0.01 0.00 0.00 57.00 54.36 1fxx n GLN 366 Cb 1.09 -1.84 0.15 0.00 1.02 0.00 0.00 30.24 30.67 1fxx n GLN 366 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1fxx h LEU 367 N 1.51 0.28 -1.46 1.08 5.85 -1.79 -1.68 115.31 119.10 1fxx h LEU 367 Ca 0.08 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1fxx h LEU 367 Cb 1.53 0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.62 1fxx h LEU 367 CO 0.28 0.13 0.00 -1.22 -0.34 0.00 0.00 178.44 177.30 1fxx n TYR 368 N -4.98 0.57 0.29 1.25 0.53 -1.26 -3.99 117.16 109.56 1fxx n TYR 368 Ca 0.12 -0.23 0.16 0.00 -1.02 0.00 0.00 57.90 56.93 1fxx n TYR 368 Cb 0.35 -0.11 0.62 0.00 -1.03 0.00 0.00 39.34 39.17 1fxx n TYR 368 CO 0.00 0.00 0.00 -0.91 -1.02 0.00 0.00 176.86 174.93 1fxx h ASN 369 N 1.62 0.00 0.00 7.72 -0.26 -1.64 -3.47 115.58 119.55 1fxx h ASN 369 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1fxx h ASN 369 Cb 0.68 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.94 1fxx h ASN 369 CO 0.08 0.00 0.00 0.61 -1.06 0.00 0.00 177.43 177.06 1fxx n GLY 370 N 0.16 2.00 3.93 2.83 0.00 -1.26 -5.15 105.19 107.70 1fxx n GLY 370 Ca 0.01 -1.03 -0.25 0.00 0.00 0.00 0.00 46.02 44.76 1fxx n GLY 370 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1fxx s PHE 371 N -2.00 3.49 0.05 1.61 0.40 -1.26 -4.98 117.98 115.29 1fxx s PHE 371 Ca 0.00 0.48 -0.15 0.00 -0.60 0.00 0.00 56.93 56.66 1fxx s PHE 371 Cb 0.00 -2.06 -0.06 0.00 0.51 0.00 0.00 43.02 41.41 1fxx s PHE 371 CO 0.00 -0.05 0.46 -0.06 0.70 0.00 0.00 175.22 176.26 1fxx s PHE 372 N -2.47 3.70 0.85 0.36 0.40 -1.26 -5.08 117.98 114.49 1fxx s PHE 372 Ca 0.43 1.03 -0.11 0.00 -0.60 0.00 0.00 56.93 57.67 1fxx s PHE 372 Cb -0.10 -2.32 0.10 0.00 0.51 0.00 0.00 43.02 41.21 1fxx s PHE 372 CO 0.39 0.58 1.09 -1.54 0.70 0.00 0.00 175.22 176.45 1fxx s SER 373 N -1.28 3.89 0.46 1.36 1.04 -1.26 -4.82 113.70 113.09 1fxx s SER 373 Ca 0.28 1.43 0.11 0.00 0.48 0.00 0.00 55.95 58.25 1fxx s SER 373 Cb -0.17 -2.13 1.04 0.00 0.10 0.00 0.00 66.02 64.86 1fxx s SER 373 CO 0.16 -2.37 2.09 0.44 0.98 0.00 0.00 173.24 174.55 1fxx h ASP 374 N -1.36 0.24 -0.14 7.02 5.19 -1.99 -1.26 116.42 124.12 1fxx h ASP 374 Ca -0.48 -0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 55.91 1fxx h ASP 374 Cb 1.28 -0.06 -0.01 0.00 0.18 0.00 0.00 39.33 40.72 1fxx h ASP 374 CO 0.56 0.19 0.06 0.00 -3.12 0.00 0.00 179.24 176.93 1fxx h ALA 375 N 1.85 0.18 -0.17 3.45 0.00 -2.00 -1.24 119.26 121.35 1fxx h ALA 375 Ca 0.08 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 1fxx h ALA 375 Cb -0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1fxx h ALA 375 CO -0.01 -0.23 -0.31 -0.44 0.00 0.00 0.00 179.25 178.25 1fxx h ASP 376 N 0.08 0.33 -0.52 0.00 3.32 -1.79 -1.49 116.42 116.35 1fxx h ASP 376 Ca 0.05 -0.12 -0.07 0.00 0.02 0.00 0.00 57.03 56.91 1fxx h ASP 376 Cb 0.16 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 1fxx h ASP 376 CO -0.00 0.64 0.08 0.03 -1.72 0.00 0.00 179.24 178.27 1fxx h ARG 377 N 0.29 0.91 0.03 3.56 3.08 -0.98 0.14 114.38 121.41 1fxx h ARG 377 Ca 0.04 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 59.86 1fxx h ARG 377 Cb 0.70 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.63 1fxx h ARG 377 CO 0.05 0.85 -0.01 0.00 -1.07 0.00 0.00 179.97 179.79 1fxx h ALA 378 N 1.22 -0.04 -0.80 0.04 0.00 -0.75 -1.21 119.26 117.73 1fxx h ALA 378 Ca 0.18 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.00 1fxx h ALA 378 Cb 0.39 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 1fxx h ALA 378 CO 0.01 -0.43 0.53 0.00 0.00 0.00 0.00 179.25 179.36 1fxx h ALA 379 N 0.74 1.01 0.00 0.00 0.00 -1.05 -1.31 119.26 118.66 1fxx h ALA 379 Ca -0.00 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1fxx h ALA 379 Cb 0.21 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1fxx h ALA 379 CO 0.01 0.43 -0.21 0.52 0.00 0.00 0.00 179.25 180.00 1fxx h MET 380 N 1.09 0.00 -0.31 0.00 2.07 -0.58 -1.59 114.93 115.61 1fxx h MET 380 Ca 0.29 0.00 -0.14 