#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3duz s HIS 23 N 0.00 0.12 0.05 4.31 2.46 -1.26 -5.16 115.29 115.82 3duz s HIS 23 Ca 0.00 -0.44 0.06 0.00 0.47 0.00 0.00 55.06 55.15 3duz s HIS 23 Cb 0.00 -0.71 -0.03 0.00 -0.13 0.00 0.00 32.58 31.72 3duz s HIS 23 CO 0.00 -0.68 -0.17 0.00 -2.47 0.00 0.00 174.74 171.42 3duz s ASN 25 N -1.35 5.69 0.31 0.00 3.84 -1.26 -4.86 114.94 117.30 3duz s ASN 25 Ca 0.04 1.30 0.15 0.00 0.21 0.00 0.00 52.86 54.55 3duz s ASN 25 Cb -0.09 -2.52 0.40 0.00 -0.55 0.00 0.00 41.25 38.49 3duz s ASN 25 CO 0.02 -1.87 1.61 0.00 -2.79 0.00 0.00 177.10 174.07 3duz h ALA 26 N 13.74 0.86 0.00 1.71 0.00 -2.03 -3.24 119.26 130.30 3duz h ALA 26 Ca -0.34 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.10 3duz h ALA 26 Cb 1.18 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3duz h ALA 26 CO 1.04 0.65 0.00 0.94 0.00 0.00 0.00 179.25 181.88 3duz n GLN 27 N -3.51 0.71 -0.88 0.00 7.27 -1.26 -3.24 117.38 116.46 3duz n GLN 27 Ca -0.00 0.00 0.04 0.00 0.07 0.00 0.00 57.00 57.11 3duz n GLN 27 Cb 0.62 -1.03 0.07 0.00 2.41 0.00 0.00 30.24 32.30 3duz n GLN 27 CO 0.00 0.00 0.00 -1.33 0.07 0.00 0.00 177.06 175.80 3duz n MET 28 N -0.44 0.48 -1.63 3.69 2.81 -1.22 -5.07 117.12 115.74 3duz n MET 28 Ca 0.00 -2.08 -0.46 0.00 -1.81 0.00 0.00 57.70 53.35 3duz n MET 28 Cb 0.02 -0.65 -0.04 0.00 -0.71 0.00 0.00 33.22 31.84 3duz n MET 28 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3duz n LYS 29 N -0.20 2.17 -4.14 0.03 5.02 -1.20 -4.98 118.16 114.86 3duz n LYS 29 Ca 0.08 0.74 -0.35 0.00 -2.02 0.00 0.00 58.31 56.76 3duz n LYS 29 Cb 0.88 -2.85 -0.09 0.00 -0.02 0.00 0.00 35.03 32.95 3duz n LYS 29 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3duz s THR 30 N 5.55 4.73 -3.68 -0.18 -1.32 -1.26 -5.06 115.64 114.42 3duz s THR 30 Ca 0.96 -0.08 0.00 0.00 -1.21 0.00 0.00 61.69 61.36 3duz s THR 30 Cb -0.57 -3.06 0.00 0.00 -1.51 0.00 0.00 72.50 67.37 3duz s THR 30 CO 0.45 0.56 0.00 0.61 -2.21 0.00 0.00 174.62 174.04 3duz n GLY 31 N 2.56 -0.59 3.78 6.08 0.00 -1.26 -4.73 105.19 111.04 3duz n GLY 31 Ca -0.18 -0.99 -0.36 0.00 0.00 0.00 0.00 46.02 44.48 3duz n GLY 31 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3duz s PRO 32 N -1.47 4.23 0.29 1.61 0.02 -1.26 -5.17 135.00 133.25 3duz s PRO 32 Ca 0.00 1.47 0.09 0.00 0.02 0.00 0.00 61.00 62.58 3duz s PRO 32 Cb 0.00 -2.56 -0.04 0.00 0.02 0.00 0.00 34.50 31.91 3duz