#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fxs s THR 2 N 0.00 4.59 -0.06 9.51 2.01 -1.26 -4.98 115.64 125.45 3fxs s THR 2 Ca 0.00 1.71 0.00 0.00 0.31 0.00 0.00 61.69 63.71 3fxs s THR 2 Cb 0.00 -4.15 0.00 0.00 0.01 0.00 0.00 72.50 68.36 3fxs s THR 2 CO 0.00 0.40 0.00 0.61 -0.69 0.00 0.00 174.62 174.94 3fxs n GLY 3 N 2.14 -0.63 3.39 4.40 0.00 -1.26 -4.75 105.19 108.47 3fxs n GLY 3 Ca -0.03 -0.62 -0.31 0.00 0.00 0.00 0.00 46.02 45.06 3fxs n GLY 3 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3fxs s THR 4 N -3.00 2.48 0.16 2.61 -1.32 -0.83 -4.89 115.64 110.86 3fxs s THR 4 Ca 0.00 -1.08 -0.30 0.00 -1.21 0.00 0.00 61.69 59.10 3fxs s THR 4 Cb 0.00 -1.95 -0.08 0.00 -1.51 0.00 0.00 72.50 68.96 3fxs s THR 4 CO 0.00 0.49 1.31 -0.44 -2.21 0.00 0.00 174.62 173.78 3fxs s SER 5 N -0.93 6.91 0.31 8.08 0.01 -1.26 -0.71 113.70 126.11 3fxs s SER 5 Ca 0.12 2.33 0.04 0.00 1.31 0.00 0.00 55.95 59.75 3fxs s SER 5 Cb -0.10 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.49 3fxs s SER 5 CO 0.01 -0.54 0.17 0.42 0.41 0.00 0.00 173.24 173.71 3fxs s THR 6 N 0.44 0.32 -0.16 1.44 -4.23 -0.24 -4.92 115.64 108.29 3fxs s THR 6 Ca 0.59 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 59.09 3fxs s THR 6 Cb -0.36 -2.50 0.04 0.00 1.34 0.00 0.00 72.50 71.03 3fxs s THR 6 CO 0.35 0.00 -0.05 -0.69 -0.54 0.00 0.00 174.62 173.69 3fxs s VAL 7 N -3.56 1.07 0.58 2.29 1.01 -1.26 -1.17 120.40 119.35 3fxs s VAL 7 Ca 0.35 -0.56 0.03 0.00 0.00 0.00 0.00 61.98 61.80 3fxs s VAL 7 Cb 0.05 -1.23 0.06 0.00 0.00 0.00 0.00 36.38 35.26 3fxs s VAL 7 CO 0.18 0.16 0.80 -0.83 0.00 0.00 0.00 175.10 175.41 3fxs s GLY 8 N 1.66 1.82 0.02 4.51 0.00 0.47 -4.91 107.32 110.88 3fxs s GLY 8 Ca 0.01 -1.57 0.01 0.00 0.00 0.00 0.00 44.72 43.18 3fxs s GLY 8 CO -0.08 -1.21 -0.05 0.54 0.00 0.00 0.00 173.10 172.30 3fxs s VAL 9 N -2.79 0.35 0.02 1.40 0.11 -1.00 -1.13 120.40 117.36 3fxs s VAL 9 Ca 0.60 -0.61 -0.02 0.00 -2.93 0.00 0.00 61.98 59.02 3fxs s VAL 9 Cb -0.08 -0.38 0.01 0.00 -1.53 0.00 0.00 36.38 34.39 3fxs s VAL 9 CO 0.39 -0.18 0.10 0.61 -3.33 0.00 0.00 175.10 172.69 3fxs n GLY 10 N 2.22 1.27 3.19 6.54 0.00 -0.60 0.05 105.19 117.87 3fxs n GLY 10 Ca -0.18 -0.95 -0.28 0.00 0.00 0.00 0.00 46.02 44.61 3fxs n GLY 10 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fxs s ARG 11 N -2.00 2.11 0.00 1.61 0.52 -0.76 -1.24 118.95 119.18 3fxs s ARG 11 Ca 0.02 -0.73 0.00 0.00 -0.52 0.00 0.00 55.73 54.50 3fxs s ARG 11 Cb -0.00 -1.81 0.00 0.00 0.52 0.00 0.00 34.95 33.66 3fxs s ARG 11 CO 0.01 0.30 0.00 0.41 0.02 0.00 0.00 175.30 176.04 3fxs n GLY 12 N 3.06 -0.30 0.30 -3.53 0.00 -0.29 -4.10 105.19 100.33 3fxs n GLY 12 Ca -0.18 -1.79 0.01 0.00 0.00 0.00 0.00 46.02 44.06 3fxs n GLY 12 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3fxs h VAL 13 N -0.68 1.17 -0.33 1.61 2.07 -1.90 -1.42 116.25 116.77 3fxs h VAL 13 Ca 0.00 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 67.00 3fxs h VAL 13 Cb 0.00 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.38 3fxs h VAL 13 CO 0.00 0.20 0.00 0.18 0.02 0.00 0.00 177.57 177.97 3fxs n LEU 14 N -4.37 2.29 0.00 2.57 4.77 -1.26 -4.93 117.00 116.07 3fxs n LEU 14 Ca 0.03 -1.05 0.00 0.00 -0.03 0.00 0.00 56.01 54.96 3fxs n LEU 14 Cb 0.14 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 3fxs n LEU 14 CO 0.37 0.53 0.00 0.61 -1.33 0.00 0.00 177.39 177.57 3fxs n GLY 15 N 1.23 0.74 3.75 -0.72 0.00 -0.53 -5.05 105.19 104.61 3fxs n GLY 15 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 3fxs n GLY 15 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3fxs s ASP 16 N -2.17 7.32 0.08 1.61 -4.77 -1.26 -4.80 116.67 112.68 3fxs s ASP 16 Ca 0.00 1.57 -0.25 0.00 -3.30 0.00 0.00 52.55 50.57 3fxs s ASP 16 Cb 0.00 -2.50 -0.06 0.00 -1.09 0.00 0.00 42.92 39.27 3fxs s ASP 16 CO 0.00 0.07 0.77 -1.58 0.70 0.00 0.00 175.17 175.13 3fxs s GLN 17 N -0.43 4.52 0.03 2.11 0.74 -1.26 -1.13 119.66 124.22 3fxs s GLN 17 Ca 0.39 1.10 -0.09 0.00 0.05 0.00 0.00 55.36 56.80 3fxs s GLN 17 Cb -0.22 -3.33 0.00 0.00 1.10 0.00 0.00 33.01 30.56 3fxs s GLN 17 CO 0.25 0.37 0.18 -1.59 -0.55 0.00 0.00 175.29 173.95 3fxs s LYS 18 N -0.37 0.64 0.28 1.67 -2.85 -0.37 -4.98 119.74 113.76 3fxs s LYS 18 Ca 0.38 -0.56 -0.15 0.00 -1.00 0.00 0.00 55.97 54.64 3fxs s LYS 18 Cb -0.21 0.27 -0.09 0.00 -2.06 0.00 0.00 37.83 35.74 3fxs s LYS 18 CO 0.24 -0.18 0.71 -0.80 0.10 0.00 0.00 175.35 175.42 3fxs s ASN 19 N -1.88 6.82 0.01 0.03 0.01 -1.26 -1.55 114.94 117.12 3fxs s ASN 19 Ca -0.08 1.26 0.02 0.00 -0.71 0.00 0.00 52.86 53.36 3fxs s ASN 19 Cb -0.03 -2.36 -0.01 0.00 0.41 0.00 0.00 41.25 39.26 3fxs s ASN 19 CO -0.02 -0.13 -0.08 0.27 -1.51 0.00 0.00 177.10 175.64 3fxs s ILE 20 N -1.84 0.59 -0.12 0.60 -0.00 -0.28 -4.97 121.20 115.17 3fxs s ILE 20 Ca 0.50 -0.54 -0.29 0.00 -0.00 0.00 0.00 60.65 60.32 3fxs s ILE 20 Cb -0.12 -0.54 -0.01 0.00 -0.00 0.00 0.00 42.46 41.78 3fxs s ILE 20 CO 0.19 0.01 1.09 0.20 -0.00 0.00 0.00 174.94 176.43 3fxs s ASN 21 N -0.58 7.14 0.40 4.36 -0.87 -1.26 -0.39 114.94 123.73 3fxs s ASN 21 Ca -0.00 1.59 0.03 0.00 -1.57 0.00 0.00 52.86 52.91 3fxs s ASN 21 Cb -0.05 -2.55 -0.03 0.00 -0.02 0.00 0.00 41.25 38.60 3fxs s ASN 21 CO 0.00 -0.56 0.10 0.42 -2.57 0.00 0.00 177.10 174.49 3fxs s THR 22 N 2.44 0.81 -0.06 1.60 -4.23 -0.31 -3.64 115.64 112.24 3fxs s THR 22 Ca 0.50 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.03 3fxs s THR 22 Cb -0.20 -2.43 0.02 0.00 1.34 0.00 0.00 72.50 71.23 3fxs s THR 22 CO 0.16 0.00 -0.09 -0.89 -0.54 0.00 0.00 174.62 173.27 3fxs s THR 23 N -3.18 0.88 -0.21 3.99 2.01 -0.30 -1.08 115.64 117.75 3fxs s THR 23 Ca 0.24 -0.31 -0.09 0.00 0.31 0.00 0.00 61.69 61.84 3fxs s THR 23 Cb 0.04 -0.85 -0.05 0.00 0.01 0.00 0.00 72.50 71.66 3fxs s THR 23 CO 0.13 0.30 0.11 -0.47 -0.69 0.00 0.00 174.62 174.01 3fxs s TYR 24 N 0.89 3.33 -0.36 4.92 5.04 0.11 -0.36 117.35 130.92 3fxs s TYR 24 Ca -0.11 0.20 0.02 0.00 -2.44 0.00 0.00 57.07 54.75 3fxs s TYR 24 Cb -0.15 -2.16 0.19 0.00 0.35 0.00 0.00 41.96 40.18 3fxs s TYR 24 CO 0.01 0.18 0.74 0.45 -1.34 0.00 0.00 175.55 175.59 3fxs s SER 25 N 0.57 -1.22 0.00 4.32 0.15 -1.26 -1.96 113.70 114.30 3fxs s SER 25 Ca 0.06 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.33 3fxs s SER 25 Cb -0.12 1.61 0.00 0.00 -1.71 0.00 0.00 66.02 65.80 3fxs s SER 25 CO 0.00 -0.16 0.00 0.41 1.20 0.00 0.00 173.24 174.69 3fxs n THR 26 N 4.54 0.00 -3.65 6.45 -1.04 -1.26 -4.77 114.28 114.55 3fxs n THR 26 Ca 0.09 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.89 3fxs n THR 26 Cb 0.58 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 69.06 3fxs n THR 26 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 3fxs s TYR 27 N 0.00 2.86 -0.28 -1.42 2.02 -1.26 -4.99 117.35 114.28 3fxs s TYR 27 Ca 0.00 -0.35 -0.16 0.00 -0.37 0.00 0.00 57.07 56.19 3fxs s TYR 27 Cb 0.00 -1.96 -0.03 0.00 -0.40 0.00 0.00 41.96 39.57 3fxs s TYR 27 CO 0.00 0.04 0.40 0.71 -1.57 0.00 0.00 175.55 175.13 3fxs s TYR 28 N -2.34 3.24 0.05 2.71 1.51 0.08 -4.35 117.35 118.23 3fxs s TYR 28 Ca 0.44 0.36 0.00 0.00 -1.01 0.00 0.00 57.07 56.87 3fxs s TYR 28 Cb -0.06 -2.63 -0.04 0.00 -0.11 0.00 0.00 41.96 39.12 3fxs s TYR 28 CO 0.28 -0.29 0.16 0.71 -1.11 0.00 0.00 175.55 175.30 3fxs s TYR 29 N 2.12 3.42 -1.25 2.71 1.51 0.52 -0.61 117.35 125.76 3fxs s TYR 29 Ca 0.16 0.22 -0.20 0.00 -1.01 0.00 0.00 57.07 56.24 3fxs s TYR 29 Cb -0.16 -1.74 -0.00 0.00 -0.11 0.00 0.00 41.96 39.96 3fxs s TYR 29 CO 0.10 0.58 1.83 1.28 -1.11 0.00 0.00 175.55 178.23 3fxs n LEU 30 N 0.55 4.16 -3.62 -1.29 4.77 -0.13 -1.15 117.00 120.29 3fxs n LEU 30 Ca -0.08 -3.60 -0.26 0.00 -0.03 0.00 0.00 56.01 52.04 3fxs n LEU 30 Cb 0.52 -1.74 -0.17 0.00 -2.33 0.00 0.00 43.42 39.69 3fxs n LEU 30 CO 0.47 -0.69 -0.33 -1.58 -1.33 0.00 0.00 177.39 173.93 3fxs s GLN 31 N 5.18 0.10 -0.43 3.23 0.74 -1.25 -1.36 119.66 125.86 3fxs s GLN 31 Ca 0.60 -0.09 -0.19 0.00 0.05 0.00 0.00 55.36 55.73 3fxs s GLN 31 Cb 0.02 -1.82 0.02 0.00 1.10 0.00 0.00 33.01 32.34 3fxs s GLN 31 CO 0.10 -0.66 0.52 0.34 -0.55 0.00 0.00 175.29 175.04 3fxs s ASP 32 N 2.12 6.24 0.00 6.67 2.15 0.88 -2.84 116.67 131.89 3fxs s ASP 32 Ca 0.02 -0.57 0.25 0.00 0.43 0.00 0.00 52.55 52.68 3fxs s ASP 32 Cb -0.16 -2.26 0.77 0.00 -0.30 0.00 0.00 42.92 40.97 3fxs s ASP 32 CO -0.09 -0.66 1.58 0.59 -0.17 0.00 0.00 175.17 176.42 3fxs n ASN 33 N 5.85 1.95 0.01 -0.34 3.02 -1.26 -1.63 115.26 122.85 3fxs n ASN 33 Ca -0.05 -1.68 0.12 0.00 -0.03 0.00 0.00 54.58 52.94 3fxs n ASN 33 Cb 0.47 -0.06 0.31 0.00 -0.61 0.00 0.00 39.78 39.90 3fxs n ASN 33 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3fxs n THR 34 N 0.51 0.06 -4.08 3.41 -2.24 -1.26 -4.73 114.28 105.95 3fxs n THR 34 Ca 0.17 -0.04 -0.33 0.00 -2.27 0.00 0.00 64.05 61.59 3fxs n THR 34 Cb 0.41 0.05 -0.15 0.00 -2.10 0.00 0.00 70.33 68.53 3fxs n THR 34 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3fxs s ARG 35 N -3.02 2.59 3.99 -0.78 0.52 -1.26 -5.06 118.95 115.93 3fxs s ARG 35 Ca 0.11 -1.11 0.00 0.00 -0.52 0.00 0.00 55.73 54.21 3fxs s ARG 35 Cb 0.17 -2.78 0.00 0.00 0.52 0.00 0.00 34.95 32.87 3fxs s ARG 35 CO 0.67 -0.41 0.00 0.41 0.02 0.00 0.00 175.30 175.99 3fxs n GLY 36 N 4.53 2.67 1.54 -3.53 0.00 -1.26 -0.66 105.19 108.48 3fxs n GLY 36 Ca -0.17 -0.20 -0.00 0.00 0.00 0.00 0.00 46.02 45.65 3fxs n GLY 36 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3fxs n ASN 37 N 1.36 4.06 0.00 1.61 3.02 -0.98 -4.97 115.26 119.36 3fxs n ASN 37 Ca 0.00 -2.74 0.00 0.00 -0.03 0.00 0.00 54.58 51.81 3fxs n ASN 37 Cb 0.00 -0.65 0.00 0.00 -0.61 0.00 0.00 39.78 38.52 3fxs n ASN 37 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3fxs n GLY 38 N 0.18 2.95 3.27 7.41 0.00 0.17 -4.54 105.19 114.63 3fxs n GLY 38 Ca 0.24 -1.66 -0.33 0.00 0.00 0.00 0.00 46.02 44.27 3fxs n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fxs s ILE 39 N -1.58 2.69 -0.09 -0.61 1.01 -0.65 -1.18 121.20 120.78 3fxs s ILE 39 Ca 0.00 -0.76 0.02 0.00 0.00 0.00 0.00 60.65 59.90 3fxs s ILE 39 Cb 0.00 -2.13 0.02 0.00 0.01 0.00 0.00 42.46 40.35 3fxs s ILE 39 CO 0.00 0.51 -0.13 -0.36 0.00 0.00 0.00 174.94 174.97 3fxs s PHE 40 N 0.79 1.69 -0.06 3.97 0.40 -0.21 -0.08 117.98 124.49 3fxs s PHE 40 Ca -0.05 -0.74 0.06 0.00 -0.60 0.00 0.00 56.93 55.60 3fxs s PHE 40 Cb -0.15 -1.25 -0.01 0.00 0.51 0.00 0.00 43.02 42.11 3fxs s PHE 40 CO 0.00 -0.40 -0.24 0.99 0.70 0.00 0.00 175.22 176.27 3fxs s THR 41 N 0.96 2.01 0.19 0.64 2.01 -0.47 -1.39 115.64 119.60 3fxs s THR 41 Ca -0.08 -1.04 0.10 0.00 0.31 0.00 0.00 61.69 60.98 3fxs s THR 41 Cb -0.15 -1.71 -0.04 0.00 0.01 0.00 0.00 72.50 70.61 3fxs s THR 41 CO -0.00 0.56 -0.21 -0.31 -0.69 0.00 0.00 174.62 173.97 3fxs s TYR 42 N -0.12 2.11 -0.35 4.92 1.51 0.62 -0.75 117.35 125.29 3fxs s TYR 42 Ca -0.05 -0.40 -0.13 0.00 -1.01 0.00 0.00 57.07 55.49 3fxs s TYR 42 Cb -0.14 -1.03 -0.01 0.00 -0.11 0.00 0.00 41.96 40.67 3fxs s TYR 42 CO 0.04 0.46 0.24 0.34 -1.11 0.00 0.00 175.55 175.52 3fxs s ASP 43 N -2.79 6.01 0.00 2.29 2.15 -0.08 -1.10 116.67 123.15 3fxs s ASP 43 Ca 0.20 -0.51 0.28 0.00 0.43 0.00 0.00 52.55 52.95 3fxs s ASP 43 Cb -0.07 -2.13 1.07 0.00 -0.30 0.00 0.00 42.92 41.50 3fxs s ASP 43 CO 0.09 -0.27 1.76 0.00 -0.17 0.00 0.00 175.17 176.59 3fxs n ALA 44 N 5.10 2.86 -3.73 3.66 0.00 -0.11 -1.88 120.51 126.41 3fxs n ALA 44 Ca -0.12 -0.32 -0.28 0.00 0.00 0.00 0.00 53.44 52.72 3fxs n ALA 44 Cb 0.49 -1.26 0.03 0.00 0.00 0.00 0.00 19.45 18.71 3fxs n ALA 44 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3fxs n LYS 45 N -0.82 -5.74 -0.95 0.00 5.02 -1.22 -1.27 118.16 113.18 3fxs n LYS 45 Ca 0.14 0.66 0.00 0.00 -2.02 0.00 0.00 58.31 57.08 3fxs n LYS 45 Cb 0.30 -5.56 0.00 0.00 -0.02 0.00 0.00 35.03 29.75 3fxs n LYS 45 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3fxs n TYR 46 N -4.67 0.00 -3.59 2.13 4.01 0.79 -4.97 117.16 110.86 3fxs n TYR 46 Ca 0.02 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.71 3fxs n TYR 46 Cb 0.54 -0.98 -0.00 0.00 -0.31 0.00 0.00 39.34 38.59 3fxs n TYR 46 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3fxs n ARG 47 N -1.14 1.36 0.00 -0.72 1.74 -0.39 -3.51 116.66 113.99 3fxs n ARG 47 Ca 0.00 -0.63 0.00 0.00 -0.77 0.00 0.00 57.85 56.45 3fxs n ARG 47 Cb 0.21 0.07 0.00 0.00 -1.02 0.00 0.00 32.46 31.72 3fxs n ARG 47 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3fxs n THR 48 N -0.72 0.98 -2.75 0.55 -2.24 -1.26 -1.25 114.28 107.58 3fxs n THR 48 Ca -0.01 -0.99 -0.42 0.00 -2.27 0.00 0.00 64.05 60.37 3fxs n THR 48 Cb 0.11 0.51 -0.03 0.00 -2.10 0.00 0.00 70.33 68.82 3fxs n THR 48 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3fxs s THR 49 N -0.98 4.89 0.07 4.28 2.01 -1.26 -5.04 115.64 119.61 3fxs s THR 49 Ca 0.00 1.97 0.10 0.00 0.31 0.00 0.00 61.69 64.07 3fxs s THR 49 Cb 0.00 -4.28 -0.03 0.00 0.01 0.00 0.00 72.50 68.20 3fxs s THR 49 CO 0.00 0.16 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.08 3fxs s LEU 50 N 1.07 2.29 0.00 4.42 1.43 -1.26 -3.43 118.68 123.20 3fxs s LEU 50 Ca 0.50 -0.62 0.27 0.00 -1.03 0.00 0.00 54.13 53.25 3fxs s LEU 50 Cb -0.20 -1.31 0.96 0.00 0.03 0.00 0.00 46.19 45.67 3fxs s LEU 50 CO 0.26 0.23 1.73 -0.81 0.23 0.00 0.00 176.35 177.99 3fxs n PRO 51 N 1.44 0.03 0.00 1.29 -0.04 -1.26 -5.11 135.00 131.35 3fxs n PRO 51 Ca -0.17 -0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 3fxs n PRO 51 Cb 0.52 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 3fxs n PRO 51 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3fxs n GLY 52 N 1.49 -0.41 3.61 0.55 0.00 -1.22 -4.27 105.19 104.93 3fxs n GLY 52 Ca 0.07 -1.46 -0.33 0.00 0.00 0.00 0.00 46.02 44.29 3fxs n GLY 52 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3fxs s SER 53 N -4.00 4.75 0.24 1.61 1.04 -0.78 -4.86 113.70 111.69 3fxs s SER 53 Ca 0.00 -0.03 -0.31 0.00 0.48 0.00 0.00 55.95 56.08 3fxs s SER 53 Cb 0.00 -1.19 -0.13 0.00 0.10 0.00 0.00 66.02 64.79 3fxs s SER 53 CO 0.00 0.34 1.46 -0.11 0.98 0.00 0.00 173.24 175.90 3fxs n LEU 54 N 1.95 3.27 -4.67 2.42 7.94 -1.26 -0.90 117.00 125.75 3fxs n LEU 54 Ca -0.17 1.13 -0.42 0.00 -1.11 0.00 0.00 56.01 55.44 3fxs n LEU 54 Cb 0.53 -1.45 -0.03 0.00 0.53 0.00 0.00 43.42 43.00 3fxs n LEU 54 CO 0.29 -0.37 1.25 0.86 -1.11 0.00 0.00 177.39 178.30 3fxs s TRP 55 N 0.08 2.41 -0.07 1.96 -0.11 0.07 -4.80 118.94 118.47 3fxs s TRP 55 Ca 0.69 0.50 0.04 0.00 1.22 0.00 0.00 56.10 58.55 3fxs s TRP 55 Cb -0.63 -3.79 -0.01 0.00 -1.50 0.00 0.00 33.47 27.53 3fxs s TRP 55 CO 0.48 -3.15 -0.20 0.00 -4.62 0.00 0.00 176.95 169.46 3fxs s ALA 56 N 3.31 2.38 -0.01 5.86 0.00 -1.26 -0.95 121.76 131.09 3fxs s ALA 56 Ca 0.68 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 51.65 3fxs s ALA 56 Cb -0.32 -0.86 0.01 0.00 0.00 0.00 0.00 23.12 21.94 3fxs s ALA 56 CO 0.27 0.40 -0.01 0.34 0.00 0.00 0.00 175.76 176.76 3fxs s ASP 57 N -0.14 0.27 0.28 0.00 2.15 0.22 -4.96 116.67 114.49 3fxs s ASP 57 Ca -0.03 -0.03 0.13 0.00 0.43 0.00 0.00 52.55 53.06 3fxs s ASP 57 Cb -0.14 -0.07 0.34 0.00 -0.30 0.00 0.00 42.92 42.75 3fxs s ASP 57 CO 0.04 -0.01 1.58 0.00 -0.17 0.00 0.00 175.17 176.60 3fxs h ALA 58 N 6.44 0.84 0.00 3.66 0.00 -1.93 0.25 119.26 128.52 3fxs h ALA 58 Ca -0.31 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.07 3fxs h ALA 58 Cb 1.18 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3fxs h ALA 58 CO 0.50 0.73 0.00 -0.40 0.00 0.00 0.00 179.25 180.07 3fxs n ASP 59 N -3.56 1.21 -0.36 0.00 5.68 -1.26 -4.67 116.55 113.60 3fxs n ASP 59 Ca -0.00 -1.52 -0.05 0.00 -0.50 0.00 0.00 54.79 52.72 3fxs n ASP 59 Cb 0.65 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.61 3fxs n ASP 59 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 3fxs n ASN 60 N -0.26 -4.22 -4.37 -1.12 5.15 -1.26 -5.00 115.26 104.18 3fxs n ASN 60 Ca 0.00 0.12 -0.33 0.00 -0.60 0.00 0.00 54.58 53.77 3fxs n ASN 60 Cb 0.27 -2.13 -0.14 0.00 -0.53 0.00 0.00 39.78 37.24 3fxs n ASN 60 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 3fxs s GLN 61 N -1.84 3.38 -0.54 1.20 -1.52 -1.26 -2.36 119.66 116.71 3fxs s GLN 61 Ca 0.00 -0.69 0.07 0.00 -1.95 0.00 0.00 55.36 52.79 3fxs s GLN 61 Cb 0.00 -2.62 0.32 0.00 -0.22 0.00 0.00 33.01 30.48 3fxs s GLN 61 CO 0.00 0.22 0.84 1.19 -0.25 0.00 0.00 175.29 177.29 3fxs n PHE 62 N 3.52 3.04 0.58 0.91 3.01 0.11 -4.81 117.46 123.81 3fxs n PHE 62 Ca -0.18 -3.97 0.08 0.00 1.01 0.00 0.00 57.45 54.39 3fxs n PHE 62 Cb 0.53 -0.48 0.09 0.00 -0.01 0.00 0.00 39.48 39.60 3fxs n PHE 62 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 3fxs n PHE 63 N 0.17 0.08 -2.12 1.38 3.72 -1.26 -1.84 117.46 117.59 3fxs n PHE 63 Ca 0.29 -0.06 -0.34 0.00 -0.05 0.00 0.00 57.45 57.29 3fxs n PHE 63 Cb 0.45 -0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.00 3fxs n PHE 63 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3fxs s ALA 64 N -1.34 2.66 0.33 4.37 0.00 -1.26 -4.85 121.76 121.67 3fxs s ALA 64 Ca 0.21 0.64 0.02 0.00 0.00 0.00 0.00 51.96 52.84 3fxs s ALA 64 Cb 0.14 -3.31 0.61 0.00 0.00 0.00 0.00 23.12 20.56 3fxs s ALA 64 CO 0.21 -0.85 1.94 0.66 0.00 0.00 0.00 175.76 177.72 3fxs h SER 65 N 0.79 0.81 0.25 0.00 4.64 -1.96 -1.24 113.55 116.83 3fxs h SER 65 Ca -0.48 -0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.80 3fxs h SER 65 Cb 1.24 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 63.15 3fxs h SER 65 CO 0.56 0.53 -0.16 0.22 -0.87 0.00 0.00 176.83 177.11 3fxs h TYR 66 N 0.92 0.00 0.00 4.77 3.20 -1.99 -2.67 116.97 121.21 3fxs h TYR 66 Ca 0.34 0.00 -0.11 0.00 3.14 0.00 0.00 58.73 62.10 3fxs h TYR 66 Cb 0.16 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 3fxs h TYR 66 CO -0.00 0.16 -0.51 -0.44 -1.64 0.00 0.00 178.16 175.74 3fxs h ASP 67 N 0.00 0.00 -0.47 -2.11 3.32 -1.56 -3.39 116.42 112.21 3fxs h ASP 67 Ca -0.00 0.00 0.09 0.00 0.02 0.00 0.00 57.03 57.14 3fxs h ASP 67 Cb 0.33 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.81 3fxs h ASP 67 CO 0.02 0.51 0.03 0.00 -1.72 0.00 0.00 179.24 178.07 3fxs h ALA 68 N 1.49 0.47 -0.17 3.45 0.00 -1.34 -1.12 119.26 122.05 3fxs h ALA 68 Ca -0.01 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 3fxs h ALA 68 Cb 1.28 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.27 3fxs h ALA 68 CO 0.07 -0.37 -0.00 -1.35 0.00 0.00 0.00 179.25 177.60 3fxs h PRO 69 N 0.15 0.25 -0.20 0.00 0.11 -1.78 -2.36 132.00 128.16 3fxs h PRO 69 Ca 0.24 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 66.21 3fxs h PRO 69 Cb 0.34 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.41 3fxs h PRO 69 CO -0.37 0.27 -0.26 0.00 -0.21 0.00 0.00 178.00 177.43 3fxs h ALA 70 N 1.76 0.31 -0.34 -0.75 0.00 -1.50 -0.88 119.26 117.87 3fxs h ALA 70 Ca 0.06 -0.39 0.07 0.00 0.00 0.00 0.00 54.91 54.65 3fxs h ALA 70 Cb 0.18 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 17.84 3fxs h ALA 70 CO 0.00 0.30 -0.10 0.28 0.00 0.00 0.00 179.25 179.73 3fxs h VAL 71 N 0.21 0.63 -0.11 0.00 2.07 -0.98 -1.40 116.25 116.67 3fxs h VAL 71 Ca 0.03 0.00 -0.21 0.00 0.82 0.00 0.00 66.70 67.33 3fxs h VAL 71 Cb 0.83 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 3fxs h VAL 71 CO 0.06 0.00 -0.79 0.44 0.02 0.00 0.00 177.57 177.31 3fxs h ASP 72 N -0.02 0.74 -0.81 0.57 3.32 -1.39 0.10 116.42 118.93 3fxs h ASP 72 Ca 0.17 -0.50 0.03 0.00 0.02 0.00 0.00 57.03 56.75 3fxs h ASP 72 Cb 0.28 -0.22 -0.05 0.00 0.22 0.00 0.00 39.33 39.56 3fxs h ASP 72 CO -0.36 1.28 0.52 0.00 -1.72 0.00 0.00 179.24 178.95 3fxs h ALA 73 N 0.70 1.07 0.18 3.45 0.00 -0.98 0.73 119.26 124.42 3fxs h ALA 73 Ca -0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3fxs h ALA 73 Cb 1.40 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3fxs h ALA 73 CO 0.15 0.33 -0.09 1.25 0.00 0.00 0.00 179.25 180.90 3fxs h HIS 74 N 1.00 -0.22 -0.35 0.00 -0.00 -1.18 -2.17 115.15 112.23 3fxs h HIS 74 Ca 0.33 -0.01 -0.06 0.00 -0.00 0.00 0.00 60.37 60.64 3fxs h HIS 74 Cb 0.02 0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 27.49 3fxs h HIS 74 CO -0.03 0.13 -0.00 -0.92 -0.00 0.00 0.00 177.93 177.11 3fxs h TYR 75 N -0.62 0.68 0.00 5.26 5.03 -0.86 -2.68 116.97 123.77 3fxs h TYR 75 Ca -0.02 -0.12 -0.04 0.00 2.58 0.00 0.00 58.73 61.12 3fxs h TYR 75 Cb 0.46 -0.18 -0.01 0.00 1.55 0.00 0.00 36.73 38.56 3fxs h TYR 75 CO 0.04 0.73 -0.20 1.88 -1.32 0.00 0.00 178.16 179.28 3fxs h TYR 76 N 0.43 0.00 -0.88 -3.82 0.05 -0.95 -1.02 116.97 110.78 3fxs h TYR 76 Ca 0.10 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.87 3fxs h TYR 76 Cb 0.46 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.16 3fxs h TYR 76 CO 0.04 0.20 0.51 0.00 -1.05 0.00 0.00 178.16 177.87 3fxs h ALA 77 N 1.80 1.12 -0.66 3.88 0.00 -1.31 -0.89 119.26 123.20 3fxs h ALA 77 Ca -0.00 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 3fxs h ALA 77 Cb 0.89 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 3fxs h ALA 77 CO 0.03 0.59 0.14 0.78 0.00 0.00 0.00 179.25 180.79 3fxs h GLY 78 N 1.21 1.15 1.02 0.00 0.00 -0.96 -0.43 103.07 105.06 3fxs h GLY 78 Ca 0.31 -0.74 -0.02 0.00 0.00 0.00 0.00 47.33 46.88 3fxs h GLY 78 CO -0.06 0.69 0.45 -2.08 0.00 0.00 0.00 176.54 175.55 3fxs h VAL 79 N 0.99 1.24 -0.48 4.60 2.07 -0.95 -0.34 116.25 123.38 3fxs h VAL 79 Ca 0.20 -0.61 -0.08 0.00 0.82 0.00 0.00 66.70 67.04 3fxs h VAL 79 Cb 0.40 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 3fxs h VAL 79 CO 0.01 0.27 0.01 0.74 0.02 0.00 0.00 177.57 178.62 3fxs h THR 80 N 1.16 1.26 -0.24 2.57 2.02 -0.89 0.04 112.91 118.83 3fxs h THR 80 Ca 0.29 -1.05 0.06 0.00 0.77 0.00 0.00 66.41 66.48 3fxs h THR 80 Cb 0.03 0.99 -0.06 0.00 -1.74 0.00 0.00 68.15 67.37 3fxs h THR 80 CO -0.05 0.37 -0.16 0.22 0.37 0.00 0.00 175.52 176.27 3fxs h TYR 81 N 0.71 -0.42 -0.87 3.16 5.03 -0.85 -1.97 116.97 121.75 3fxs h TYR 81 Ca 0.14 