0.00 -2.07 0.00 0.00 59.70 57.78 1fxx h MET 380 Cb -0.12 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 29.60 1fxx h MET 380 CO -0.06 0.21 -0.39 -0.22 1.07 0.00 0.00 176.91 177.52 1fxx h LYS 381 N 0.00 0.72 -0.28 1.72 1.63 -0.09 -2.64 116.57 117.63 1fxx h LYS 381 Ca -0.00 -0.37 -0.11 0.00 -0.85 0.00 0.00 60.65 59.32 1fxx h LYS 381 Cb 0.43 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.06 1fxx h LYS 381 CO 0.03 0.99 -0.26 0.82 -3.45 0.00 0.00 179.45 177.57 1fxx h ILE 382 N 0.59 1.27 -0.80 2.00 2.04 -0.70 -2.72 117.51 119.20 1fxx h ILE 382 Ca 0.05 -1.33 0.04 0.00 1.00 0.00 0.00 64.86 64.63 1fxx h ILE 382 Cb 0.93 1.34 -0.05 0.00 -0.74 0.00 0.00 36.82 38.30 1fxx h ILE 382 CO 0.08 0.43 0.50 0.58 0.00 0.00 0.00 178.15 179.74 1fxx h VAL 383 N 0.49 1.08 0.00 1.67 2.07 -1.09 -1.48 116.25 118.99 1fxx h VAL 383 Ca 0.07 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 1fxx h VAL 383 Cb 0.72 0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1fxx h VAL 383 CO 0.05 0.17 -0.14 -0.07 0.02 0.00 0.00 177.57 177.61 1fxx h LEU 384 N 0.95 0.00 -0.10 2.57 3.38 -1.16 -2.44 115.31 118.51 1fxx h LEU 384 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 1fxx h LEU 384 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1fxx h LEU 384 CO -0.14 0.14 -0.71 -0.62 0.09 0.00 0.00 178.44 177.21 1fxx n GLU 385 N -3.63 0.14 -2.95 1.13 -0.58 -0.71 -4.90 120.64 109.14 1fxx n GLU 385 Ca -0.02 -0.10 -0.40 0.00 -0.42 0.00 0.00 57.16 56.23 1fxx n GLU 385 Cb 0.27 -1.50 -0.05 0.00 -0.57 0.00 0.00 31.44 29.59 1fxx n GLU 385 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1fxx s THR 386 N -2.93 4.55 0.34 2.62 2.01 -0.64 -5.03 115.64 116.55 1fxx s THR 386 Ca 0.11 1.72 -0.27 0.00 0.31 0.00 0.00 61.69 63.55 1fxx s THR 386 Cb 0.17 -4.15 -0.09 0.00 0.01 0.00 0.00 72.50 68.44 1fxx s THR 386 CO 0.76 0.43 1.16 -1.61 -0.69 0.00 0.00 174.62 174.67 1fxx s GLU 387 N -0.51 4.35 0.27 4.92 2.02 -1.26 -4.88 118.70 123.61 1fxx s GLU 387 Ca 0.38 1.88 -0.02 0.00 0.02 0.00 0.00 54.97 57.23 1fxx s GLU 387 Cb -0.22 -2.94 0.59 0.00 0.10 0.00 0.00 34.13 31.66 1fxx s GLU 387 CO 0.25 -0.08 1.63 -1.35 0.02 0.00 0.00 175.26 175.73 1fxx h PRO 388 N 3.23 0.12 -0.88 0.39 0.11 -1.96 0.65 132.00 133.66 1fxx h PRO 388 Ca -0.48 -0.01 0.13 0.00 0.11 0.00 0.00 66.00 65.76 1fxx h PRO 388 Cb 1.22 -0.03 -0.07 0.00 0.11 0.00 0.00 31.00 32.24 1fxx h PRO 388 CO 0.65 0.08 0.57 0.00 -0.21 0.00 0.00 178.00 179.09 1fxx h ARG 389 N 0.13 0.69 -0.00 1.05 2.47 -1.96 -2.05 114.38 114.70 1fxx h ARG 389 Ca 0.49 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 59.17 1fxx h ARG 389 Cb 0.95 -0.16 0.00 0.00 -1.65 0.00 0.00 29.97 29.11 1fxx h ARG 389 CO -0.70 0.46 -0.32 0.09 0.56 0.00 0.00 179.97 180.05 1fxx n ASN 390 N -4.55 0.59 -0.24 7.04 3.02 0.19 -4.31 115.26 117.00 1fxx n ASN 390 Ca 0.17 -0.40 0.05 0.00 -0.03 0.00 0.00 54.58 54.36 1fxx n ASN 390 Cb 0.44 0.09 0.17 0.00 -0.61 0.00 0.00 39.78 39.86 1fxx n ASN 390 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1fxx h LEU 391 N 0.42 0.05 -0.95 3.41 3.38 -1.02 -0.79 115.31 119.81 1fxx h LEU 391 Ca 0.00 0.13 0.04 0.00 0.09 0.00 0.00 57.88 58.15 1fxx h LEU 391 Cb 0.48 0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.34 1fxx h LEU 391 CO 0.00 -0.01 0.61 -0.65 0.09 0.00 0.00 178.44 178.49 1fxx h PRO 392 N 0.29 1.14 0.00 1.13 0.11 -1.78 -2.19 132.00 130.70 1fxx h PRO 392 Ca 0.40 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 66.42 1fxx h PRO 392 Cb 0.65 -0.26 -0.00 0.00 0.11 0.00 0.00 31.00 31.50 1fxx h PRO 392 CO -0.47 0.75 -0.09 0.00 -0.21 0.00 0.00 178.00 177.98 1fxx h ALA 393 N 1.40 1.00 -1.88 -0.75 0.00 -1.46 -3.46 119.26 114.12 1fxx h ALA 393 Ca 0.39 -0.08 -0.64 0.00 0.00 0.00 0.00 54.91 54.57 1fxx h ALA 393 Cb 0.04 -0.01 0.06 0.00 0.00 0.00 0.00 17.79 17.88 1fxx h ALA 393 CO -0.13 0.11 0.49 -0.11 0.00 0.00 0.00 179.25 179.60 1fxx n LEU 394 N -3.20 2.04 -3.43 0.00 7.94 -0.69 -4.92 117.00 114.74 1fxx n