s PRO 32 CO 0.00 -0.08 0.03 0.71 -0.33 0.00 0.00 177.00 177.33 3duz s TYR 33 N -1.68 2.67 -0.21 6.54 2.02 -1.26 -5.14 117.35 120.29 3duz s TYR 33 Ca 0.57 -0.29 -0.19 0.00 -0.37 0.00 0.00 57.07 56.79 3duz s TYR 33 Cb -0.21 -1.33 0.06 0.00 -0.40 0.00 0.00 41.96 40.08 3duz s TYR 33 CO 0.26 0.54 0.57 0.21 -1.57 0.00 0.00 175.55 175.56 3duz s LYS 34 N -3.71 0.66 0.00 -0.62 2.20 -1.26 -5.14 119.74 111.87 3duz s LYS 34 Ca 0.33 0.80 -0.30 0.00 -0.36 0.00 0.00 55.97 56.44 3duz s LYS 34 Cb -0.05 0.31 -0.05 0.00 -1.51 0.00 0.00 37.83 36.54 3duz s LYS 34 CO 0.20 -0.08 1.24 0.42 -0.36 0.00 0.00 175.35 176.77 3duz s ILE 35 N 0.35 4.06 -0.33 5.43 1.01 -1.26 -4.95 121.20 125.53 3duz s ILE 35 Ca -0.00 1.44 -0.29 0.00 0.00 0.00 0.00 60.65 61.80 3duz s ILE 35 Cb -0.04 -3.92 -0.01 0.00 0.01 0.00 0.00 42.46 38.50 3duz s ILE 35 CO 0.00 0.04 1.50 -0.75 0.00 0.00 0.00 174.94 175.74 3duz s LYS 36 N 1.79 3.66 0.59 2.79 2.20 -1.26 -5.00 119.74 124.51 3duz s LYS 36 Ca 0.58 1.26 -0.16 0.00 -0.36 0.00 0.00 55.97 57.30 3duz s LYS 36 Cb -0.28 -4.03 -0.04 0.00 -1.51 0.00 0.00 37.83 31.98 3duz s LYS 36 CO 0.26 -1.45 1.07 -0.80 -0.36 0.00 0.00 175.35 174.06 3duz s ASN 37 N 4.12 5.75 0.13 1.43 -0.87 -1.26 -5.02 114.94 119.22 3duz s ASN 37 Ca 0.66 1.87 -0.23 0.00 -1.57 0.00 0.00 52.86 53.58 3duz s ASN 37 Cb -0.19 -2.54 -0.07 0.00 -0.02 0.00 0.00 41.25 38.43 3duz s ASN 37 CO 0.30 -1.19 0.70 -0.76 -2.57 0.00 0.00 177.10 173.57 3duz s LEU 38 N -4.42 4.57 0.03 0.60 1.02 -1.26 -5.01 118.68 114.21 3duz s LEU 38 Ca 0.65 1.50 -0.32 0.00 0.02 0.00 0.00 54.13 55.98 3duz s LEU 38 Cb -0.17 -3.14 -0.11 0.00 0.02 0.00 0.00 46.19 42.79 3duz s LEU 38 CO 0.35 0.23 1.88 0.47 0.02 0.00 0.00 176.35 179.31 3duz n ASP 39 N 1.66 3.83 -4.36 2.29 9.92 -1.26 -4.97 116.55 123.66 3duz n ASP 39 Ca -0.07 0.96 -0.45 0.00 -0.53 0.00 0.00 54.79 54.70 3duz n ASP 39 Cb 0.49 -1.48 -0.06 0.00 -0.64 0.00 0.00 41.12 39.44 3duz n ASP 39 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 3duz s ILE 40 N 3.61 5.18 -0.18 0.53 1.01 -1.26 -5.05 121.20 125.03 3duz s ILE 40 Ca 0.88 -1.18 -0.26 0.00 0.00 0.00 0.00 60.65 60.09 3duz s ILE 40 Cb -0.55 -4.24 -0.01 0.00 0.01 0.00 0.00 42.46 37.67 3duz s ILE 40 CO 0.44 -0.73 0.86 -0.89 0.00 0.00 0.00 174.94 174.61 3duz s THR 41 N 1.76 4.85 0.20 2.92 2.01 -1.26 -5.02 115.64 121.10 3duz s THR 41 Ca 0.05 1.67 -0.32 0.00 0.31 0.00 0.00 61.69 63.40 3duz s