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.46 3fxs h TYR 81 Cb 0.50 0.22 -0.04 0.00 1.55 0.00 0.00 36.73 38.96 3fxs h TYR 81 CO 0.04 -0.24 0.47 -0.44 -1.32 0.00 0.00 178.16 176.67 3fxs h ASP 82 N -0.15 1.10 0.13 -2.11 3.32 -0.52 -1.40 116.42 116.79 3fxs h ASP 82 Ca 0.14 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 3fxs h ASP 82 Cb 0.36 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.63 3fxs h ASP 82 CO -0.34 0.88 -0.06 0.22 -1.72 0.00 0.00 179.24 178.23 3fxs h TYR 83 N 1.23 -0.16 -0.38 4.55 3.20 -0.42 0.17 116.97 125.15 3fxs h TYR 83 Ca 0.31 -0.00 -0.07 0.00 3.14 0.00 0.00 58.73 62.10 3fxs h TYR 83 Cb 0.03 0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 3fxs h TYR 83 CO 0.01 -0.05 -0.06 1.88 -1.64 0.00 0.00 178.16 178.30 3fxs h TYR 84 N -0.23 0.69 0.09 -3.82 0.05 -1.14 0.15 116.97 112.76 3fxs h TYR 84 Ca -0.02 -0.10 -0.00 0.00 0.05 0.00 0.00 58.73 58.66 3fxs h TYR 84 Cb 0.18 -0.19 0.00 0.00 1.01 0.00 0.00 36.73 37.74 3fxs h TYR 84 CO -0.05 0.69 -0.04 -0.22 -1.05 0.00 0.00 178.16 177.49 3fxs h LYS 85 N 0.60 -0.12 -0.03 4.88 3.64 -0.83 -0.17 116.57 124.54 3fxs h LYS 85 Ca 0.11 0.01 -0.19 0.00 -1.27 0.00 0.00 60.65 59.31 3fxs h LYS 85 Cb 0.47 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 3fxs h LYS 85 CO 0.02 0.35 -0.80 -0.91 -2.27 0.00 0.00 179.45 175.84 3fxs h ASN 86 N -0.65 0.34 0.21 4.20 2.35 -0.90 -1.85 115.58 119.28 3fxs h ASN 86 Ca -0.01 -0.25 -0.34 0.00 -0.55 0.00 0.00 56.30 55.15 3fxs h ASN 86 Cb 0.52 -0.10 -0.06 0.00 0.05 0.00 0.00 38.32 38.73 3fxs h ASN 86 CO 0.02 1.01 -2.08 0.52 -1.65 0.00 0.00 177.43 175.24 3fxs n VAL 87 N -3.75 1.52 -0.12 2.81 0.31 0.53 -4.59 118.33 115.04 3fxs n VAL 87 Ca -0.04 -0.79 0.00 0.00 -0.01 0.00 0.00 64.34 63.50 3fxs n VAL 87 Cb 0.75 -0.88 0.00 0.00 -0.91 0.00 0.00 33.84 32.80 3fxs n VAL 87 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 3fxs n HIS 88 N -2.97 0.00 -3.29 3.52 8.25 -0.62 -5.00 115.22 115.11 3fxs n HIS 88 Ca -0.27 -0.27 -0.24 0.00 -0.26 0.00 0.00 57.72 56.68 3fxs n HIS 88 Cb 1.09 -0.03 0.02 0.00 1.12 0.00 0.00 29.99 32.19 3fxs n HIS 88 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3fxs n ASN 89 N -0.27 -4.97 -4.50 0.41 5.15 -0.69 -4.95 115.26 105.43 3fxs n ASN 89 Ca 0.00 -0.39 -0.35 0.00 -0.60 0.00 0.00 54.58 53.24 3fxs n ASN 89 Cb 0.18 -4.04 -0.12 0.00 -0.53 0.00 0.00 39.78 35.28 3fxs n ASN 89 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 3fxs s ARG 90 N -5.96 3.72 -0.56 1.20 3.52 -0.17 -4.94 118.95 115.77 3fxs s ARG 90 Ca 0.40 -0.47 -0.19 0.00 -0.13 0.00 0.00 55.73 55.34 3fxs s ARG 90 Cb -0.19 -3.12 0.09 0.00 -1.56 0.00 0.00 34.95 30.17 3fxs s ARG 90 CO 0.49 0.09 0.66 -0.51 -0.81 0.00 0.00 175.30 175.22 3fxs s LEU 91 N 0.81 5.28 0.00 -0.88 1.43 -1.26 -2.30 118.68 121.76 3fxs s LEU 91 Ca 0.01 -1.26 0.00 0.00 -1.03 0.00 0.00 54.13 51.85 3fxs s LEU 91 Cb -0.14 -2.34 0.00 0.00 0.03 0.00 0.00 46.19 43.74 3fxs s LEU 91 CO 0.02 -1.01 0.00 -0.24 0.23 0.00 0.00 176.35 175.35 3fxs n SER 92 N 6.19 -6.25 0.19 2.29 2.88 -1.26 -0.60 113.62 117.06 3fxs n SER 92 Ca -0.09 0.19 0.07 0.00 -1.33 0.00 0.00 58.87 57.71 3fxs n SER 92 Cb 0.43 -0.54 0.22 0.00 -0.75 0.00 0.00 64.21 63.57 3fxs n SER 92 CO 0.00 0.00 0.00 0.10 -1.23 0.00 0.00 175.04 173.91 3fxs h TYR 93 N -0.16 0.00 -0.07 0.66 -0.00 -1.92 -2.85 116.97 112.63 3fxs h TYR 93 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 3fxs h TYR 93 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.89 3fxs h TYR 93 CO 0.00 0.31 0.00 -0.40 -0.00 0.00 0.00 178.16 178.07 3fxs n ASP 94 N -3.26 2.42 0.00 0.10 5.75 -1.26 -4.30 116.55 116.00 3fxs n ASP 94 Ca 0.02 -1.80 0.00 0.00 -0.01 0.00 0.00 54.79 52.99 3fxs n ASP 94 Cb 0.58 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.64 3fxs n ASP 94 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3fxs n GLY 95 N 1.29 0.86 2.08 6.12 0.00 -0.84 -4.85 105.19 109.85 3fxs n GLY 95 Ca 0.16 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.11 3fxs n GLY 95 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3fxs n ASN 96 N -0.01 2.66 -3.23 1.61 5.15 -0.85 -4.28 115.26 116.33 3fxs n ASN 96 Ca 0.00 -2.85 -0.23 0.00 -0.60 0.00 0.00 54.58 50.89 3fxs n ASN 96 Cb 0.00 -0.41 0.04 0.00 -0.53 0.00 0.00 39.78 38.88 3fxs n ASN 96 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 3fxs n ASN 97 N -0.55 -5.74 -4.63 1.20 5.03 0.24 -4.92 115.26 105.88 3fxs n ASN 97 Ca 0.21 -0.38 -0.40 0.00 0.87 0.00 0.00 54.58 54.89 3fxs n ASN 97 Cb 0.89 -4.62 0.03 0.00 -1.02 0.00 0.00 39.78 35.06 3fxs n ASN 97 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3fxs n ALA 98 N -3.87 0.47 -1.77 5.41 0.00 -1.26 -2.32 120.51 117.17 3fxs n ALA 98 Ca -0.07 0.16 -0.40 0.00 0.00 0.00 0.00 53.44 53.14 3fxs n ALA 98 Cb 0.59 -2.14 -0.01 0.00 0.00 0.00 0.00 19.45 17.90 3fxs n ALA 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fxs s ALA 99 N -1.34 3.35 -0.28 0.00 0.00 -1.26 -4.56 121.76 117.67 3fxs s ALA 99 Ca 0.67 1.29 -0.09 0.00 0.00 0.00 0.00 51.96 53.83 3fxs s ALA 99 Cb -0.50 -3.51 -0.02 0.00 0.00 0.00 0.00 23.12 19.09 3fxs s ALA 99 CO 0.54 -0.83 0.13 0.42 0.00 0.00 0.00 175.76 176.02 3fxs s ILE 100 N -1.21 4.67 -0.07 0.00 1.01 -0.33 -5.01 121.20 120.25 3fxs s ILE 100 Ca 0.55 -0.19 0.01 0.00 0.00 0.00 0.00 60.65 61.02 3fxs s ILE 100 Cb -0.40 -3.27 -0.03 0.00 0.01 0.00 0.00 42.46 38.77 3fxs s ILE 100 CO 0.52 0.20 -0.10 -0.13 0.00 0.00 0.00 174.94 175.43 3fxs s ARG 101 N 1.65 2.79 -0.01 2.79 0.52 -1.26 -1.04 118.95 124.40 3fxs s ARG 101 Ca 0.06 -0.62 0.02 0.00 -0.52 0.00 0.00 55.73 54.67 3fxs s ARG 101 Cb -0.16 -2.54 -0.00 0.00 0.52 0.00 0.00 34.95 32.77 3fxs s ARG 101 CO 0.06 0.57 -0.06 -1.12 0.02 0.00 0.00 175.30 174.77 3fxs s SER 102 N -0.57 0.70 -0.04 0.23 0.01 -0.48 -0.32 113.70 113.23 3fxs s SER 102 Ca 0.08 -0.11 0.06 0.00 1.31 0.00 0.00 55.95 57.29 3fxs s SER 102 Cb -0.12 -0.10 -0.02 0.00 0.21 0.00 0.00 66.02 65.99 3fxs s SER 102 CO 0.02 0.06 -0.20 -0.44 0.41 0.00 0.00 173.24 173.09 3fxs s SER 103 N -0.07 3.55 0.46 2.44 0.01 0.00 -0.27 113.70 119.81 3fxs s SER 103 Ca 0.01 -0.34 0.04 0.00 1.31 0.00 0.00 55.95 56.98 3fxs s SER 103 Cb -0.03 -0.65 -0.05 0.00 0.21 0.00 0.00 66.02 65.50 3fxs s SER 103 CO -0.00 0.32 0.01 0.68 0.41 0.00 0.00 173.24 174.66 3fxs s VAL 104 N -0.61 1.54 -1.42 3.43 -7.23 -0.26 -0.94 120.40 114.92 3fxs s VAL 104 Ca 0.09 -2.00 -0.10 0.00 -1.81 0.00 0.00 61.98 58.16 3fxs s VAL 104 Cb -0.11 -2.57 0.04 0.00 0.56 0.00 0.00 36.38 34.31 3fxs s VAL 104 CO 0.00 0.00 1.08 1.41 -0.31 0.00 0.00 175.10 177.28 3fxs n HIS 105 N -1.11 -2.58 -2.45 2.82 8.25 -1.14 -0.94 115.22 118.07 3fxs n HIS 105 Ca -0.12 0.96 -0.42 0.00 -0.26 0.00 0.00 57.72 57.88 3fxs n HIS 105 Cb 0.67 -4.59 -0.03 0.00 1.12 0.00 0.00 29.99 27.17 3fxs n HIS 105 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 3fxs s TYR 106 N -3.33 3.09 0.00 4.41 5.04 -0.84 -0.15 117.35 125.57 3fxs s TYR 106 Ca 0.57 1.15 0.00 0.00 -2.44 0.00 0.00 57.07 56.35 3fxs s TYR 106 Cb -0.27 -3.45 0.00 0.00 0.35 0.00 0.00 41.96 38.60 3fxs s TYR 106 CO 0.77 -1.44 0.00 0.45 -1.34 0.00 0.00 175.55 173.99 3fxs n SER 107 N 5.60 -3.13 -4.10 4.32 2.88 -0.38 -4.33 113.62 114.48 3fxs n SER 107 Ca 0.12 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.38 3fxs n SER 107 Cb 0.46 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.75 3fxs n SER 107 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 3fxs s GLN 108 N 0.00 2.22 -1.44 -1.46 -0.21 -1.25 -4.25 119.66 113.27 3fxs s GLN 108 Ca 0.00 -0.59 -0.06 0.00 0.02 0.00 0.00 55.36 54.73 3fxs s GLN 108 Cb 0.00 -1.76 0.03 0.00 1.00 0.00 0.00 33.01 32.28 3fxs s GLN 108 CO 0.00 0.07 0.50 0.41 -2.12 0.00 0.00 175.29 174.15 3fxs n GLY 109 N 3.74 -0.51 3.61 3.09 0.00 -1.25 -4.92 105.19 108.94 3fxs n GLY 109 Ca -0.21 0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 3fxs n GLY 109 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3fxs s TYR 110 N -3.05 3.07 -0.58 1.61 5.04 -1.25 -3.77 117.35 118.43 3fxs s TYR 110 Ca 0.30 0.79 -0.04 0.00 -2.44 0.00 0.00 57.07 55.68 3fxs s TYR 110 Cb -0.15 -3.68 0.04 0.00 0.35 0.00 0.00 41.96 38.53 3fxs s TYR 110 CO 0.38 -0.84 2.78 0.09 -1.34 0.00 0.00 175.55 176.61 3fxs n ASN 111 N 6.81 6.67 -3.74 4.32 3.02 -1.26 -0.94 115.26 130.14 3fxs n ASN 111 Ca 0.07 -3.13 -0.05 0.00 -0.03 0.00 0.00 54.58 51.44 3fxs n ASN 111 Cb 0.48 -1.27 -0.02 0.00 -0.61 0.00 0.00 39.78 38.36 3fxs n ASN 111 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3fxs s ASN 112 N 0.50 -0.24 0.00 6.41 2.47 -1.26 -5.00 114.94 117.82 3fxs s ASN 112 Ca 0.59 -0.40 -0.05 0.00 0.42 0.00 0.00 52.86 53.41 3fxs s ASN 112 Cb 0.34 0.55 -0.00 0.00 -1.45 0.00 0.00 41.25 40.69 3fxs s ASN 112 CO -0.18 -1.00 0.09 0.00 -3.72 0.00 0.00 177.10 172.29 3fxs s ALA 113 N -3.47 -0.21 -0.01 1.71 0.00 -1.26 -1.40 121.76 117.11 3fxs s ALA 113 Ca 0.11 -0.19 -0.29 0.00 0.00 0.00 0.00 51.96 51.59 3fxs s ALA 113 Cb -0.03 0.08 0.08 0.00 0.00 0.00 0.00 23.12 23.25 3fxs s ALA 113 CO 0.02 -0.18 0.71 -0.59 0.00 0.00 0.00 175.76 175.72 3fxs s PHE 114 N -1.21 -0.58 -0.16 0.00 -0.71 -0.18 -4.98 117.98 110.16 3fxs s PHE 114 Ca -0.13 0.83 -0.18 0.00 -1.04 0.00 0.00 56.93 56.41 3fxs s PHE 114 Cb -0.07 0.46 -0.04 0.00 -1.21 0.00 0.00 43.02 42.16 3fxs s PHE 114 CO 0.01 -0.63 0.46 -0.46 -1.34 0.00 0.00 175.22 173.26 3fxs s TRP 115 N -1.89 3.45 -1.31 3.49 -0.11 -1.26 -0.17 118.94 121.14 3fxs s TRP 115 Ca -0.06 0.80 0.19 0.00 1.22 0.00 0.00 56.10 58.25 3fxs s TRP 115 Cb -0.00 -2.57 0.68 0.00 -1.50 0.00 0.00 33.47 30.08 3fxs s TRP 115 CO 0.03 0.07 1.59 0.27 -4.62 0.00 0.00 176.95 174.29 3fxs n ASN 116 N 4.09 4.48 0.00 5.86 6.94 -0.37 -4.90 115.26 131.36 3fxs n ASN 116 Ca -0.07 -2.33 0.00 0.00 -0.02 0.00 0.00 54.58 52.16 3fxs n ASN 116 Cb 0.51 -0.54 0.00 0.00 -2.36 0.00 0.00 39.78 37.39 3fxs n ASN 116 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3fxs n GLY 117 N 1.19 2.44 0.00 4.83 0.00 -1.26 -4.77 105.19 107.63 3fxs n GLY 117 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 3fxs n GLY 117 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3fxs n SER 118 N 0.00 0.85 -3.83 1.61 7.64 -1.26 -5.12 113.62 113.50 3fxs n SER 118 Ca 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.80 3fxs n SER 118 Cb 0.00 0.11 -0.03 0.00 -1.01 0.00 0.00 64.21 63.28 3fxs n SER 118 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3fxs s GLN 119 N -0.93 1.68 0.18 1.43 -2.07 -1.26 -4.68 119.66 114.01 3fxs s GLN 119 Ca 0.00 -0.98 -0.16 0.00 -1.82 0.00 0.00 55.36 52.41 3fxs s GLN 119 Cb 0.00 0.58 -0.07 0.00 -1.09 0.00 0.00 33.01 32.43 3fxs s GLN 119 CO 0.00 -0.76 0.60 -1.64 -1.32 0.00 0.00 175.29 172.18 3fxs s MET 120 N -3.92 4.05 -0.07 9.60 -1.94 0.56 -1.23 119.30 126.36 3fxs s MET 120 Ca 0.12 0.59 0.01 0.00 -1.71 0.00 0.00 55.69 54.70 3fxs s MET 120 Cb -0.04 -2.89 0.02 0.00 2.01 0.00 