LEU 394 Ca 0.01 1.12 -0.31 0.00 -1.11 0.00 0.00 56.01 55.72 1fxx n LEU 394 Cb 0.39 -1.27 -0.05 0.00 0.53 0.00 0.00 43.42 43.03 1fxx n LEU 394 CO 0.31 -0.91 0.37 0.47 -1.11 0.00 0.00 177.39 176.52 1fxx n ASP 395 N 2.52 4.64 -4.59 1.96 8.00 -1.26 -5.05 116.55 122.77 1fxx n ASP 395 Ca 0.17 -3.52 -0.30 0.00 0.71 0.00 0.00 54.79 51.85 1fxx n ASP 395 Cb 0.24 -0.78 -0.10 0.00 -0.02 0.00 0.00 41.12 40.46 1fxx n ASP 395 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1fxx s ILE 396 N -3.12 3.47 0.05 0.53 -1.09 -1.26 -5.11 121.20 114.66 1fxx s ILE 396 Ca 0.40 -1.18 -0.19 0.00 -2.23 0.00 0.00 60.65 57.45 1fxx s ILE 396 Cb 0.16 -2.61 -0.06 0.00 -1.58 0.00 0.00 42.46 38.37 1fxx s ILE 396 CO -0.03 0.15 0.56 -0.89 -1.23 0.00 0.00 174.94 173.50 1fxx s THR 397 N -1.20 4.80 -0.06 2.92 2.01 -1.26 -5.08 115.64 117.77 1fxx s THR 397 Ca 0.21 1.19 0.02 0.00 0.31 0.00 0.00 61.69 63.43 1fxx s THR 397 Cb -0.11 -3.89 0.01 0.00 0.01 0.00 0.00 72.50 68.52 1fxx s THR 397 CO 0.14 0.52 -0.12 -0.36 -0.69 0.00 0.00 174.62 174.10 1fxx s PHE 398 N -0.87 1.46 -0.14 4.92 2.99 -1.26 -4.91 117.98 120.18 1fxx s PHE 398 Ca 0.29 -0.53 -0.09 0.00 0.00 0.00 0.00 56.93 56.60 1fxx s PHE 398 Cb -0.19 -1.07 -0.05 0.00 0.00 0.00 0.00 43.02 41.71 1fxx s PHE 398 CO 0.18 -0.27 -0.06 0.28 -0.00 0.00 0.00 175.22 175.35 1fxx h VAL 399 N 5.94 0.16 -2.56 -0.44 2.07 -1.97 -3.46 116.25 115.98 1fxx h VAL 399 Ca -0.31 -1.17 -0.52 0.00 0.82 0.00 0.00 66.70 65.52 1fxx h VAL 399 Cb 1.19 0.35 0.05 0.00 -1.52 0.00 0.00 31.29 31.36 1fxx h VAL 399 CO 0.47 0.05 1.09 -0.62 0.02 0.00 0.00 177.57 178.59 1fxx s ASP 400 N -5.83 6.40 0.45 0.57 -1.08 -1.26 -4.89 116.67 111.03 1fxx s ASP 400 Ca -0.13 2.80 0.31 0.00 -0.52 0.00 0.00 52.55 55.01 1fxx s ASP 400 Cb 0.02 -2.58 1.50 0.00 -1.46 0.00 0.00 42.92 40.41 1fxx s ASP 400 CO 0.22 -1.00 1.93 0.11 0.52 0.00 0.00 175.17 176.95 1fxx h LYS 401 N 8.12 0.00 -0.20 4.34 1.57 -2.03 -3.09 116.57 125.27 1fxx h LYS 401 Ca -0.45 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.15 1fxx h LYS 401 Cb 1.21 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.52 1fxx h LYS 401 CO 0.95 0.00 -0.58 0.00 -0.57 0.00 0.00 179.45 179.25 1fxx h ARG 402 N 0.00 0.65 -0.69 3.15 3.08 -2.00 -3.34 114.38 115.23 1fxx h ARG 402 Ca 0.00 -0.43 0.14 0.00 0.07 0.00 0.00 59.98 59.76 1fxx h ARG 402 Cb 0.19 0.06 -0.10 0.00 0.08 0.00 0.00 29.97 30.20 1fxx h ARG 402 CO 0.00 1.05 0.13 0.82 -1.07 0.00 0.00 179.97 180.90 1fxx h ILE 403 N 0.49 0.54 -0.66 2.04 2.04 -1.94 -0.59 117.51 119.42 1fxx h ILE 403 Ca 0.00 -0.08 0.09 0.00 1.00 0.00 0.00 64.86 65.87 1fxx h ILE 403 Cb 1.15 0.28 -0.07 0.00 -0.74 0.00 0.00 36.82 37.44 1fxx h ILE 403 CO 0.11 0.04 0.29 -0.33 0.00 0.00 0.00 178.15 178.27 1fxx h GLU 404 N 0.24 0.49 -0.22 2.37 5.08 -1.79 0.20 114.58 120.96 1fxx h GLU 404 Ca 0.38 -0.03 -0.20 0.00 -1.00 0.00 0.00 59.36 58.51 1fxx h GLU 404 Cb 0.62 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1fxx h GLU 404 CO -0.49 0.33 -0.63 0.87 -1.00 0.00 0.00 179.01 178.08 1fxx h LYS 405 N 0.51 0.78 -0.85 2.33 1.57 -1.49 -2.71 116.57 116.72 1fxx h LYS 405 Ca 0.33 -0.55 -0.01 0.00 -1.87 0.00 0.00 60.65 58.55 1fxx h LYS 405 Cb 0.37 0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.73 1fxx h LYS 405 CO -0.29 1.17 0.49 -0.07 -0.57 0.00 0.00 179.45 180.19 1fxx h LEU 406 N 0.58 1.03 -0.35 2.94 3.38 -0.40 -2.26 115.31 120.22 1fxx h LEU 406 Ca -0.01 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 1fxx h LEU 406 Cb 1.24 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 1fxx h LEU 406 CO 0.13 0.81 0.11 0.25 0.09 0.00 0.00 178.44 179.83 1fxx h LEU 407 N 1.17 0.52 -0.46 1.67 5.85 -0.56 -0.45 115.31 123.04 1fxx h LEU 407 Ca 0.30 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 1fxx h LEU 407 Cb -0.02 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 1fxx h LEU 407 CO -0.05 0.59 0.24 0.15 -0.34 0.00 0.00 178.44 179.02 1fxx h PHE 408 N 0.42 0.65 -0.62 1.25 3.57 -1.29 -1.37 116.94 119.55 1fxx h PHE 408 Ca 0.11 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.53 1fxx h PHE 408 Cb 0.26 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.76 1fxx h PHE 408 CO 0.01 0.50 0.14 -0.91 -2.23 0.00 0.00 178.31 175.82 1fxx h ASN 409 N 0.60 0.93 -0.48 0.41 2.35 -1.29 -0.67 115.58 117.42 1fxx h ASN 409 Ca 0.16 -0.19 0.02 0.00 -0.55 0.00 0.00 56.30 55.74 1fxx h ASN 409 Cb 0.09 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.18 1fxx h ASN 409 CO -0.02 0.91 0.30 0.22 -1.65 0.00 0.00 177.43 177.18 1fxx h TYR 410 N 0.94 0.56 0.01 1.19 3.20 -0.72 0.15 116.97 122.30 1fxx h TYR 410 Ca 0.20 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.08 1fxx h TYR 410 Cb 0.35 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.44 1fxx h TYR 410 CO 0.02 0.33 -0.01 0.00 -1.64 0.00 0.00 178.16 176.87 1fxx h ARG 411 N 0.60 -0.02 -0.80 1.82 3.08 -1.02 -2.00 114.38 116.04 1fxx h ARG 411 Ca 0.19 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.21 1fxx h ARG 411 Cb -0.01 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.00 1fxx h ARG 411 CO -0.07 0.54 0.39 0.00 -1.07 0.00 0.00 179.97 179.76 1fxx h ALA 412 N 0.38 1.18 -0.00 0.04 0.00 -1.05 0.20 119.26 120.01 1fxx h ALA 412 Ca -0.00 -0.15 -0.25 0.00 0.00 0.00 0.00 54.91 54.51 1fxx h ALA 412 Cb 0.57 -0.32 0.02 0.00 0.00 0.00 0.00 17.79 18.06 1fxx h ALA 412 CO 0.00 0.63 -0.96 0.00 0.00 0.00 0.00 179.25 178.92 1fxx h ARG 413 N 1.13 0.65 0.00 0.00 3.08 -0.77 -3.33 114.38 115.14 1fxx h ARG 413 Ca 0.28 -0.70 -0.21 0.00 0.07 0.00 0.00 59.98 59.41 1fxx h ARG 413 Cb 0.10 0.20 -0.04 0.00 0.08 0.00 0.00 29.97 30.31 1fxx h ARG 413 CO -0.04 1.29 -2.14 0.09 -1.07 0.00 0.00 179.97 178.10 1fxx n ASN 414 N -3.92 0.41 -3.12 7.04 3.02 -0.75 -4.73 115.26 113.20 1fxx n ASN 414 Ca -0.11 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.22 1fxx n ASN 414 Cb 0.84 1.32 -0.04 0.00 -0.61 0.00 0.00 39.78 41.30 1fxx n ASN 414 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1fxx n PHE 415 N -2.50 1.58 -0.29 3.10 3.01 0.70 -4.96 117.46 118.11 1fxx n PHE 415 Ca -0.20 -3.88 0.07 0.00 1.01 0.00 0.00 57.45 54.46 1fxx n PHE 415 Cb 0.89 -0.44 0.23 0.00 -0.01 0.00 0.00 39.48 40.14 1fxx n PHE 415 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1fxx h PRO 416 N 3.12 0.52 0.00 -1.08 0.11 -1.64 -0.17 132.00 132.87 1fxx h PRO 416 Ca 0.11 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1fxx h PRO 416 Cb 0.79 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.79 1fxx h PRO 416 CO 0.62 0.34 0.00 0.41 -0.21 0.00 0.00 178.00 179.16 1fxx n GLY 417 N -1.33 -0.40 0.15 -0.55 0.00 -1.26 -1.38 105.19 100.42 1fxx n GLY 417 Ca 0.17 -0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.29 1fxx n GLY 417 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1fxx n THR 418 N -1.27 0.00 -2.89 2.61 -1.04 -0.07 -4.94 114.28 106.67 1fxx n THR 418 Ca 0.02 -0.08 -0.38 0.00 -2.04 0.00 0.00 64.05 61.57 1fxx n THR 418 Cb 0.03 0.66 -0.06 0.00 -1.82 0.00 0.00 70.33 69.14 1fxx n THR 418 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1fxx s LEU 419 N -2.79 4.50 0.82 -4.42 1.43 -0.48 -5.01 118.68 112.74 1fxx s LEU 419 Ca 0.15 1.73 -0.12 0.00 -1.03 0.00 0.00 54.13 54.86 1fxx s LEU 419 Cb 0.18 -3.61 0.10 0.00 0.03 0.00 0.00 46.19 42.88 1fxx s LEU 419 CO 0.68 0.10 1.19 1.51 0.23 0.00 0.00 176.35 180.05 1fxx s ASP 420 N -1.36 4.33 0.22 2.29 1.47 -1.26 -4.76 116.67 117.60 1fxx s ASP 420 Ca 0.42 0.68 -0.09 0.00 1.18 0.00 0.00 52.55 54.74 1fxx s ASP 420 Cb -0.22 -1.12 0.34 0.00 -0.34 0.00 0.00 42.92 41.59 1fxx s ASP 420 CO 0.26 -2.00 1.66 0.22 0.68 0.00 0.00 175.17 175.99 1fxx h TYR 421 N -1.10 0.02 -0.62 2.11 3.20 -1.99 -0.32 116.97 118.25 1fxx h TYR 421 Ca -0.46 0.05 -0.09 0.00 3.14 0.00 0.00 58.73 61.37 1fxx h TYR 421 Cb 1.32 0.09 -0.02 0.00 1.54 0.00 0.00 36.73 39.66 1fxx h TYR 421 CO 0.11 -0.16 0.04 0.00 -1.64 0.00 0.00 178.16 176.51 1fxx h ALA 422 N 1.59 0.90 -0.21 1.82 0.00 -2.00 -2.42 119.26 118.94 1fxx h ALA 422 Ca 0.35 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1fxx h ALA 422 Cb 0.58 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1fxx h ALA 422 CO -0.54 0.66 -0.20 0.93 0.00 0.00 0.00 179.25 180.10 1fxx h GLU 423 N 0.98 0.37 -0.65 0.00 5.08 -1.60 -1.53 114.58 117.22 1fxx h GLU 423 Ca 0.18 -0.11 -0.08 0.00 -1.00 0.00 0.00 59.36 58.34 1fxx h GLU 423 Cb 0.50 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.69 1fxx h GLU 423 CO 0.02 0.55 0.08 1.96 -1.00 0.00 0.00 179.01 180.62 1fxx h GLN 424 N 0.34 1.10 -0.59 2.33 4.20 -0.76 0.05 115.11 121.77 1fxx h GLN 424 Ca 0.06 -0.31 -0.06 0.00 0.06 0.00 0.00 58.65 58.40 1fxx h GLN 424 Cb 0.54 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 1fxx h GLN 424 CO 0.04 1.02 0.15 1.96 -0.67 0.00 0.00 178.83 181.32 1fxx h GLN 425 N 1.02 0.95 -0.63 1.46 4.20 -0.96 -0.58 115.11 120.57 1fxx h GLN 425 Ca 0.20 -0.23 -0.03 0.00 0.06 0.00 0.00 58.65 58.65 1fxx h GLN 425 Cb 0.48 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 28.10 1fxx h GLN 425 CO 0.02 0.87 0.29 -0.09 -0.67 0.00 0.00 178.83 179.24 1fxx h ARG 426 N 0.86 0.92 -0.18 1.46 2.43 -0.92 -0.81 114.38 118.14 1fxx h ARG 426 Ca 0.19 -0.15 -0.07 0.00 -0.81 0.00 0.00 59.98 59.14 1fxx h ARG 426 Cb 0.35 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 1fxx h ARG 426 CO 0.00 0.75 -0.20 2.35 -1.51 0.00 0.00 179.97 181.36 1fxx h TRP 427 N 0.87 0.34 -0.47 2.20 2.91 -0.67 0.30 115.95 121.43 1fxx h TRP 427 Ca 0.21 -0.06 -0.13 0.00 1.13 0.00 0.00 58.89 60.05 1fxx h TRP 427 Cb 0.15 -0.09 -0.01 0.00 -0.51 0.00 0.00 29.16 28.70 1fxx h TRP 427 CO 0.01 0.50 -0.21 1.25 -1.03 0.00 0.00 178.44 178.96 1fxx h LEU 428 N 0.29 0.99 -0.69 0.65 5.85 -0.56 -1.96 115.31 119.87 1fxx h LEU 428 Ca 0.05 -0.37 -0.08 0.00 0.84 0.00 0.00 57.88 58.32 1fxx h LEU 428 Cb 0.52 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 1fxx h LEU 428 CO 0.03 1.16 0.09 -0.08 -0.34 0.00 0.00 178.44 179.30 1fxx h GLU 429 N 0.83 1.09 -0.42 1.25 4.57 -0.41 -2.08 114.58 119.42 1fxx h GLU 429 Ca 0.11 -0.30 0.02 0.00 -1.18 0.00 0.00 59.36 58.01 1fxx h GLU 429 Cb 0.78 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 29.21 1fxx h GLU 429 CO 0.06 1.01 0.23 1.25 -1.18 0.00 0.00 179.01 180.39 1fxx h HIS 430 N 1.02 0.43 -0.14 0.92 2.76 -0.70 -1.15 115.15 118.29 1fxx h HIS 430 Ca 0.20 0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.32 1fxx h HIS 430 Cb 0.46 -0.13 -0.01 0.00 1.55 0.00 0.00 27.41 29.28 1fxx h HIS 430 CO 0.03 0.24 -0.21 0.00 -1.30 0.00 0.00 177.93 176.69 1fxx h ARG 431 N 0.47 0.24 -0.30 5.26 3.08 -1.09 -2.05 114.38 119.98 1fxx h ARG 431 Ca 0.17 -0.07 -0.12 0.00 0.07 0.00 0.00 59.98 60.03 1fxx h ARG 431 Cb 0.04 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 1fxx h ARG 431 CO -0.10 0.45 -0.32 -0.09 -1.07 0.00 0.00 179.97 178.84 1fxx h ARG 432 N 0.22 0.65 0.00 0.04 2.43 -0.70 -1.33 114.38 115.70 1fxx h ARG 432 Ca 0.04 -0.29 0.00 0.00 -0.81 0.00 0.00 59.98 58.91 1fxx h ARG 432 Cb 0.51 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 1fxx h ARG 432 CO 0.03 0.89 0.00 1.96 -1.51 0.00 0.00 179.97 181.34 1fxx h GLN 433 N 0.55 0.00 0.07 0.20 1.08 -0.56 -3.19 115.11 113.26 1fxx h GLN 433 Ca 0.06 0.00 -0.28 0.00 -1.45 0.00 0.00 58.65 56.98 1fxx h GLN 433 Cb 0.82 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.23 1fxx h GLN 433 CO 0.07 0.00 -1.51 0.28 -0.95 0.00 0.00 178.83 176.72 1fxx h VAL 434 N 0.00 0.87 -0.97 -0.54 2.07 -1.03 -3.40 116.25 113.25 1fxx h VAL 434 Ca 0.00 -2.29 -0.74 0.00 0.82 0.00 0.00 66.70 64.49 1fxx h VAL 434 Cb 0.57 2.46 -0.11 0.00 -1.52 0.00 0.00 31.29 32.69 1fxx h VAL 434 CO 0.00 0.61 2.44 0.49 0.02 0.00 0.00 177.57 181.12 1fxx n PHE 435 N -4.00 2.96 -1.64 1.57 0.99 -0.53 -4.91 117.46 111.89 1fxx n PHE 435 Ca -0.30 -2.85 -0.30 0.00 -0.00 0.00 0.00 57.45 54.00 1fxx n PHE 435 Cb 0.85 -2.09 0.07 0.00 -1.00 0.00 0.00 39.48 37.31 1fxx n PHE 435 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.76 