0.00 34.83 33.93 3fxs s MET 120 CO 0.05 0.44 -0.07 0.08 -0.01 0.00 0.00 175.02 175.50 3fxs s VAL 121 N -1.51 0.82 -0.13 -6.03 1.01 0.76 -0.82 120.40 114.50 3fxs s VAL 121 Ca 0.40 -0.26 0.01 0.00 0.00 0.00 0.00 61.98 62.13 3fxs s VAL 121 Cb -0.15 -0.81 0.02 0.00 0.00 0.00 0.00 36.38 35.43 3fxs s VAL 121 CO 0.20 0.30 -0.16 -0.31 0.00 0.00 0.00 175.10 175.13 3fxs s TYR 122 N 1.05 2.16 0.82 5.22 2.02 -0.12 -1.01 117.35 127.48 3fxs s TYR 122 Ca -0.08 -1.11 -0.12 0.00 -0.37 0.00 0.00 57.07 55.38 3fxs s TYR 122 Cb -0.14 -1.55 0.08 0.00 -0.40 0.00 0.00 41.96 39.94 3fxs s TYR 122 CO -0.00 -0.58 1.11 0.20 -1.57 0.00 0.00 175.55 174.71 3fxs s GLY 123 N 1.17 1.61 0.00 0.71 0.00 -0.50 -1.99 107.32 108.32 3fxs s GLY 123 Ca -0.02 -0.34 0.25 0.00 0.00 0.00 0.00 44.72 44.61 3fxs s GLY 123 CO -0.05 0.11 1.41 1.22 0.00 0.00 0.00 173.10 175.79 3fxs n ASP 124 N -3.45 1.06 -0.44 1.64 8.00 -1.21 -2.35 116.55 119.79 3fxs n ASP 124 Ca 0.07 -0.85 0.06 0.00 0.71 0.00 0.00 54.79 54.78 3fxs n ASP 124 Cb 0.58 0.28 -0.02 0.00 -0.02 0.00 0.00 41.12 41.93 3fxs n ASP 124 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3fxs n GLY 125 N 1.40 -2.31 0.80 0.44 0.00 -0.11 -1.76 105.19 103.65 3fxs n GLY 125 Ca 0.10 -1.37 0.12 0.00 0.00 0.00 0.00 46.02 44.87 3fxs n GLY 125 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3fxs n ASP 126 N -2.98 2.45 0.00 1.61 5.68 -1.17 -3.96 116.55 118.18 3fxs n ASP 126 Ca -0.02 -1.81 0.00 0.00 -0.50 0.00 0.00 54.79 52.46 3fxs n ASP 126 Cb 0.20 -0.06 0.00 0.00 -1.14 0.00 0.00 41.12 40.12 3fxs n ASP 126 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3fxs n GLY 127 N 1.30 2.23 0.46 6.12 0.00 0.69 -4.80 105.19 111.19 3fxs n GLY 127 Ca 0.17 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.13 3fxs n GLY 127 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fxs n GLN 128 N -2.00 0.33 0.11 1.61 -0.00 -1.26 -4.75 117.38 111.41 3fxs n GLN 128 Ca 0.00 0.13 -0.19 0.00 -0.00 0.00 0.00 57.00 56.94 3fxs n GLN 128 Cb 0.00 -1.07 -0.13 0.00 -0.00 0.00 0.00 30.24 29.04 3fxs n GLN 128 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.06 178.21 3fxs h THR 129 N -0.61 1.38 -3.84 -0.39 2.02 -1.95 -3.34 112.91 106.18 3fxs h THR 129 Ca -0.02 -2.74 -0.14 0.00 0.77 0.00 0.00 66.41 64.28 3fxs h THR 129 Cb 0.64 2.84 -0.19 0.00 -1.74 0.00 0.00 68.15 69.70 3fxs h THR 129 CO -0.01 0.82 -0.58 -0.36 0.37 0.00 0.00 175.52 175.76 3fxs s PHE 130 N -2.81 0.22 0.50 3.16 0.08 -1.26 -0.15 117.98 117.72 3fxs s PHE 130 Ca -0.07 -0.50 0.06 0.00 0.12 0.00 0.00 56.93 56.54 3fxs s PHE 130 Cb 0.06 -0.16 0.04 0.00 -0.57 0.00 0.00 43.02 42.39 3fxs s PHE 130 CO 0.91 -0.31 0.69 0.96 -0.10 0.00 0.00 175.22 177.37 3fxs s ILE 131 N -2.24 2.69 0.03 0.64 -4.36 -0.70 -0.22 121.20 117.04 3fxs s ILE 131 Ca -0.08 -0.90 -0.36 0.00 -0.26 0.00 0.00 60.65 59.05 3fxs s ILE 131 Cb -0.04 -2.79 -0.15 0.00 1.25 0.00 0.00 42.46 40.74 3fxs s ILE 131 CO -0.03 0.00 1.55 -2.65 0.24 0.00 0.00 174.94 174.05 3fxs n PRO 132 N -2.10 1.59 0.20 0.37 -0.02 -0.72 -4.36 135.00 129.95 3fxs n PRO 132 Ca 0.10 0.58 0.14 0.00 -2.02 0.00 0.00 63.50 62.30 3fxs n PRO 132 Cb 0.60 -2.29 0.42 0.00 -0.02 0.00 0.00 33.50 32.21 3fxs n PRO 132 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3fxs h LEU 133 N 6.00 0.00 0.00 2.45 4.07 -1.73 -1.77 115.31 124.33 3fxs h LEU 133 Ca -0.47 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.49 3fxs h LEU 133 Cb 1.30 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.04 3fxs h LEU 133 CO 0.86 0.00 0.00 -1.54 -1.08 0.00 0.00 178.44 176.68 3fxs n SER 134 N -2.80 0.00 0.06 -0.43 3.41 -1.26 -1.94 113.62 110.67 3fxs n SER 134 Ca 0.03 0.20 0.09 0.00 -0.26 0.00 0.00 58.87 58.93 3fxs n SER 134 Cb 0.40 -0.32 0.39 0.00 -0.26 0.00 0.00 64.21 64.42 3fxs n SER 134 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fxs n GLY 135 N -0.45 -1.10 3.45 5.00 0.00 -0.67 -4.28 105.19 107.14 3fxs n GLY 135 Ca 0.04 0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 3fxs n GLY 135 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3fxs s GLY 136 N -3.27 1.97 0.39 -0.02 0.00 -0.82 -4.83 107.32 100.75 3fxs s GLY 136 Ca 0.05 -1.64 0.06 0.00 0.00 0.00 0.00 44.72 43.19 3fxs s GLY 136 CO 0.31 0.86 2.03 1.19 0.00 0.00 0.00 173.10 177.49 3fxs h ILE 137 N 5.68 1.11 -0.08 0.90 2.10 -1.88 -1.56 117.51 123.77 3fxs h ILE 137 Ca -0.28 -0.23 -0.10 0.00 1.08 0.00 0.00 64.86 65.34 3fxs h ILE 137 Cb 1.12 0.38 -0.01 0.00 -1.09 0.00 0.00 36.82 37.22 3fxs h ILE 137 CO 0.69 0.12 -0.38 -2.24 -1.08 0.00 0.00 178.15 175.26 3fxs h ASP 138 N 0.67 0.17 -0.05 2.19 3.04 -1.93 -0.49 116.42 120.03 3fxs h ASP 138 Ca 0.20 -0.07 -0.01 0.00 -3.24 0.00 0.00 57.03 53.91 3fxs h ASP 138 Cb -0.03 -0.05 -0.00 0.00 -1.04 0.00 0.00 39.33 38.21 3fxs h ASP 138 CO -0.05 0.55 -0.01 0.58 -2.04 0.00 0.00 179.24 178.27 3fxs h VAL 139 N 0.14 1.29 -0.02 4.15 2.07 -1.64 0.56 116.25 122.79 3fxs h VAL 139 Ca 0.01 -0.89 0.03 0.00 0.82 0.00 0.00 66.70 66.67 3fxs h VAL 139 Cb 0.75 1.79 -0.04 0.00 -1.52 0.00 0.00 31.29 32.27 3fxs h VAL 139 CO 0.06 0.24 -0.18 0.58 0.02 0.00 0.00 177.57 178.28 3fxs h VAL 140 N -0.25 0.55 -0.04 2.57 2.07 -1.11 -0.99 116.25 119.06 3fxs h VAL 140 Ca 0.01 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.43 3fxs h VAL 140 Cb 0.39 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 3fxs h VAL 140 CO 0.00 0.00 -0.43 0.00 0.02 0.00 0.00 177.57 177.16 3fxs h ALA 141 N 0.64 1.21 0.26 1.67 0.00 -1.12 -1.46 119.26 120.46 3fxs h ALA 141 Ca 0.06 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 3fxs h ALA 141 Cb 0.37 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3fxs h ALA 141 CO -0.19 0.57 -0.21 1.25 0.00 0.00 0.00 179.25 180.67 3fxs h HIS 142 N 0.08 -0.54 -0.06 0.00 6.17 -0.57 -1.05 115.15 119.18 3fxs h HIS 142 Ca 0.00 -0.00 -0.16 0.00 0.71 0.00 0.00 60.37 60.92 3fxs h HIS 142 Cb 0.80 0.20 -0.01 0.00 2.52 0.00 0.00 27.41 30.92 3fxs h HIS 142 CO 0.01 -0.31 -0.68 0.93 0.71 0.00 0.00 177.93 178.58 3fxs h GLU 143 N -0.47 0.28 -0.23 5.26 4.39 -0.94 -2.43 114.58 120.43 3fxs h GLU 143 Ca -0.02 -0.22 -0.02 0.00 0.34 0.00 0.00 59.36 59.45 3fxs h GLU 143 Cb 0.42 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.10 3fxs h GLU 143 CO -0.01 0.86 0.07 -0.07 -1.16 0.00 0.00 179.01 178.69 3fxs h LEU 144 N 0.19 0.29 -1.68 1.33 4.07 -1.25 -0.88 115.31 117.39 3fxs h LEU 144 Ca -0.02 -0.02 -0.04 0.00 0.08 0.00 0.00 57.88 57.88 3fxs h LEU 144 Cb 1.23 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 42.89 3fxs h LEU 144 CO 0.11 0.29 -0.19 0.74 -1.08 0.00 0.00 178.44 178.31 3fxs h THR 145 N 0.32 0.88 -0.28 0.22 2.02 -0.71 -0.63 112.91 114.73 3fxs h THR 145 Ca 0.08 -0.72 -0.02 0.00 0.77 0.00 0.00 66.41 66.52 3fxs h THR 145 Cb 0.11 1.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 3fxs h THR 145 CO -0.01 0.19 0.10 0.45 0.37 0.00 0.00 175.52 176.63 3fxs h HIS 146 N 0.00 0.39 -0.44 3.16 3.86 -0.85 -0.20 115.15 121.07 3fxs h HIS 146 Ca -0.00 -0.01 -0.13 0.00 -1.16 0.00 0.00 60.37 59.07 3fxs h HIS 146 Cb 0.40 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.74 3fxs h HIS 146 CO 0.00 0.32 -0.23 0.00 0.86 0.00 0.00 177.93 178.88 3fxs h ALA 147 N 1.72 0.76 -0.10 2.45 0.00 -1.13 0.23 119.26 123.19 3fxs h ALA 147 Ca 0.10 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.63 3fxs h ALA 147 Cb 0.10 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3fxs h ALA 147 CO -0.01 0.66 0.03 0.28 0.00 0.00 0.00 179.25 180.21 3fxs h VAL 148 N 0.78 0.97 -0.36 0.00 2.07 -1.05 -2.44 116.25 116.22 3fxs h VAL 148 Ca 0.10 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.59 3fxs h VAL 148 Cb 0.78 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 3fxs h VAL 148 CO 0.06 0.01 0.22 0.74 0.02 0.00 0.00 177.57 178.63 3fxs h THR 149 N 0.08 1.12 -0.24 2.57 2.02 -0.88 -1.91 112.91 115.67 3fxs h THR 149 Ca 0.04 -0.28 0.07 0.00 0.77 0.00 0.00 66.41 67.01 3fxs h THR 149 Cb 0.03 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.09 3fxs h THR 149 CO -0.05 0.12 0.19 0.44 0.37 0.00 0.00 175.52 176.58 3fxs h ASP 150 N 0.47 0.00 0.30 4.18 3.32 -0.77 0.12 116.42 124.05 3fxs h ASP 150 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 3fxs h ASP 150 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 3fxs h ASP 150 CO -0.02 0.00 -0.36 -1.22 -1.72 0.00 0.00 179.24 175.91 3fxs n TYR 151 N -4.31 0.00 0.00 4.55 4.02 -0.80 -4.36 117.16 116.26 3fxs n TYR 151 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.92 3fxs n TYR 151 Cb 0.33 -0.15 0.00 0.00 -0.02 0.00 0.00 39.34 39.50 3fxs n TYR 151 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 3fxs n THR 152 N -0.92 0.00 -0.35 -0.72 -2.24 -0.60 -4.93 114.28 104.53 3fxs n THR 152 Ca 0.10 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.88 3fxs n THR 152 Cb 0.35 0.00 0.17 0.00 -2.10 0.00 0.00 70.33 68.74 3fxs n THR 152 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fxs h ALA 153 N 1.00 1.38 -0.32 6.98 0.00 -1.37 -3.47 119.26 123.46 3fxs h ALA 153 Ca 0.00 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 3fxs h ALA 153 Cb 0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 3fxs h ALA 153 CO 0.00 0.53 -0.07 0.41 0.00 0.00 0.00 179.25 180.12 3fxs n GLY 154 N -1.38 0.36 3.68 0.00 0.00 0.31 -2.11 105.19 106.05 3fxs n GLY 154 Ca 0.13 -0.83 -0.49 0.00 0.00 0.00 0.00 46.02 44.83 3fxs n GLY 154 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3fxs n LEU 155 N -0.37 3.32 -4.76 0.99 4.77 -1.26 -4.18 117.00 115.49 3fxs n LEU 155 Ca -0.03 0.99 -0.41 0.00 -0.03 0.00 0.00 56.01 56.53 3fxs n LEU 155 Cb 0.39 -1.35 -0.01 0.00 -2.33 0.00 0.00 43.42 40.12 3fxs n LEU 155 CO 0.04 -0.11 1.18 -0.63 -1.33 0.00 0.00 177.39 176.54 3fxs s ILE 156 N 3.78 2.10 -1.31 -0.08 1.01 -0.26 -4.82 121.20 121.63 3fxs s ILE 156 Ca 0.92 0.09 -0.06 0.00 0.00 0.00 0.00 60.65 61.60 3fxs s ILE 156 Cb -0.73 -3.06 0.13 0.00 0.01 0.00 0.00 42.46 38.82 3fxs s ILE 156 CO 0.52 0.02 2.28 0.00 0.00 0.00 0.00 174.94 177.75 3fxs n TYR 157 N 1.36 2.65 -3.50 3.97 9.36 -1.26 -1.76 117.16 127.98 3fxs n TYR 157 Ca 0.05 -2.81 -0.16 0.00 3.32 0.00 0.00 57.90 58.30 3fxs n TYR 157 Cb 0.38 -1.84 -0.05 0.00 -0.63 0.00 0.00 39.34 37.21 3fxs n TYR 157 CO 0.00 0.00 0.00 -0.65 0.22 0.00 0.00 176.86 176.43 3fxs s GLN 158 N -0.94 1.12 4.22 2.98 1.11 -1.26 -4.83 119.66 122.06 3fxs s GLN 158 Ca 0.51 -0.02 0.00 0.00 0.01 0.00 0.00 55.36 55.86 3fxs s GLN 158 Cb 0.17 0.52 0.00 0.00 -1.01 0.00 0.00 33.01 32.69 3fxs s GLN 158 CO -0.07 -0.41 0.00 0.09 0.01 0.00 0.00 175.29 174.91 3fxs n ASN 159 N 0.46 0.00 0.06 5.90 3.02 -0.27 -1.64 115.26 122.78 3fxs n ASN 159 Ca -0.18 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.26 3fxs n ASN 159 Cb 0.60 0.00 -0.00 0.00 -0.61 0.00 0.00 39.78 39.77 3fxs n ASN 159 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 3fxs h GLU 160 N 0.00 0.38 -0.16 3.52 5.08 -1.89 -0.36 114.58 121.15 3fxs h GLU 160 Ca 0.00 -0.35 -0.03 0.00 -1.00 0.00 0.00 59.36 57.98 3fxs h GLU 160 Cb 0.00 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 3fxs h GLU 160 CO 0.00 1.01 -0.03 0.66 -1.00 0.00 0.00 179.01 179.65 3fxs h SER 161 N 0.24 0.20 -0.22 1.42 4.64 -1.53 -1.21 113.55 117.09 3fxs h SER 161 Ca -0.05 -0.03 -0.17 0.00 -0.47 0.00 0.00 61.79 61.07 3fxs h SER 161 Cb 1.42 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 63.45 3fxs h SER 161 CO 0.14 0.28 -0.51 1.23 -0.87 0.00 0.00 176.83 177.09 3fxs h GLY 162 N 0.53 0.88 1.94 -0.77 0.00 -0.46 0.04 103.07 105.22 3fxs h GLY 162 Ca 0.05 -0.99 -0.10 0.00 0.00 0.00 0.00 47.33 46.29 3fxs h GLY 162 CO 0.01 0.89 -0.46 0.00 0.00 0.00 0.00 176.54 176.98 3fxs h ALA 163 N 0.79 1.19 -0.28 3.60 0.00 -0.55 -1.00 119.26 123.01 3fxs h ALA 163 Ca 0.02 -0.42 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 3fxs h ALA 163 Cb 1.10 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 3fxs h ALA 163 CO 0.11 0.59 -0.01 0.82 0.00 0.00 0.00 179.25 180.76 3fxs h ILE 164 N 0.06 1.26 -0.32 0.00 2.04 -1.12 -0.28 117.51 119.15 3fxs h ILE 164 Ca 0.00 -0.94 0.07 0.00 1.00 0.00 0.00 64.86 64.99 3fxs h ILE 164 Cb 0.83 1.33 -0.07 0.00 -0.74 0.00 0.00 36.82 38.17 3fxs h ILE 164 CO 0.06 0.30 -0.13 -1.13 0.00 0.00 0.00 178.15 177.25 3fxs h ASN 165 N 0.27 -0.44 -0.41 1.72 -0.73 -0.64 0.18 115.58 115.53 3fxs h ASN 165 Ca 0.08 0.11 0.00 0.00 1.87 0.00 0.00 56.30 58.37 3fxs h ASN 165 Cb 0.43 0.25 -0.02 0.00 0.27 0.00 0.00 38.32 39.26 3fxs h ASN 165 CO 0.02 -0.16 0.27 -0.33 -0.37 0.00 0.00 177.43 176.86 3fxs h GLU 166 N -0.07 0.54 -0.39 6.67 4.39 -1.12 -2.24 114.58 122.36 3fxs h GLU 166 Ca 0.16 -0.03 -0.07 0.00 0.34 0.00 0.00 59.36 59.76 3fxs h GLU 166 Cb 0.31 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.82 3fxs h GLU 166 CO -0.37 0.36 -0.05 0.00 -1.16 0.00 0.00 179.01 177.79 3fxs h ALA 167 N 1.15 1.19 -0.94 3.43 0.00 -0.48 0.26 119.26 123.86 3fxs h ALA 167 Ca 0.15 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 3fxs h ALA 167 Cb -0.06 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.52 3fxs h ALA 167 CO -0.03 0.53 0.58 0.82 0.00 0.00 0.00 179.25 181.14 3fxs h ILE 168 N 0.60 1.25 -0.44 0.00 1.08 -0.35 0.34 117.51 120.00 3fxs h ILE 168 Ca 0.12 -0.53 -0.12 0.00 -0.39 0.00 0.00 64.86 63.94 3fxs h ILE 168 Cb 0.45 -0.09 -0.02 0.00 -3.07 0.00 0.00 36.82 34.10 3fxs h ILE 168 CO 0.02 0.26 -0.19 0.28 -0.69 0.00 0.00 178.15 177.83 3fxs h SER 169 N 1.29 0.87 -0.39 1.72 0.02 -0.80 -0.55 113.55 115.72 3fxs h SER 169 Ca 0.34 -0.31 -0.12 0.00 -0.84 0.00 0.00 61.79 60.86 3fxs h SER 169 Cb -0.08 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.21 3fxs h SER 169 CO -0.07 1.04 -0.19 0.44 -1.14 0.00 0.00 176.83 176.92 3fxs h ASP 170 N 0.76 0.89 0.44 3.07 3.32 -0.19 0.42 116.42 125.13 3fxs h ASP 170 Ca 0.11 -0.32 -0.02 0.00 0.02 0.00 0.00 57.03 56.82 3fxs h ASP 170 Cb 0.72 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.03 3fxs h ASP 170 CO 0.06 1.06 -0.21 0.40 -1.72 0.00 0.00 179.24 178.82 3fxs h ILE 171 N 0.77 0.56 0.00 0.35 2.04 -0.14 -0.93 117.51 120.15 3fxs h ILE 171 Ca 0.11 -0.23 -0.10 0.00 1.00 0.00 0.00 64.86 65.64 3fxs h ILE 171 Cb 0.73 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 3fxs h ILE 171 CO 0.06 0.04 -0.50 -0.26 0.00 0.00 0.00 178.15 177.49 3fxs h PHE 172 N -0.73 0.00 -0.93 1.37 0.04 -1.12 -0.44 116.94 115.13 3fxs h PHE 172 Ca -0.06 0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.72 3fxs h PHE 172 Cb 0.52 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.62 3fxs h PHE 172 CO -0.02 0.50 0.62 0.78 -0.60 0.00 0.00 178.31 179.59 3fxs h GLY 173 N 2.18 1.31 0.97 -1.45 0.00 -0.85 0.44 103.07 105.67 3fxs h GLY 173 Ca -0.00 -0.49 -0.14 0.00 0.00 0.00 0.00 47.33 46.70 3fxs h GLY 173 CO 0.06 0.47 -0.41 -0.84 0.00 0.00 0.00 176.54 175.83 3fxs h THR 174 N 1.25 1.32 -0.38 4.70 2.02 -0.75 -1.74 112.91 119.32 3fxs h THR 174 Ca 0.34 -1.63 -0.03 0.00 0.77 0.00 0.00 66.41 65.87 3fxs h THR 174 Cb -0.13 1.82 -0.02 0.00 -1.74 0.00 0.00 68.15 68.07 3fxs h THR 174 CO -0.08 0.51 0.13 -0.07 0.37 0.00 0.00 175.52 176.38 3fxs h LEU 175 N 0.36 0.50 -0.72 2.58 3.38 -0.87 0.75 115.31 121.29 3fxs h LEU 175 Ca 0.01 -0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.83 3fxs h LEU 175 Cb 1.01 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 3fxs h LEU 175 CO 0.09 0.48 -0.06 0.58 0.09 0.00 0.00 178.44 179.62 3fxs h VAL 176 N 0.54 1.26 -0.40 1.22 2.07 -0.79 -0.03 116.25 120.13 3fxs h VAL 176 Ca 0.13 -1.16 0.02 0.00 0.82 0.00 0.00 66.70 66.51 3fxs h VAL 176 Cb 0.16 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 3fxs h VAL 176 CO -0.01 0.41 0.23 -0.08 0.02 0.00 0.00 177.57 178.14 3fxs h GLU 177 N 0.83 0.45 -0.73 1.57 4.81 -0.57 -0.40 114.58 120.55 3fxs h GLU 177 Ca 0.14 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.30 3fxs h GLU 177 Cb 0.58 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.83 3fxs h GLU 177 CO 0.04 0.30 0.26 0.74 -0.73 0.00 0.00 179.01 179.62 3fxs h PHE 178 N 0.47 1.13 -0.78 0.92 0.04 -0.72 -0.79 116.94 117.21 3fxs h PHE 178 Ca 0.16 -0.09 0.04 0.00 2.80 0.00 0.00 57.97 60.88 3fxs h PHE 178 Cb 0.02 -0.34 -0.05 0.00 2.20 0.00 0.00 35.95 37.78 3fxs h PHE 178 CO -0.08 0.88 0.49 -0.92 -0.60 0.00 0.00 178.31 178.08 3fxs h TYR 179 N 1.07 0.91 0.00 -0.55 5.03 -0.17 -0.78 116.97 122.49 3fxs h TYR 179 Ca 0.24 0.03 -0.10 0.00 2.58 0.00 0.00 58.73 61.48 3fxs h TYR 179 Cb 0.25 -0.30 -0.01 0.00 1.55 0.00 0.00 36.73 38.22 3fxs h TYR 179 CO 0.02 0.49 -0.48 0.00 -1.32 0.00 0.00 178.16 176.87 3fxs h ALA 180 N 1.35 0.97 -4.45 1.82 0.00 -0.97 -3.47 119.26 114.51 3fxs h ALA 180 Ca 0.33 -0.44 -0.30 0.00 0.00 0.00 0.00 54.91 54.50 3fxs h ALA 180 Cb 0.08 -0.08 0.10 0.00 0.00 0.00 0.00 17.79 17.89 3fxs h ALA 180 CO -0.14 0.60 -0.50 -1.71 0.00 0.00 0.00 179.25 177.51 3fxs n ASN 181 N -3.62 -5.23 -4.09 0.00 5.15 -0.30 -4.99 115.26 102.17 3fxs n ASN 181 Ca -0.01 -0.38 -0.33 0.00 -0.60 0.00 0.00 54.58 53.27 3fxs n ASN 181 Cb 0.56 -3.86 -0.15 0.00 -0.53 0.00 0.00 39.78 35.80 3fxs n ASN 181 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3fxs s LYS 182 N -5.90 2.17 -1.34 1.20 3.01 -1.25 -4.75 119.74 112.88 3fxs s LYS 182 Ca 0.41 -1.42 -0.11 0.00 -1.01 0.00 0.00 55.97 53.84 3fxs s LYS 182 Cb -0.18 -3.02 0.01 0.00 -1.01 0.00 0.00 37.83 33.63 3fxs s LYS 182 CO 0.51 -0.65 0.48 0.09 0.51 0.00 0.00 175.35 176.29 3fxs n ASN 183 N 4.45 -1.91 -4.81 2.83 3.02 -1.26 -4.91 115.26 112.68 3fxs n ASN 183 Ca -0.11 -1.11 -0.33 0.00 -0.03 0.00 0.00 54.58 53.00 3fxs n ASN 183 Cb 0.42 -2.63 -0.03 0.00 -0.61 0.00 0.00 39.78 36.93 3fxs n ASN 183 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3fxs s PRO 184 N -6.72 3.74 0.37 3.52 0.04 -1.26 -5.04 135.00 129.66 3fxs s PRO 184 Ca 0.20 1.20 -0.15 0.00 0.04 0.00 0.00 61.00 62.28 3fxs s PRO 184 Cb -0.09 -2.10 0.05 0.00 0.04 0.00 0.00 34.50 32.41 3fxs s PRO 184 CO 0.92 -0.46 0.77 0.16 0.04 0.00 0.00 177.00 178.42 3fxs s ASP 185 N -2.48 0.03 -0.26 6.66 1.47 -1.26 -5.03 116.67 115.79 3fxs s ASP 185 Ca 0.64 -1.12 0.12 0.00 1.18 0.00 0.00 52.55 53.37 3fxs s ASP 185 Cb -0.14 0.83 0.63 0.00 -0.34 0.00 0.00 42.92 43.90 3fxs s ASP 185 CO 0.27 -1.64 1.60 0.79 0.68 0.00 0.00 175.17 176.87 3fxs n TRP 186 N -0.53 1.64 -3.91 2.11 7.02 -1.26 -4.89 117.44 117.62 3fxs n TRP 186 Ca -0.08 -1.14 -0.21 0.00 -1.02 0.00 0.00 57.50 55.05 3fxs n TRP 186 Cb 0.60 -0.51 -0.03 0.00 -2.42 0.00 0.00 31.31 28.95 3fxs n TRP 186 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 3fxs s GLU 187 N -2.98 3.13 -0.19 -0.99 0.41 -1.26 -0.63 118.70 116.20 3fxs s GLU 187 Ca 0.49 -0.96 -0.01 0.00 -0.41 0.00 0.00 54.97 54.08 3fxs s GLU 187 Cb 0.40 -2.72 0.01 0.00 -1.78 0.00 0.00 34.13 30.03 3fxs s GLU 187 CO 0.09 0.32 -0.14 0.42 -0.49 0.00 0.00 175.26 175.46 3fxs s ILE 188 N -2.10 2.62 0.00 -1.63 -1.09 -0.28 -4.72 121.20 113.99 3fxs s ILE 188 Ca 0.36 -0.76 0.00 0.00 -2.23 0.00 0.00 60.65 58.03 3fxs s ILE 188 Cb -0.08 -2.14 0.00 0.00 -1.58 0.00 0.00 42.46 38.66 3fxs s ILE 188 CO 0.28 0.50 0.00 0.61 -1.23 0.00 0.00 174.94 175.09 3fxs n GLY 189 N 4.57 0.74 0.33 6.18 0.00 -1.26 -1.33 105.19 114.42 3fxs n GLY 189 Ca -0.20 0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.96 3fxs n GLY 189 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3fxs h GLU 190 N 4.05 0.12 0.00 1.61 9.09 -1.85 -1.54 114.58 126.07 3fxs h GLU 190 Ca 0.00 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.40 3fxs h GLU 190 Cb 0.00 -0.03 0.00 0.00 -1.65 0.00 0.00 28.75 27.07 3fxs h GLU 190 CO 0.00 0.08 0.00 -0.44 0.05 0.00 0.00 179.01 178.70 3fxs h ASP 191 N 0.12 0.00 0.00 3.06 3.32 -1.91 -3.30 116.42 117.71 3fxs h ASP 191 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 3fxs h ASP 191 Cb 0.53 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.08 3fxs h ASP 191 CO -0.02 0.00 0.00 1.33 -1.72 0.00 0.00 179.24 178.83 3fxs n VAL 192 N -2.58 0.00 -3.20 -1.35 0.24 -0.73 -4.87 118.33 105.83 3fxs n VAL 192 Ca 0.02 -0.43 -0.39 0.00 -2.04 0.00 0.00 64.34 61.51 3fxs n VAL 192 Cb 0.30 1.03 -0.06 0.00 -1.47 0.00 0.00 33.84 33.65 3fxs n VAL 192 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 3fxs s TYR 193 N -0.66 3.72 -0.44 6.34 5.04 -0.66 -1.71 117.35 128.97 3fxs s TYR 193 Ca 0.00 1.25 -0.34 0.00 -2.44 0.00 0.00 57.07 55.54 3fxs s TYR 193 Cb 0.00 -2.60 0.05 0.00 0.35 0.00 0.00 41.96 39.76 3fxs s TYR 193 CO 0.00 0.40 0.61 0.25 -1.34 0.00 0.00 175.55 175.47 3fxs n THR 194 N 2.48 -3.47 0.27 4.34 -2.24 0.79 -4.80 114.28 111.65 3fxs n THR 194 Ca -0.07 0.06 0.11 0.00 -2.27 0.00 0.00 64.05 61.88 3fxs n THR 194 Cb 0.51 -3.17 0.54 0.00 -2.10 0.00 0.00 70.33 66.11 3fxs n THR 194 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 3fxs n PRO 195 N -0.34 0.16 0.00 -0.78 -0.04 -1.26 -1.18 135.00 131.56 3fxs n PRO 195 Ca -0.10 0.54 0.14 0.00 -0.04 0.00 0.00 63.50 64.04 3fxs n PRO 195 Cb 0.63 -1.91 0.53 0.00 -0.04 0.00 0.00 33.50 32.71 3fxs n PRO 195 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3fxs n GLY 196 N -0.71 -0.10 2.82 0.55 0.00 -1.26 -4.82 105.19 101.66 3fxs n GLY 196 Ca 0.00 -0.43 -0.23 0.00 0.00 0.00 0.00 46.02 45.36 3fxs n GLY 196 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fxs s ILE 197 N -2.04 0.50 0.42 -0.61 1.01 -0.33 -5.14 121.20 115.00 3fxs s ILE 197 Ca 0.37 0.01 -0.04 0.00 0.00 0.00 0.00 60.65 61.00 3fxs s ILE 197 Cb 0.21 -0.61 -0.04 0.00 0.01 0.00 0.00 42.46 42.03 3fxs s ILE 197 CO 0.35 0.27 0.70 -0.44 0.00 0.00 0.00 174.94 175.82 3fxs s SER 198 N 1.71 6.31 0.00 3.58 0.01 -1.26 -4.36 113.70 119.69 3fxs s SER 198 Ca 0.02 0.79 0.00 0.00 1.31 0.00 0.00 55.95 58.07 3fxs s SER 198 Cb -0.13 -2.18 0.00 0.00 0.21 0.00 0.00 66.02 63.92 3fxs s SER 198 CO -0.05 -0.45 0.00 0.61 0.41 0.00 0.00 173.24 173.77 3fxs n GLY 199 N -1.92 0.85 3.80 3.44 0.00 -1.26 -5.02 105.19 105.07 3fxs n GLY 199 Ca -0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.79 3fxs n GLY 199 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3fxs n ASP 200 N -0.01 2.41 -3.00 1.61 5.75 -1.26 -5.14 116.55 116.91 3fxs n ASP 200 Ca 0.00 -2.69 -0.04 0.00 -0.01 0.00 0.00 54.79 52.05 3fxs n ASP 200 Cb 0.01 -0.22 0.02 0.00 -1.03 0.00 0.00 41.12 39.89 3fxs n ASP 200 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 3fxs n SER 201 N -2.08 -1.69 -0.09 -1.12 3.41 -1.26 -4.51 113.62 106.28 3fxs n SER 201 Ca 0.07 -1.96 -0.13 0.00 -0.26 0.00 0.00 58.87 56.59 3fxs n SER 201 Cb 0.60 2.77 -0.05 0.00 -0.26 0.00 0.00 64.21 67.27 3fxs n SER 201 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3fxs h LEU 202 N 0.00 0.63 -7.76 1.04 3.38 -1.49 -3.48 115.31 107.64 3fxs h LEU 202 Ca -0.26 -0.45 -0.08 0.00 0.09 0.00 0.00 57.88 57.18 3fxs h LEU 202 Cb 1.10 -0.18 -0.14 0.00 0.09 0.00 0.00 40.66 41.54 3fxs h LEU 202 CO 0.34 0.95 -0.31 -0.13 0.09 0.00 0.00 178.44 179.38 3fxs s ARG 203 N -4.44 0.90 -0.07 1.13 0.52 -1.23 -4.99 118.95 110.78 3fxs s ARG 203 Ca -0.13 -0.93 0.02 0.00 -0.52 0.00 0.00 55.73 54.17 3fxs s ARG 203 Cb 0.08 0.37 0.01 0.00 0.52 0.00 0.00 34.95 35.93 3fxs s ARG 203 CO 0.80 -0.30 -0.13 0.45 0.02 0.00 0.00 175.30 176.14 3fxs s SER 204 N -2.86 1.91 0.09 0.23 0.15 -1.26 -1.13 113.70 110.83 3fxs s SER 204 Ca 0.05 -0.32 -0.02 0.00 0.70 0.00 0.00 55.95 56.36 3fxs s SER 204 Cb 0.04 -0.88 -0.24 0.00 -1.71 0.00 0.00 66.02 63.23 3fxs s SER 204 CO -0.10 0.04 1.19 0.24 1.20 0.00 0.00 173.24 175.80 3fxs h MET 205 N 6.99 0.22 0.00 5.44 2.86 -1.21 -2.70 114.93 126.53 3fxs h MET 205 Ca -0.30 -0.36 -0.18 0.00 -2.06 0.00 0.00 59.70 56.81 3fxs h MET 205 Cb 1.19 0.13 -0.03 0.00 0.06 0.00 0.00 31.60 32.96 3fxs h MET 205 CO 0.47 1.16 -0.84 0.66 1.06 0.00 0.00 176.91 179.42 3fxs h SER 206 N 0.07 0.00 -2.05 1.22 4.64 -1.87 -3.29 113.55 112.28 3fxs h SER 206 Ca -0.10 0.00 -0.44 0.00 -0.47 0.00 0.00 61.79 60.77 3fxs h SER 206 Cb 1.89 0.00 -0.32 0.00 -0.31 0.00 0.00 62.40 63.65 3fxs h SER 206 CO 0.18 0.84 -0.78 -0.62 -0.87 0.00 0.00 176.83 175.58 3fxs s ASP 207 N -6.70 1.14 0.48 4.97 2.15 -1.26 -5.00 116.67 112.45 3fxs s ASP 207 Ca 0.01 -2.19 0.19 0.00 0.43 0.00 0.00 52.55 50.99 3fxs s ASP 207 Cb 0.10 0.28 1.19 0.00 -0.30 0.00 0.00 42.92 44.20 3fxs s ASP 207 CO 0.79 -0.21 1.98 -0.65 -0.17 0.00 0.00 175.17 176.92 3fxs h PRO 208 N 6.29 0.22 0.00 4.34 0.11 -1.68 -1.48 132.00 139.80 3fxs h PRO 208 Ca 0.13 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.22 3fxs h PRO 208 Cb 1.00 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.06 3fxs h PRO 208 CO 0.24 0.14 0.00 0.00 -0.21 0.00 0.00 178.00 178.17 3fxs h ALA 209 N 1.72 1.00 -0.06 -0.75 0.00 -1.78 -1.83 119.26 117.57 3fxs h ALA 209 Ca 0.27 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.20 3fxs h ALA 209 Cb 0.76 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 3fxs h ALA 209 CO -0.05 0.00 0.08 -0.22 0.00 0.00 0.00 179.25 179.06 3fxs h LYS 210 N 0.00 0.00 -0.05 0.00 3.64 -1.56 -1.02 116.57 117.58 3fxs h LYS 210 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3fxs h LYS 210 Cb 0.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 3fxs h LYS 210 CO 0.00 0.00 0.00 0.66 -2.27 0.00 0.00 179.45 177.84 3fxs n TYR 211 N -3.67 0.14 -0.95 1.91 4.01 -0.72 -4.97 117.16 112.91 3fxs n TYR 211 Ca -0.02 -0.89 0.00 0.00 -0.16 0.00 0.00 57.90 56.83 3fxs n TYR 211 Cb 0.17 -0.15 0.00 0.00 -0.31 0.00 0.00 39.34 39.04 3fxs n TYR 211 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3fxs n GLY 212 N -1.11 0.46 3.86 2.72 0.00 -0.39 -5.04 105.19 105.69 3fxs n GLY 212 Ca 0.14 -0.62 -0.34 0.00 0.00 0.00 0.00 46.02 45.20 3fxs n GLY 212 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3fxs s ASP 213 N -2.56 6.70 0.44 1.61 1.01 -1.02 -4.95 116.67 117.90 3fxs s ASP 213 Ca 0.00 0.93 -0.25 0.00 0.71 0.00 0.00 52.55 53.94 3fxs s ASP 213 Cb 0.00 -2.23 -0.08 0.00 1.01 0.00 0.00 42.92 41.62 3fxs s ASP 213 CO 0.00 0.07 1.28 -2.16 0.21 0.00 0.00 175.17 174.57 3fxs s PRO 214 N -2.21 3.79 -0.06 8.23 0.04 -1.26 -2.43 135.00 141.11 3fxs s PRO 214 Ca 0.39 2.08 0.09 0.00 0.04 0.00 0.00 61.00 63.60 3fxs s PRO 214 Cb -0.14 -2.60 0.13 0.00 0.04 0.00 0.00 34.50 31.94 3fxs s PRO 214 CO 0.20 -0.62 1.05 -0.40 0.04 0.00 0.00 177.00 177.27 3fxs n ASP 215 N -0.19 2.04 -3.63 6.66 5.68 -1.26 -2.39 116.55 123.45 3fxs n ASP 215 Ca 0.06 -2.46 -0.15 0.00 -0.50 0.00 0.00 54.79 51.73 3fxs n ASP 215 Cb 0.45 -0.20 -0.08 0.00 -1.14 0.00 0.00 41.12 40.15 3fxs n ASP 215 CO 0.00 0.00 0.00 -2.28 -1.33 0.00 0.00 177.20 173.59 3fxs s HIS 216 N -1.80 -0.58 0.46 2.11 5.04 -1.26 -4.69 115.29 114.58 3fxs s HIS 216 Ca 0.15 1.21 0.12 0.00 -1.54 0.00 0.00 55.06 55.00 3fxs s HIS 216 Cb 0.13 0.27 1.06 0.00 0.04 0.00 0.00 32.58 34.07 3fxs s HIS 216 CO 0.01 -0.43 2.09 -0.92 -2.34 0.00 0.00 174.74 173.16 3fxs h TYR 217 N 4.23 0.28 0.00 3.88 3.20 -1.13 -0.30 116.97 127.14 3fxs h TYR 217 Ca -0.28 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.60 3fxs h TYR 217 Cb 1.16 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 39.34 3fxs h TYR 217 CO 0.41 0.17 0.00 -1.13 -1.64 0.00 0.00 178.16 175.97 3fxs n SER 218 N -4.50 0.37 -1.14 -2.11 3.41 -1.26 -1.56 113.62 106.82 3fxs n SER 218 Ca 0.01 0.62 0.08 0.00 -0.26 0.00 0.00 58.87 59.32 3fxs n SER 218 Cb 0.10 -0.69 0.28 0.00 -0.26 0.00 0.00 64.21 63.64 3fxs n SER 218 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3fxs n LYS 219 N -1.94 3.32 -1.84 4.33 5.02 -0.12 -5.03 118.16 121.89 3fxs n LYS 219 Ca 0.01 -2.66 -0.37 0.00 -2.02 0.00 0.00 58.31 53.27 3fxs n LYS 219 Cb 0.13 -1.72 0.05 0.00 -0.02 0.00 0.00 35.03 33.47 3fxs n LYS 219 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 3fxs s ARG 220 N -1.93 2.73 -0.03 1.97 1.70 -0.60 -4.67 118.95 118.12 3fxs s ARG 220 Ca 0.41 1.99 -0.27 0.00 -0.47 0.00 0.00 55.73 57.39 3fxs s ARG 220 Cb 0.28 -1.89 -0.03 0.00 -0.57 0.00 0.00 34.95 32.74 3fxs s ARG 220 CO 0.17 -1.44 0.87 -0.47 -1.08 0.00 0.00 175.30 173.36 3fxs s TYR 221 N -1.46 3.62 -0.03 5.89 5.04 -1.26 -4.97 117.35 124.18 3fxs s TYR 221 Ca 0.80 1.52 0.05 0.00 -2.44 0.00 0.00 57.07 57.00 3fxs s TYR 221 Cb -0.35 -3.00 0.07 0.00 0.35 0.00 0.00 41.96 39.03 3fxs s TYR 221 CO 0.38 0.02 1.00 0.25 -1.34 0.00 0.00 175.55 175.86 3fxs n THR 222 N 3.89 1.13 -1.20 4.34 -2.24 -1.26 -4.79 114.28 114.14 3fxs n THR 222 Ca 0.03 -1.23 0.00 0.00 -2.27 0.00 0.00 64.05 60.58 3fxs n THR 222 Cb 0.51 0.34 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 3fxs n THR 222 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fxs n GLY 223 N -0.69 -0.54 0.02 3.38 0.00 -1.26 -5.04 105.19 101.06 3fxs n GLY 223 Ca 0.04 -1.74 0.06 0.00 0.00 0.00 0.00 46.02 44.38 3fxs n GLY 223 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3fxs n THR 224 N -1.55 0.00 -1.52 2.61 -2.24 -1.26 -4.24 114.28 106.08 3fxs n THR 224 Ca 0.00 -0.19 -0.37 0.00 -2.27 0.00 0.00 64.05 61.22 3fxs n THR 224 Cb 0.00 1.01 0.07 0.00 -2.10 0.00 0.00 70.33 69.31 3fxs n THR 224 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fxs n GLN 225 N -1.25 0.74 -3.71 -0.78 1.13 -1.26 -2.96 117.38 109.29 3fxs n GLN 225 Ca 0.03 0.30 -0.24 0.00 -1.94 0.00 0.00 57.00 55.15 3fxs n GLN 225 Cb 0.22 -2.21 0.05 0.00 0.11 0.00 0.00 30.24 28.40 3fxs n GLN 225 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 3fxs n ASP 226 N -1.24 -3.12 -3.44 1.08 2.03 -1.26 -1.17 116.55 109.43 3fxs n ASP 226 Ca 0.14 -0.74 -0.25 0.00 0.52 0.00 0.00 54.79 54.46 3fxs n ASP 226 Cb 0.48 -4.30 0.01 0.00 -0.72 0.00 0.00 41.12 36.59 3fxs n ASP 226 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 3fxs n ASN 227 N -3.00 -4.30 -0.05 1.67 5.03 -1.24 -1.42 115.26 111.95 3fxs n ASN 227 Ca -0.15 -0.47 0.00 0.00 0.87 0.00 0.00 54.58 54.83 3fxs n ASN 227 Cb 0.61 -3.51 0.00 0.00 -1.02 0.00 0.00 39.78 35.86 3fxs n ASN 227 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3fxs n GLY 228 N -1.33 0.70 2.09 7.41 0.00 -0.41 -1.12 105.19 112.54 3fxs n GLY 228 Ca -0.02 -0.71 -0.06 0.00 0.00 0.00 0.00 46.02 45.23 3fxs n GLY 228 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fxs n GLY 229 N -0.93 0.42 0.25 -0.02 0.00 -0.32 -4.26 105.19 100.34 3fxs n GLY 229 Ca 0.00 -0.48 0.10 0.00 0.00 0.00 0.00 46.02 45.64 3fxs n GLY 229 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3fxs h VAL 230 N -0.54 0.83 -0.02 1.61 -1.51 -1.50 0.21 116.25 115.33 3fxs h VAL 230 Ca -0.15 -0.39 0.00 0.00 -1.23 0.00 0.00 66.70 64.92 3fxs h VAL 230 Cb 1.10 1.23 0.00 0.00 -2.13 0.00 0.00 31.29 31.49 3fxs h VAL 230 CO 0.16 0.10 -0.01 1.41 -1.23 0.00 0.00 177.57 178.01 3fxs n HIS 231 N -4.05 0.00 -0.04 5.19 8.25 -1.26 -3.37 115.22 119.93 3fxs n HIS 231 Ca -0.02 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.39 3fxs n HIS 231 Cb 0.19 -0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.28 3fxs n HIS 231 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 3fxs n ILE 232 N 0.51 0.97 0.48 1.59 5.41 -0.32 -4.58 119.36 123.43 3fxs n ILE 232 Ca 0.17 0.26 0.06 0.00 1.00 0.00 0.00 62.75 64.25 3fxs n ILE 232 Cb 0.43 -1.91 0.28 0.00 -0.71 0.00 0.00 39.64 37.72 3fxs n ILE 232 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 3fxs n ASN 233 N -3.67 0.00 0.31 4.38 3.02 0.60 -1.35 115.26 118.55 3fxs n ASN 233 Ca -0.07 0.36 0.17 0.00 -0.03 0.00 0.00 54.58 55.01 3fxs n ASN 233 Cb 0.27 -0.42 0.99 0.00 -0.61 0.00 0.00 39.78 40.01 3fxs n ASN 233 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3fxs h SER 234 N 0.00 0.00 -0.45 6.41 4.64 -1.73 -2.11 113.55 120.31 3fxs h SER 234 Ca 0.00 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.34 3fxs h SER 234 Cb 0.18 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.24 3fxs h SER 234 CO 0.00 0.01 0.30 1.23 -0.87 0.00 0.00 176.83 177.50 3fxs h GLY 235 N 0.07 0.60 0.95 -0.77 0.00 -1.39 0.20 103.07 102.74 3fxs h GLY 235 Ca -0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 3fxs h GLY 235 CO 0.00 0.20 0.19 -2.22 0.00 0.00 0.00 176.54 174.71 3fxs h ILE 236 N 0.56 1.17 0.13 2.60 2.04 -1.00 0.06 117.51 123.07 3fxs h ILE 236 Ca 0.17 -0.50 -0.29 0.00 1.00 0.00 0.00 64.86 65.25 3fxs h ILE 236 Cb 0.01 0.77 0.02 0.00 -0.74 0.00 0.00 36.82 36.88 3fxs h ILE 236 CO -0.04 0.19 -1.25 0.40 0.00 0.00 0.00 178.15 177.45 3fxs h ILE 237 N 0.50 1.34 -0.92 -0.67 1.08 -1.57 -2.71 117.51 114.55 3fxs h ILE 237 Ca 0.14 -2.62 0.08 0.00 -0.39 0.00 0.00 64.86 62.06 3fxs h ILE 237 Cb 0.12 2.77 -0.07 0.00 -3.07 0.00 0.00 36.82 36.57 3fxs h ILE 237 CO -0.02 0.79 0.58 0.78 -0.69 0.00 0.00 178.15 179.59 3fxs h ASN 238 N 0.21 0.89 -0.63 1.72 2.35 -0.90 0.53 115.58 119.75 3fxs h ASN 238 Ca -0.18 0.02 -0.06 0.00 -0.55 0.00 0.00 56.30 55.54 3fxs h ASN 238 Cb 1.93 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 