177.71 1fxx s THR 436 N 0.82 3.49 0.19 4.37 -4.23 -1.25 -4.83 115.64 114.19 1fxx s THR 436 Ca 0.45 0.48 -0.13 0.00 -1.18 0.00 0.00 61.69 61.32 1fxx s THR 436 Cb 0.12 -3.29 0.10 0.00 1.34 0.00 0.00 72.50 70.77 1fxx s THR 436 CO -0.03 -0.63 1.73 -0.65 -0.54 0.00 0.00 174.62 174.50 1fxx h PRO 437 N -0.87 0.30 -0.55 3.99 0.11 -1.93 -1.32 132.00 131.72 1fxx h PRO 437 Ca -0.46 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.59 1fxx h PRO 437 Cb 1.25 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 1fxx h PRO 437 CO 0.60 0.20 0.14 1.05 -0.21 0.00 0.00 178.00 179.77 1fxx h GLU 438 N 0.30 0.85 -0.26 1.05 9.09 -1.99 -1.29 114.58 122.32 1fxx h GLU 438 Ca 0.25 -0.17 -0.04 0.00 0.05 0.00 0.00 59.36 59.45 1fxx h GLU 438 Cb 0.30 -0.13 -0.01 0.00 -1.65 0.00 0.00 28.75 27.26 1fxx h GLU 438 CO -0.28 0.76 0.02 0.35 0.05 0.00 0.00 179.01 179.90 1fxx h PHE 439 N 0.82 0.49 -0.58 2.06 3.57 -1.74 -0.87 116.94 120.69 1fxx h PHE 439 Ca 0.18 -0.08 -0.06 0.00 3.53 0.00 0.00 57.97 61.54 1fxx h PHE 439 Cb 0.29 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.88 1fxx h PHE 439 CO 0.02 0.59 0.11 -0.07 -2.23 0.00 0.00 178.31 176.72 1fxx h LEU 440 N 0.25 0.86 -0.51 0.59 3.38 -1.05 -0.48 115.31 118.35 1fxx h LEU 440 Ca 0.08 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.79 1fxx h LEU 440 Cb 0.38 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1fxx h LEU 440 CO 0.01 0.86 0.03 -0.61 0.09 0.00 0.00 178.44 178.82 1fxx h GLN 441 N 0.87 0.88 -0.53 1.13 5.75 -1.10 -0.76 115.11 121.35 1fxx h GLN 441 Ca 0.18 -0.26 -0.06 0.00 -0.15 0.00 0.00 58.65 58.35 1fxx h GLN 441 Cb 0.36 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.80 1fxx h GLN 441 CO 0.01 0.90 0.07 0.78 -2.65 0.00 0.00 178.83 177.94 1fxx h GLY 442 N 0.75 0.91 0.81 2.39 0.00 -0.84 0.85 103.07 107.94 1fxx h GLY 442 Ca 0.15 -0.57 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 1fxx h GLY 442 CO 0.02 0.53 0.01 -1.82 0.00 0.00 0.00 176.54 175.27 1fxx h TYR 443 N 0.80 0.03 -0.66 5.60 3.20 -0.75 -1.87 116.97 123.32 1fxx h TYR 443 Ca 0.17 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.01 1fxx h TYR 443 Cb 0.38 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.61 1fxx h TYR 443 CO 0.02 0.22 0.31 0.00 -1.64 0.00 0.00 178.16 177.07 1fxx h ALA 444 N 0.81 0.86 -0.76 1.82 0.00 -0.92 -1.99 119.26 119.08 1fxx h ALA 444 Ca 0.01 -0.15 0.07 0.00 0.00 0.00 0.00 54.91 54.84 1fxx h ALA 444 Cb 0.20 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 17.67 1fxx h ALA 444 CO -0.00 0.43 0.44 -0.44 0.00 0.00 0.00 179.25 179.68 1fxx h ASP 445 N 0.92 0.65 -0.40 0.00 3.32 -0.69 0.12 116.42 120.35 1fxx h ASP 445 Ca 0.23 0.03 -0.08 0.00 0.02 0.00 0.00 57.03 57.23 1fxx h ASP 445 Cb 0.13 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1fxx h ASP 445 CO -0.03 0.41 -0.05 -0.08 -1.72 0.00 0.00 179.24 177.77 1fxx h GLU 446 N 0.78 0.73 -0.33 3.56 4.81 -1.02 -1.27 114.58 121.84 1fxx h GLU 446 Ca 0.35 -0.26 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 1fxx h GLU 446 Cb 0.23 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 1fxx h GLU 446 CO -0.20 0.85 0.15 -0.07 -0.73 0.00 0.00 179.01 179.01 1fxx h LEU 447 N 0.55 0.44 -0.49 1.64 3.38 -0.85 -0.95 115.31 119.04 1fxx h LEU 447 Ca 0.11 -0.14 0.05 0.00 0.09 0.00 0.00 57.88 58.00 1fxx h LEU 447 Cb 0.55 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.14 1fxx h LEU 447 CO 0.03 0.45 0.21 1.56 0.09 0.00 0.00 178.44 180.79 1fxx h GLN 448 N 0.40 0.40 -0.78 1.13 4.20 -0.68 0.20 115.11 119.99 1fxx h GLN 448 Ca 0.11 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.76 1fxx h GLN 448 Cb 0.13 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 27.79 1fxx h GLN 448 CO -0.01 0.27 0.33 1.98 -0.67 0.00 0.00 178.83 180.73 1fxx h MET 449 N 0.42 1.14 -0.14 1.46 4.05 -0.95 -2.45 114.93 118.46 1fxx h MET 449 Ca 0.23 -0.19 -0.18 0.00 -0.28 0.00 0.00 59.70 59.28 1fxx h MET 449 Cb 0.19 -0.20 -0.00 0.00 -0.80 0.00 0.00 31.60 30.79 1fxx h MET 449 CO -0.20 0.90 -0.65 -0.07 0.23 0.00 0.00 176.91 177.13 1fxx h LEU 450 N 1.12 0.62 -0.75 3.39 3.38 -0.51 -2.59 115.31 119.97 1fxx h LEU 450 Ca 0.26 -0.37 -0.10 0.00 0.09 0.00 0.00 57.88 57.76 1fxx h LEU 450 Cb 0.17 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1fxx h LEU 450 CO -0.03 1.10 -0.12 1.62 0.09 0.00 0.00 178.44 181.10 1fxx h VAL 451 N 0.39 1.26 -0.82 1.22 3.04 -0.86 -0.08 116.25 120.41 1fxx h VAL 451 Ca -0.01 -1.21 -0.03 0.00 -1.01 0.00 0.00 66.70 64.43 1fxx h VAL 451 Cb 1.22 1.05 -0.04 0.00 -2.01 0.00 0.00 31.29 31.51 1fxx h VAL 451 CO 0.12 0.42 0.37 1.56 -1.01 0.00 0.00 177.57 179.03 1fxx h GLN 452 N 0.74 1.19 0.00 4.17 1.08 -1.40 -1.40 115.11 119.49 1fxx h GLN 452 Ca 0.12 -0.19 -0.14 0.00 -1.45 0.00 0.00 58.65 56.99 1fxx h GLN 452 Cb 0.63 -0.21 -0.02 0.00 -0.05 0.00 0.00 27.48 27.83 1fxx h GLN 452 CO 0.04 0.93 -0.69 0.37 -0.95 0.00 0.00 178.83 178.53 1fxx h GLN 453 N 1.17 0.00 -0.00 1.46 4.15 -1.04 -3.34 115.11 117.50 1fxx h GLN 453 Ca 0.28 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.70 1fxx h GLN 453 Cb 0.15 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.84 1fxx h GLN 453 CO -0.03 0.69 -0.46 0.66 -1.93 0.00 0.00 178.83 177.75 1fxx n TYR 454 N -3.58 0.01 -0.33 3.99 4.02 -0.08 -4.78 117.16 116.42 1fxx n TYR 454 Ca -0.00 -1.47 0.16 0.00 -0.01 0.00 0.00 57.90 56.57 1fxx n TYR 454 Cb 0.71 -0.25 0.39 0.00 -0.02 0.00 0.00 39.34 40.17 1fxx n TYR 454 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1fxx h ALA 455 N 0.94 1.87 0.63 -0.72 0.00 -1.38 -2.78 119.26 117.80 1fxx h ALA 455 Ca 0.00 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1fxx h ALA 455 Cb 1.01 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.75 1fxx h ALA 455 CO 0.00 -0.23 -0.30 -0.44 0.00 0.00 0.00 179.25 178.28 1fxx h ASP 456 N 0.63 -0.71 -1.03 0.00 3.32 -1.88 -3.42 116.42 113.34 1fxx h ASP 456 Ca 0.56 0.02 -0.50 0.00 0.02 0.00 0.00 57.03 57.14 1fxx h ASP 456 Cb 1.05 0.18 -0.03 0.00 0.22 0.00 0.00 39.33 40.76 1fxx h ASP 456 CO -0.33 -0.46 1.65 -0.67 -1.72 0.00 0.00 179.24 177.71 1fxx n ASP 457 N -4.54 1.64 0.23 6.45 -0.08 -1.05 -4.81 116.55 114.39 1fxx n ASP 457 Ca -0.10 -0.17 0.07 0.00 -1.51 0.00 0.00 54.79 53.08 1fxx n ASP 457 Cb 0.33 -1.33 0.61 0.00 2.34 0.00 0.00 41.12 43.07 1fxx n ASP 457 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1fxx h LYS 458 N 16.27 0.07 -0.14 -0.67 1.57 -1.83 -1.72 116.57 130.11 1fxx h LYS 458 Ca -0.18 -0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.40 1fxx h LYS 458 Cb 1.29 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 33.59 1fxx h LYS 458 CO 1.22 0.06 -0.66 0.93 -0.57 0.00 0.00 179.45 180.43 1fxx h GLU 459 N 0.07 0.70 -0.31 3.15 5.08 -1.94 -2.73 114.58 118.59 1fxx h GLU 459 Ca 0.02 -0.56 -0.12 0.00 -1.00 0.00 0.00 59.36 57.70 1fxx h GLU 459 Cb 0.01 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1fxx h GLU 459 CO -0.00 1.17 -0.26 0.87 -1.00 0.00 0.00 179.01 179.79 1fxx h LYS 460 N 0.39 0.73 -0.81 2.33 1.57 -1.79 -2.82 116.57 116.17 1fxx h LYS 460 Ca -0.04 -0.36 0.01 0.00 -1.87 0.00 0.00 60.65 58.38 1fxx h LYS 460 Cb 1.29 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.56 1fxx h LYS 460 CO 0.14 0.98 0.53 0.28 -0.57 0.00 0.00 179.45 180.81 1fxx h VAL 461 N 0.48 1.21 -0.78 0.50 2.07 -1.40 -0.36 116.25 117.98 1fxx h VAL 461 Ca 0.06 -0.40 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 1fxx h VAL 461 Cb 0.82 0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 30.58 1fxx h VAL 461 CO 0.07 0.21 0.48 0.00 0.02 0.00 0.00 177.57 178.34 1fxx h ALA 462 N 1.48 0.99 -0.41 1.67 0.00 -1.35 0.13 119.26 121.77 1fxx h ALA 462 Ca 0.30 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 1fxx h ALA 462 Cb -0.12 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.34 1fxx h ALA 462 CO -0.06 0.45 -0.11 -0.07 0.00 0.00 0.00 179.25 179.46 1fxx h LEU 463 N 1.06 0.72 -0.48 0.00 3.38 -1.03 -2.03 115.31 116.94 