40.11 3fxs h ASN 238 CO 0.23 0.55 0.18 0.50 -1.65 0.00 0.00 177.43 177.24 3fxs h LYS 239 N 1.02 1.00 -0.37 0.81 1.63 -0.95 0.18 116.57 119.88 3fxs h LYS 239 Ca 0.41 -0.23 0.00 0.00 -0.85 0.00 0.00 60.65 59.99 3fxs h LYS 239 Cb 0.24 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 31.71 3fxs h LYS 239 CO -0.20 0.89 0.25 0.00 -3.45 0.00 0.00 179.45 176.94 3fxs h ALA 240 N 1.06 0.47 -0.66 5.00 0.00 -0.96 -0.20 119.26 123.97 3fxs h ALA 240 Ca 0.20 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 3fxs h ALA 240 Cb 0.32 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3fxs h ALA 240 CO -0.00 -0.07 0.40 0.00 0.00 0.00 0.00 179.25 179.58 3fxs h ALA 241 N 1.14 0.84 -0.84 0.00 0.00 -0.71 0.50 119.26 120.19 3fxs h ALA 241 Ca 0.14 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3fxs h ALA 241 Cb -0.06 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.43 3fxs h ALA 241 CO -0.03 0.30 0.54 -0.92 0.00 0.00 0.00 179.25 179.15 3fxs h TYR 242 N 0.89 1.07 -0.49 0.00 3.20 -0.47 -1.55 116.97 119.62 3fxs h TYR 242 Ca 0.24 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 62.02 3fxs h TYR 242 Cb -0.04 -0.36 -0.02 0.00 1.54 0.00 0.00 36.73 37.86 3fxs h TYR 242 CO -0.02 0.69 -0.11 -0.07 -1.64 0.00 0.00 178.16 177.00 3fxs h LEU 243 N 1.14 0.95 -0.83 2.82 3.38 -0.44 0.39 115.31 122.72 3fxs h LEU 243 Ca 0.31 -0.36 0.02 0.00 0.09 0.00 0.00 57.88 57.94 3fxs h LEU 243 Cb -0.11 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.34 3fxs h LEU 243 CO -0.06 1.09 0.54 0.40 0.09 0.00 0.00 178.44 180.50 3fxs h ILE 244 N 0.80 1.16 -0.02 1.22 2.04 -0.52 0.65 117.51 122.85 3fxs h ILE 244 Ca 0.13 -0.37 -0.05 0.00 1.00 0.00 0.00 64.86 65.57 3fxs h ILE 244 Cb 0.67 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.75 3fxs h ILE 244 CO 0.05 0.20 -0.17 -1.28 0.00 0.00 0.00 178.15 176.95 3fxs h SER 245 N 1.08 0.17 0.00 1.72 0.87 -0.89 0.15 113.55 116.64 3fxs h SER 245 Ca 0.32 -0.72 0.00 0.00 -1.23 0.00 0.00 61.79 60.16 3fxs h SER 245 Cb -0.05 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 61.86 3fxs h SER 245 CO -0.10 0.87 -1.21 0.00 -0.53 0.00 0.00 176.83 175.86 3fxs n GLN 246 N -4.58 1.15 -0.79 2.24 1.13 0.13 -0.76 117.38 115.90 3fxs n GLN 246 Ca -0.09 -0.07 0.10 0.00 -1.94 0.00 0.00 57.00 55.00 3fxs n GLN 246 Cb 0.44 -1.32 -0.03 0.00 0.11 0.00 0.00 30.24 29.44 3fxs n GLN 246 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3fxs n GLY 247 N 1.46 -2.10 0.00 1.08 0.00 0.22 -4.44 105.19 101.42 3fxs n GLY 247 Ca 0.00 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.73 3fxs n GLY 247 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fxs n GLY 248 N -3.26 0.57 3.30 -0.02 0.00 -0.81 -4.77 105.19 100.19 3fxs n GLY 248 Ca -0.01 -1.69 -0.33 0.00 0.00 0.00 0.00 46.02 43.99 3fxs n GLY 248 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fxs s THR 249 N -1.46 2.78 -0.11 2.61 2.01 -1.26 -0.49 115.64 119.72 3fxs s THR 249 Ca 0.00 -0.74 -0.01 0.00 0.31 0.00 0.00 61.69 61.25 3fxs s THR 249 Cb 0.00 -2.17 0.03 0.00 0.01 0.00 0.00 72.50 70.37 3fxs s THR 249 CO 0.00 0.52 -0.05 -2.28 -0.69 0.00 0.00 174.62 172.11 3fxs s HIS 250 N 0.67 1.30 -1.68 4.92 5.04 -0.33 -4.68 115.29 120.52 3fxs s HIS 250 Ca -0.07 -0.63 -0.15 0.00 -1.54 0.00 0.00 55.06 52.67 3fxs s HIS 250 Cb -0.16 -1.13 0.14 0.00 0.04 0.00 0.00 32.58 31.47 3fxs s HIS 250 CO 0.02 -0.48 0.63 0.66 -2.34 0.00 0.00 174.74 173.24 3fxs n TYR 251 N 4.99 -1.58 -0.30 3.88 4.01 -1.26 -1.16 117.16 125.73 3fxs n TYR 251 Ca -0.11 0.76 0.00 0.00 -0.16 0.00 0.00 57.90 58.39 3fxs n TYR 251 Cb 0.50 -2.85 0.00 0.00 -0.31 0.00 0.00 39.34 36.68 3fxs n TYR 251 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3fxs n GLY 252 N -1.52 1.20 3.58 2.72 0.00 -1.26 -5.02 105.19 104.88 3fxs n GLY 252 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3fxs n GLY 252 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fxs s VAL 253 N -2.86 4.79 -0.06 1.61 1.01 -0.31 -5.06 120.40 119.51 3fxs s VAL 253 Ca 0.00 -0.02 -0.13 0.00 0.00 0.00 0.00 61.98 61.83 3fxs s VAL 253 Cb 0.00 -3.20 -0.05 0.00 0.00 0.00 0.00 36.38 33.12 3fxs s VAL 253 CO 0.00 0.39 0.32 -0.44 0.00 0.00 0.00 175.10 175.36 3fxs s SER 254 N 0.97 6.64 -0.11 3.32 0.01 -1.26 -1.19 113.70 122.09 3fxs s SER 254 Ca 0.05 0.76 0.04 0.00 1.31 0.00 0.00 55.95 58.10 3fxs s SER 254 Cb -0.14 -2.19 0.00 0.00 0.21 0.00 0.00 66.02 63.90 3fxs s SER 254 CO 0.03 0.31 -0.23 -0.69 0.41 0.00 0.00 173.24 173.07 3fxs s VAL 255 N -0.80 2.08 -0.35 3.43 1.01 0.36 -4.89 120.40 121.24 3fxs s VAL 255 Ca 0.20 -1.00 -0.26 0.00 0.00 0.00 0.00 61.98 60.92 3fxs s VAL 255 Cb -0.15 -1.80 0.01 0.00 0.00 0.00 0.00 36.38 34.45 3fxs s VAL 255 CO 0.09 0.56 0.91 -0.69 0.00 0.00 0.00 175.10 175.97 3fxs s VAL 256 N 0.42 4.63 0.36 2.92 1.01 -1.26 -1.93 120.40 126.55 3fxs s VAL 256 Ca -0.17 1.25 -0.27 0.00 0.00 0.00 0.00 61.98 62.79 3fxs s VAL 256 Cb -0.18 -4.29 -0.09 0.00 0.00 0.00 0.00 36.38 31.82 3fxs s VAL 256 CO 0.07 -0.46 1.16 -0.83 0.00 0.00 0.00 175.10 175.05 3fxs s GLY 257 N 1.78 2.92 0.00 4.51 0.00 -1.26 -4.72 107.32 110.56 3fxs s GLY 257 Ca 0.37 0.97 0.10 0.00 0.00 0.00 0.00 44.72 46.16 3fxs s GLY 257 CO 0.17 1.52 0.90 0.29 0.00 0.00 0.00 173.10 175.97 3fxs n ILE 258 N 0.44 0.19 0.00 0.90 -5.35 0.52 -4.83 119.36 111.22 3fxs n ILE 258 Ca 0.02 -0.59 0.00 0.00 -0.27 0.00 0.00 62.75 61.91 3fxs n ILE 258 Cb 0.46 1.08 0.00 0.00 -1.74 0.00 0.00 39.64 39.44 3fxs n ILE 258 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3fxs n GLY 259 N 0.54 0.39 0.29 3.28 0.00 0.06 -4.56 105.19 105.19 3fxs n GLY 259 Ca 0.07 -1.78 -0.09 0.00 0.00 0.00 0.00 46.02 44.22 3fxs n GLY 259 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3fxs h ARG 260 N 0.00 1.02 -0.62 1.61 3.08 -1.93 -2.13 114.38 115.41 3fxs h ARG 260 Ca 0.00 -0.29 -0.05 0.00 0.07 0.00 0.00 59.98 59.71 3fxs h ARG 260 Cb 0.00 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 29.91 3fxs h ARG 260 CO 0.00 0.97 0.21 -0.44 -1.07 0.00 0.00 179.97 179.64 3fxs h ASP 261 N 0.93 0.89 0.09 7.04 3.32 -1.98 0.17 116.42 126.88 3fxs h ASP 261 Ca 0.18 -0.20 -0.22 0.00 0.02 0.00 0.00 57.03 56.81 3fxs h ASP 261 Cb 0.46 -0.23 0.01 0.00 0.22 0.00 0.00 39.33 39.79 3fxs h ASP 261 CO 0.02 0.85 -0.86 0.11 -1.72 0.00 0.00 179.24 177.64 3fxs h LYS 262 N 0.88 0.60 -0.56 3.56 1.57 -1.79 -0.67 116.57 120.16 3fxs h LYS 262 Ca 0.20 -0.55 0.10 0.00 -1.87 0.00 0.00 60.65 58.53 3fxs h LYS 262 Cb 0.27 0.13 -0.07 0.00 0.08 0.00 0.00 32.23 32.64 3fxs h LYS 262 CO -0.01 1.17 0.15 1.25 -0.57 0.00 0.00 179.45 181.44 3fxs h LEU 263 N 0.38 0.08 -0.66 2.94 5.85 -0.95 -0.18 115.31 122.77 3fxs h LEU 263 Ca -0.07 0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.69 3fxs h LEU 263 Cb 1.48 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.59 3fxs h LEU 263 CO 0.16 0.06 0.21 1.23 -0.34 0.00 0.00 178.44 179.76 3fxs h GLY 264 N 0.30 1.09 0.94 3.75 0.00 -0.33 -1.64 103.07 107.17 3fxs h GLY 264 Ca 0.29 -0.64 -0.04 0.00 0.00 0.00 0.00 47.33 46.93 3fxs h GLY 264 CO -0.34 0.60 0.08 0.50 0.00 0.00 0.00 176.54 177.38 3fxs h LYS 265 N 0.95 0.66 -0.06 4.80 1.79 -0.68 -0.37 116.57 123.65 3fxs h LYS 265 Ca 0.21 -0.17 -0.00 0.00 -2.18 0.00 0.00 60.65 58.51 3fxs h LYS 265 Cb 0.29 -0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 30.86 3fxs h LYS 265 CO -0.01 0.70 0.03 0.82 -1.08 0.00 0.00 179.45 179.91 3fxs h ILE 266 N 0.51 1.08 -0.07 1.86 2.04 -0.88 -1.31 117.51 120.74 3fxs h ILE 266 Ca 0.12 -0.22 -0.14 0.00 1.00 0.00 0.00 64.86 65.62 3fxs h ILE 266 Cb 0.35 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 3fxs h ILE 266 CO 0.01 0.07 -0.57 -0.26 0.00 0.00 0.00 178.15 177.40 3fxs h PHE 267 N 0.01 0.28 -0.49 1.37 -1.00 -1.31 0.08 116.94 115.87 3fxs h PHE 267 Ca 0.02 -0.10 -0.02 0.00 2.81 0.00 0.00 57.97 60.68 3fxs h PHE 267 Cb 0.08 -0.05 -0.02 0.00 3.61 0.00 0.00 35.95 39.56 3fxs h PHE 267 CO -0.05 0.74 0.23 -0.92 -1.61 0.00 0.00 178.31 176.70 3fxs h TYR 268 N 0.17 0.71 -0.37 -0.55 3.20 -0.94 0.55 116.97 119.74 3fxs h TYR 268 Ca -0.00 -0.04 -0.11 0.00 3.14 0.00 0.00 58.73 61.72 3fxs h TYR 268 Cb 1.05 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 39.09 3fxs h TYR 268 CO 0.02 0.57 -0.20 -0.09 -1.64 0.00 0.00 178.16 176.82 3fxs h ARG 269 N 0.65 0.79 -0.34 1.82 2.43 -1.01 -1.16 114.38 117.57 3fxs h ARG 269 Ca 0.17 -0.35 0.04 0.00 -0.81 0.00 0.00 59.98 59.03 3fxs h ARG 269 Cb 0.12 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.62 3fxs h ARG 269 CO -0.02 0.98 0.12 0.00 -1.51 0.00 0.00 179.97 179.53 3fxs h ALA 270 N 0.79 0.39 -0.81 2.80 0.00 -0.85 0.37 119.26 121.94 3fxs h ALA 270 Ca 0.08 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3fxs h ALA 270 Cb 0.75 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 3fxs h ALA 270 CO 0.06 -0.28 0.51 1.25 0.00 0.00 0.00 179.25 180.79 3fxs h LEU 271 N 0.26 0.96 0.00 0.00 5.85 -0.52 -0.11 115.31 121.74 3fxs h LEU 271 Ca 0.15 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3fxs h LEU 271 Cb 0.12 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 40.91 3fxs h LEU 271 CO -0.16 0.72 -1.69 0.35 -0.34 0.00 0.00 178.44 177.32 3fxs n THR 272 N -4.39 0.14 0.02 1.05 -2.24 -0.47 -2.86 114.28 105.53 3fxs n THR 272 Ca 0.09 -0.47 0.01 0.00 -2.27 0.00 0.00 64.05 61.41 3fxs n THR 272 Cb 0.05 -0.01 -0.01 0.00 -2.10 0.00 0.00 70.33 68.26 3fxs n THR 272 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fxs n GLN 273 N -2.29 1.63 0.00 -0.78 1.13 0.10 -4.87 117.38 112.31 3fxs n GLN 273 Ca -0.02 -0.01 0.00 0.00 -1.94 0.00 0.00 57.00 55.02 3fxs n GLN 273 Cb 0.55 -0.92 0.00 0.00 0.11 0.00 0.00 30.24 29.97 3fxs n GLN 273 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 3fxs n TYR 274 N -1.43 0.00 -2.27 1.08 4.01 -0.73 -5.04 117.16 112.78 3fxs n TYR 274 Ca -0.00 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.39 3fxs n TYR 274 Cb 0.04 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.07 3fxs n TYR 274 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3fxs s LEU 275 N -3.14 3.73 0.41 7.72 1.43 -0.13 -5.00 118.68 123.70 3fxs s LEU 275 Ca 0.00 2.12 0.04 0.00 -1.03 0.00 0.00 54.13 55.26 3fxs s LEU 275 Cb 0.00 -4.57 -0.05 0.00 0.03 0.00 0.00 46.19 41.60 3fxs s LEU 275 CO 0.00 -1.18 0.04 0.42 0.23 0.00 0.00 176.35 175.87 3fxs s THR 276 N -1.86 1.32 0.51 5.49 -4.23 -1.26 -4.51 115.64 111.10 3fxs s THR 276 Ca 0.71 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 59.44 3fxs s THR 276 Cb -0.22 -2.64 0.36 0.00 1.34 0.00 0.00 72.50 71.34 3fxs s THR 276 CO 0.27 0.00 2.02 -0.65 -0.54 0.00 0.00 174.62 175.72 3fxs h PRO 277 N 1.78 0.08 -0.44 3.99 0.11 -1.59 -2.76 132.00 133.17 3fxs h PRO 277 Ca -0.42 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3fxs h PRO 277 Cb 1.26 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3fxs h PRO 277 CO 0.72 0.05 0.00 0.25 -0.21 0.00 0.00 178.00 178.81 3fxs n THR 278 N -4.43 1.97 -1.67 -1.15 -2.24 -1.26 -1.10 114.28 104.40 3fxs n THR 278 Ca 0.08 -1.44 -0.45 0.00 -2.27 0.00 0.00 64.05 59.97 3fxs n THR 278 Cb 0.47 0.01 -0.03 0.00 -2.10 0.00 0.00 70.33 68.68 3fxs n THR 278 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3fxs n SER 279 N 0.34 2.91 -4.61 3.42 7.64 -1.04 -4.79 113.62 117.49 3fxs n SER 279 Ca 0.22 1.12 -0.19 0.00 1.01 0.00 0.00 58.87 61.03 3fxs n SER 279 Cb 0.84 -1.43 0.05 0.00 -1.01 0.00 0.00 64.21 62.66 3fxs n SER 279 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 3fxs n ASN 280 N 2.61 2.05 -0.31 6.43 0.23 -1.26 -3.16 115.26 121.86 3fxs n ASN 280 Ca 0.13 -2.45 -0.05 0.00 -0.53 0.00 0.00 54.58 51.69 3fxs n ASN 280 Cb 0.31 -0.30 0.07 0.00 -2.08 0.00 0.00 39.78 37.78 3fxs n ASN 280 CO 0.00 0.00 0.00 -0.26 -0.93 0.00 0.00 177.26 176.07 3fxs h PHE 281 N 0.23 1.14 -0.61 -2.53 -1.00 -1.95 0.13 116.94 112.34 3fxs h PHE 281 Ca -0.26 -0.03 -0.04 0.00 2.81 0.00 0.00 57.97 60.45 3fxs h PHE 281 Cb 1.12 -0.36 -0.03 0.00 3.61 0.00 0.00 35.95 40.29 3fxs h PHE 281 CO 0.00 0.80 0.23 1.03 -1.61 0.00 0.00 178.31 178.75 3fxs h SER 282 N 1.16 0.83 0.12 2.17 0.87 -1.94 -0.71 113.55 116.05 3fxs h SER 282 Ca 0.29 -0.12 -0.10 0.00 -1.23 0.00 0.00 61.79 60.63 3fxs h SER 282 Cb 0.03 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.77 3fxs h SER 282 CO -0.05 0.76 -0.36 1.56 -0.53 0.00 0.00 176.83 178.21 3fxs h GLN 283 N 0.89 0.33 -0.69 2.24 4.20 -1.71 -2.24 115.11 118.13 3fxs h GLN 283 Ca 0.21 -0.15 -0.04 0.00 0.06 0.00 0.00 58.65 58.73 3fxs h GLN 283 Cb 0.20 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.94 3fxs h GLN 283 CO -0.02 0.65 0.26 1.25 -0.67 0.00 0.00 178.83 180.31 3fxs h LEU 284 N 0.29 0.96 -0.62 1.46 5.85 -0.34 -0.63 115.31 122.28 3fxs h LEU 284 Ca 0.03 -0.18 0.07 0.00 0.84 0.00 0.00 57.88 58.65 3fxs h LEU 284 Cb 0.77 -0.25 -0.06 0.00 0.37 0.00 0.00 40.66 41.49 3fxs h LEU 284 CO 0.06 0.88 0.29 -0.09 -0.34 0.00 0.00 178.44 179.24 3fxs h ARG 285 N 0.99 0.52 -0.55 1.25 2.43 -0.71 -0.00 114.38 118.30 3fxs h ARG 285 Ca 0.23 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.31 3fxs h ARG 285 Cb 0.23 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.64 3fxs h ARG 285 CO -0.02 0.34 0.13 0.00 -1.51 0.00 0.00 179.97 178.91 3fxs h ALA 286 N 1.37 0.73 -0.72 2.80 0.00 -1.20 -0.26 119.26 121.97 3fxs h ALA 286 Ca 0.29 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3fxs h ALA 286 Cb 0.27 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3fxs h ALA 286 CO -0.23 0.44 0.41 0.00 0.00 0.00 0.00 179.25 179.87 3fxs h ALA 287 N 1.01 0.93 -0.54 0.00 0.00 -0.60 0.60 119.26 120.67 3fxs h ALA 287 Ca 0.17 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 3fxs h ALA 287 Cb 0.35 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3fxs h ALA 287 CO 0.00 0.42 0.01 0.00 0.00 0.00 0.00 179.25 179.69 3fxs h ALA 288 N 1.21 0.72 -0.54 0.00 0.00 -0.78 -0.07 119.26 119.81 3fxs h ALA 288 Ca 0.26 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 3fxs h ALA 288 Cb 0.01 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3fxs h ALA 288 CO -0.04 0.54 0.23 0.28 0.00 0.00 0.00 179.25 180.25 3fxs h VAL 289 N 0.82 1.21 -0.17 0.00 2.07 -0.83 -0.93 116.25 118.42 3fxs h VAL 289 Ca 0.15 -0.65 -0.10 0.00 0.82 0.00 0.00 66.70 66.92 3fxs h VAL 289 Cb 0.52 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 3fxs h VAL 289 CO 0.03 0.25 -0.33 -0.61 0.02 0.00 0.00 177.57 176.93 3fxs h GLN 290 N 0.73 0.35 -0.54 1.57 5.75 -0.67 0.12 115.11 122.42 3fxs h GLN 290 Ca 0.18 -0.14 -0.11 0.00 -0.15 0.00 0.00 58.65 58.43 3fxs h GLN 290 Cb 0.18 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.70 3fxs h GLN 290 CO -0.02 0.64 -0.09 0.77 -2.65 0.00 0.00 178.83 177.49 3fxs h SER 291 N 0.30 0.99 0.00 -0.69 0.02 -0.68 0.52 113.55 114.02 3fxs h SER 291 Ca 0.04 -0.31 -0.13 0.00 -0.84 0.00 0.00 61.79 60.54 3fxs h SER 291 Cb 0.73 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 3fxs h SER 291 CO 0.06 1.09 -0.43 0.00 -1.14 0.00 0.00 176.83 176.41 3fxs h ALA 292 N 1.00 0.86 0.16 3.77 0.00 -0.81 -1.31 119.26 122.92 3fxs h ALA 292 Ca 0.14 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 3fxs h ALA 292 Cb 0.64 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3fxs h ALA 292 CO 0.04 0.65 -0.07 1.15 0.00 0.00 0.00 179.25 181.02 3fxs h THR 293 N 0.43 0.88 -0.57 0.00 2.02 -0.27 0.87 112.91 116.27 3fxs h THR 293 Ca 0.03 -0.13 0.11 0.00 0.77 0.00 0.00 66.41 67.19 3fxs h THR 293 Cb 0.92 0.96 -0.09 0.00 -1.74 0.00 0.00 68.15 68.21 3fxs h THR 293 CO 0.08 0.03 0.08 0.44 0.37 0.00 0.00 175.52 176.52 3fxs h ASP 294 N -0.27 -0.08 0.56 4.18 3.32 -0.72 -0.10 116.42 123.32 3fxs h ASP 294 Ca -0.02 0.12 -0.26 0.00 0.02 0.00 0.00 57.03 56.88 3fxs h ASP 294 Cb 0.21 0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.94 3fxs h ASP 294 CO 0.04 -0.02 -1.18 -0.07 -1.72 0.00 0.00 179.24 176.29 3fxs h LEU 295 N 0.21 0.45 -0.01 1.55 3.38 -1.01 -3.40 115.31 116.48 3fxs h LEU 295 Ca 0.29 -0.45 0.00 0.00 0.09 0.00 0.00 57.88 57.81 3fxs h LEU 295 Cb 0.44 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.05 3fxs h LEU 295 CO -0.41 1.33 0.00 -1.22 0.09 0.00 0.00 178.44 178.23 3fxs n TYR 296 N -3.59 0.00 0.00 1.13 4.01 0.28 -5.09 117.16 113.90 3fxs n TYR 296 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 3fxs n TYR 296 Cb 0.98 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.01 3fxs n TYR 296 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3fxs n GLY 297 N 0.55 2.02 0.26 2.72 0.00 -0.06 -4.41 105.19 106.27 3fxs n GLY 297 Ca 0.00 -1.70 0.05 0.00 0.00 0.00 0.00 46.02 44.37 3fxs n GLY 297 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3fxs h SER 298 N 0.00 0.15 -0.52 1.61 0.87 -1.88 -1.00 113.55 112.77 3fxs h SER 298 Ca 0.00 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 3fxs h SER 298 Cb 0.00 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 61.92 3fxs h SER 298 CO 0.00 0.20 0.00 0.35 -0.53 0.00 0.00 176.83 176.85 3fxs n THR 299 N -4.41 1.37 -1.42 2.23 -2.24 -1.26 -4.85 114.28 103.69 3fxs n THR 299 Ca -0.01 -0.91 -0.30 0.00 -2.27 0.00 0.00 64.05 60.56 3fxs n THR 299 Cb 0.16 0.08 0.09 0.00 -2.10 0.00 0.00 70.33 68.56 3fxs n THR 299 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3fxs s SER 300 N -0.83 4.51 0.38 3.42 1.04 -0.38 -4.93 113.70 116.91 3fxs s SER 300 Ca 0.40 1.54 0.07 0.00 0.48 0.00 0.00 55.95 58.44 3fxs s SER 300 Cb 0.25 -2.29 0.76 0.00 0.10 0.00 0.00 66.02 64.84 3fxs s SER 300 CO 0.20 -1.99 1.96 -0.61 0.98 0.00 0.00 173.24 173.79 3fxs h GLN 301 N -1.10 0.47 -0.16 4.02 5.75 -1.91 -2.68 115.11 119.49 3fxs h GLN 301 Ca -0.46 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 57.98 3fxs h GLN 301 Cb 1.25 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 29.70 3fxs h GLN 301 CO 0.56 0.43 0.10 0.93 -2.65 0.00 0.00 178.83 178.20 3fxs h GLU 302 N 0.46 0.20 -0.51 1.69 3.07 -1.91 0.39 114.58 117.98 3fxs h GLU 302 Ca 0.11 -0.01 -0.06 0.00 -0.50 0.00 0.00 59.36 58.90 3fxs h GLU 302 Cb 0.17 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.01 3fxs h GLU 302 CO -0.01 0.13 0.09 0.28 -1.40 0.00 0.00 179.01 178.11 3fxs h VAL 303 N 0.21 1.25 -0.52 3.13 2.07 -1.81 -1.64 116.25 118.93 3fxs h VAL 303 Ca 0.06 -0.91 -0.05 0.00 0.82 0.00 0.00 66.70 66.62 3fxs h VAL 303 Cb -0.02 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 3fxs h VAL 303 CO -0.02 0.33 0.11 0.00 0.02 0.00 0.00 177.57 178.01 3fxs h ALA 304 N 0.98 1.21 -0.33 1.67 0.00 -1.08 -2.08 119.26 119.63 3fxs h ALA 304 Ca 0.16 -0.21 -0.14 0.00 0.00 0.00 0.00 54.91 54.72 3fxs h ALA 304 Cb 0.38 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3fxs h ALA 304 CO 0.01 0.54 -0.35 0.77 0.00 0.00 0.00 179.25 180.21 3fxs h SER 305 N 0.77 0.79 -0.81 0.00 0.02 0.04 -0.98 113.55 113.38 3fxs h SER 305 Ca 0.17 -0.34 0.02 0.00 -0.84 0.00 0.00 61.79 60.81 3fxs h SER 305 Cb 0.31 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 62.59 3fxs h SER 305 CO 0.00 1.06 0.52 0.58 -1.14 0.00 0.00 176.83 177.86 3fxs h VAL 306 N 0.62 1.16 -0.22 2.27 2.07 -1.01 0.23 116.25 121.37 3fxs h VAL 306 Ca 0.06 -0.36 -0.04 0.00 0.82 0.00 0.00 66.70 67.19 3fxs h VAL 306 Cb 0.89 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 3fxs h VAL 306 CO 0.08 0.19 -0.02 0.11 0.02 0.00 0.00 177.57 177.95 3fxs h LYS 307 N 1.04 0.39 -0.84 1.57 1.57 -1.06 -2.10 116.57 117.14 3fxs h LYS 307 Ca 0.31 -0.13 0.16 0.00 -1.87 0.00 0.00 60.65 59.12 3fxs h LYS 307 Cb -0.04 -0.03 -0.10 0.00 0.08 0.00 0.00 32.23 32.14 3fxs h LYS 307 CO -0.09 0.60 0.41 1.96 -0.57 0.00 0.00 179.45 181.75 3fxs h GLN 308 N 0.14 0.54 -0.36 3.15 4.20 -0.91 -0.28 115.11 121.60 3fxs h GLN 308 Ca 0.06 -0.03 -0.08 0.00 0.06 0.00 0.00 58.65 58.65 3fxs h GLN 308 Cb 0.43 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 3fxs h GLN 308 CO 0.01 0.36 -0.10 0.00 -0.67 0.00 0.00 178.83 178.43 3fxs h ALA 309 N 1.58 0.50 -0.33 3.87 0.00 -0.48 0.65 119.26 125.05 3fxs h ALA 309 Ca 0.47 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 3fxs h ALA 309 Cb 0.72 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 3fxs h ALA 309 CO -0.40 0.36 -0.29 0.74 0.00 0.00 0.00 179.25 179.67 3fxs h PHE 310 N 0.50 0.78 -0.58 0.00 0.04 -1.12 -2.54 116.94 114.03 3fxs h PHE 310 Ca 0.09 -0.19 0.03 0.00 2.80 0.00 0.00 57.97 60.70 3fxs h PHE 310 Cb 0.61 -0.18 -0.04 0.00 2.20 0.00 0.00 35.95 38.54 3fxs h PHE 310 CO 0.05 0.89 0.34 -0.44 -0.60 0.00 0.00 178.31 178.55 3fxs h ASP 311 N 0.58 0.55 -0.25 2.17 3.32 -0.71 0.04 116.42 122.12 3fxs h ASP 311 Ca 0.07 0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.17 3fxs h ASP 311 Cb 0.79 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.22 3fxs h ASP 311 CO 0.06 0.38 0.17 0.00 -1.72 0.00 0.00 179.24 178.13 3fxs h ALA 312 N 1.27 2.00 -0.68 3.45 0.00 -0.51 -0.72 119.26 124.07 3fxs h ALA 312 Ca 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3fxs h ALA 312 Cb 0.05 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3fxs h ALA 312 CO -0.11 -0.05 0.00 1.33 0.00 0.00 0.00 179.25 180.42 3fxs n VAL 313 N -4.49 1.42 -0.94 0.00 0.24 -0.99 -4.77 118.33 108.81 3fxs n VAL 313 Ca 0.02 -1.07 0.00 0.00 -2.04 0.00 0.00 64.34 61.25 3fxs n VAL 313 Cb 0.19 0.28 0.00 0.00 -1.47 0.00 0.00 33.84 32.84 3fxs n VAL 313 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3fxs n GLY 314 N 1.37 0.43 3.42 7.63 0.00 -0.28 -0.62 105.19 117.14 3fxs n GLY 314 Ca 0.25 -0.93 -0.38 0.00 0.00 0.00 0.00 46.02 44.96 3fxs n GLY 314 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fxs s VAL 315 N -2.00 4.39 -1.55 1.61 1.01 -0.06 -4.63 120.40 119.17 3fxs s VAL 315 Ca 0.00 -0.42 0.12 0.00 0.00 0.00 0.00 61.98 61.69 3fxs s VAL 315 Cb 0.00 -3.20 0.10 0.00 0.00 0.00 0.00 36.38 33.28 3fxs s VAL 315 CO 0.00 0.14 0.89 2.29 0.00 0.00 0.00 175.10 178.42