1fxx h LEU 463 Ca 0.28 -0.21 -0.16 0.00 0.09 0.00 0.00 57.88 57.88 1fxx h LEU 463 Cb -0.06 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1fxx h LEU 463 CO -0.05 0.85 -0.49 -0.07 0.09 0.00 0.00 178.44 178.77 1fxx h LEU 464 N 0.67 0.76 -0.50 1.67 3.38 -0.38 -1.73 115.31 119.18 1fxx h LEU 464 Ca 0.12 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1fxx h LEU 464 Cb 0.57 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1fxx h LEU 464 CO 0.04 1.12 0.27 0.11 0.09 0.00 0.00 178.44 180.07 1fxx h LYS 465 N 0.55 0.70 -0.60 1.13 1.57 -0.58 -1.91 116.57 117.43 1fxx h LYS 465 Ca 0.03 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 1fxx h LYS 465 Cb 1.05 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 33.19 1fxx h LYS 465 CO 0.10 0.55 0.32 0.00 -0.57 0.00 0.00 179.45 179.85 1fxx h ALA 466 N 1.11 0.78 -0.81 3.86 0.00 -1.23 -1.28 119.26 121.70 1fxx h ALA 466 Ca 0.18 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1fxx h ALA 466 Cb 0.05 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1fxx h ALA 466 CO -0.03 0.31 0.45 -0.07 0.00 0.00 0.00 179.25 179.91 1fxx h LEU 467 N 0.82 1.00 -0.25 0.00 3.38 -0.92 -0.00 115.31 119.34 1fxx h LEU 467 Ca 0.21 -0.08 -0.17 0.00 0.09 0.00 0.00 57.88 57.93 1fxx h LEU 467 Cb 0.07 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.57 1fxx h LEU 467 CO -0.03 0.80 -0.51 -0.25 0.09 0.00 0.00 178.44 178.54 1fxx h TRP 468 N 1.12 1.00 -0.62 1.13 -0.00 -1.06 -1.93 115.95 115.60 1fxx h TRP 468 Ca 0.29 -0.36 0.01 0.00 -0.00 0.00 0.00 58.89 58.82 1fxx h TRP 468 Cb 0.02 -0.18 -0.03 0.00 -0.00 0.00 0.00 29.16 28.96 1fxx h TRP 468 CO 0.01 1.17 0.40 1.96 -0.00 0.00 0.00 178.44 181.98 1fxx h GLN 469 N 0.54 0.78 -0.90 2.65 4.20 -0.90 -0.95 115.11 120.53 1fxx h GLN 469 Ca 0.01 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 1fxx h GLN 469 Cb 1.12 -0.18 -0.04 0.00 0.30 0.00 0.00 27.48 28.68 1fxx h GLN 469 CO 0.11 0.52 0.49 -0.92 -0.67 0.00 0.00 178.83 178.36 1fxx h TYR 470 N 0.80 1.24 -0.59 2.96 3.20 -0.93 -1.51 116.97 122.15 1fxx h TYR 470 Ca 0.23 -0.03 -0.07 0.00 3.14 0.00 0.00 58.73 62.00 1fxx h TYR 470 Cb -0.06 -0.40 -0.02 0.00 1.54 0.00 0.00 36.73 37.79 1fxx h TYR 470 CO -0.04 0.86 0.08 0.00 -1.64 0.00 0.00 178.16 177.43 1fxx h ALA 471 N 1.27 1.03 0.17 1.82 0.00 -0.79 -2.04 119.26 120.72 1fxx h ALA 471 Ca 0.32 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.98 1fxx h ALA 471 Cb 0.03 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1fxx h ALA 471 CO -0.05 0.62 -0.21 -0.44 0.00 0.00 0.00 179.25 179.17 1fxx h ASP 472 N 0.91 -0.57 0.40 0.00 3.32 -0.29 0.09 116.42 120.29 1fxx h ASP 472 Ca 0.18 0.06 -0.14 0.00 0.02 0.00 0.00 57.03 57.15 1fxx h ASP 472 Cb 0.42 0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.16 1fxx h ASP 472 CO 0.01 -0.30 -0.59 1.05 -1.72 0.00 0.00 179.24 177.69 1fxx h GLU 473 N -0.43 0.19 0.00 3.56 4.11 -1.15 -2.33 114.58 118.54 1fxx h GLU 473 Ca 0.01 -0.13 -0.15 0.00 0.07 0.00 0.00 59.36 59.17 1fxx h GLU 473 Cb 0.42 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 1fxx h GLU 473 CO -0.07 0.72 -1.51 1.51 0.07 0.00 0.00 179.01 179.73 1fxx n ILE 474 N -3.88 1.00 0.00 -1.06 3.06 -0.78 -4.66 119.36 113.04 1fxx n ILE 474 Ca -0.02 -0.67 0.00 0.00 -2.50 0.00 0.00 62.75 59.56 1fxx n ILE 474 Cb 0.60 -0.58 0.00 0.00 0.54 0.00 0.00 39.64 40.20 1fxx n ILE 474 CO 0.00 0.00 0.00 0.52 -2.50 0.00 0.00 176.55 174.57 1fxx n VAL 475 N -2.78 0.00 -2.96 9.51 0.31 0.01 -5.00 118.33 117.42 1fxx n VAL 475 Ca -0.10 -0.30 -0.35 0.00 -0.01 0.00 0.00 64.34 63.58 1fxx n VAL 475 Cb 0.80 0.81 -0.06 0.00 -0.91 0.00 0.00 33.84 34.48 1fxx n VAL 475 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1fxx s GLU 476 N -1.27 4.31 0.00 5.55 8.01 -0.87 -5.02 118.70 129.41 1fxx s GLU 476 Ca 0.00 1.02 0.00 0.00 0.01 0.00 0.00 54.97 56.00 1fxx s GLU 476 Cb 0.00 -2.66 0.00 0.00 -4.31 0.00 0.00 34.13 27.16 1fxx s GLU 476 CO 0.00 0.25 0.00 0.72 0.01 0.00 0.00 175.26 176.24