THR 41 Cb -0.26 -4.15 -0.12 0.00 0.01 0.00 0.00 72.50 67.97 3duz s THR 41 CO 0.06 -0.01 1.70 -2.65 -0.69 0.00 0.00 174.62 173.03 3duz n PRO 42 N 5.43 2.66 -2.00 4.92 -0.02 -1.26 -4.88 135.00 139.85 3duz n PRO 42 Ca 0.05 0.96 -0.42 0.00 -2.02 0.00 0.00 63.50 62.08 3duz n PRO 42 Cb 0.48 -2.80 -0.03 0.00 -0.02 0.00 0.00 33.50 31.14 3duz n PRO 42 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3duz s PRO 43 N 1.18 4.26 0.28 0.52 0.04 -1.26 -4.91 135.00 135.10 3duz s PRO 43 Ca 0.76 2.30 0.18 0.00 0.04 0.00 0.00 61.00 64.28 3duz s PRO 43 Cb -0.54 -3.14 0.10 0.00 0.04 0.00 0.00 34.50 30.96 3duz s PRO 43 CO 0.33 -0.48 1.36 0.87 0.04 0.00 0.00 177.00 179.12 3duz h LYS 44 N 5.82 0.00 -4.75 4.56 1.57 -1.91 -3.42 116.57 118.44 3duz h LYS 44 Ca -0.44 0.00 -0.67 0.00 -1.87 0.00 0.00 60.65 57.67 3duz h LYS 44 Cb 1.21 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.34 3duz h LYS 44 CO 0.83 0.29 -0.49 -1.21 -0.57 0.00 0.00 179.45 178.31 3duz s GLU 45 N -3.06 3.57 -0.07 3.15 8.01 -1.26 -2.31 118.70 126.73 3duz s GLU 45 Ca 0.03 -0.59 0.02 0.00 0.01 0.00 0.00 54.97 54.44 3duz s GLU 45 Cb 0.07 -3.78 -0.03 0.00 -4.31 0.00 0.00 34.13 26.09 3duz s GLU 45 CO 0.74 -0.40 -0.09 0.99 0.01 0.00 0.00 175.26 176.51 3duz s THR 46 N 1.73 3.49 -0.23 3.63 2.01 0.08 -4.93 115.64 121.41 3duz s THR 46 Ca 0.06 -0.56 -0.15 0.00 0.31 0.00 0.00 61.69 61.36 3duz s THR 46 Cb -0.17 -2.41 -0.04 0.00 0.01 0.00 0.00 72.50 69.89 3duz s THR 46 CO 0.11 0.59 0.34 -0.22 -0.69 0.00 0.00 174.62 174.75 3duz s LEU 47 N -0.71 4.11 -0.16 4.42 2.96 -1.26 0.18 118.68 128.21 3duz s LEU 47 Ca 0.11 0.37 -0.00 0.00 -0.22 0.00 0.00 54.13 54.39 3duz s LEU 47 Cb -0.11 -2.41 -0.00 0.00 0.50 0.00 0.00 46.19 44.17 3duz s LEU 47 CO 0.01 -0.08 -0.14 -1.58 -1.32 0.00 0.00 176.35 173.24 3duz s GLN 48 N 1.48 3.23 0.31 1.98 0.74 -0.17 -5.00 119.66 122.23 3duz s GLN 48 Ca 0.16 -0.74 -0.03 0.00 0.05 0.00 0.00 55.36 54.80 3duz s GLN 48 Cb -0.15 -2.67 -0.04 0.00 1.10 0.00 0.00 33.01 31.25 3duz s GLN 48 CO 0.08 -0.02 0.54 0.15 -0.55 0.00 0.00 175.29 175.49 3duz s LYS 49 N 0.92 3.56 -1.35 1.67 1.02 -1.26 -0.90 119.74 123.41 3duz s LYS 49 Ca -0.03 -0.15 -0.07 0.00 0.02 0.00 0.00 55.97 55.74 3duz s LYS 49 Cb -0.15 -2.66 0.02 0.00 -0.52 0.00 0.00 37.83 34.51 3duz s LYS 49 CO -0.02 0.19 1.11 -0.25 -0.92 0.00 0.00 175.35 175.47 3duz n ASP 50 N -1.26 -5.18 -4.68 2.83 8.00 -1.17 -4.94 116.55 110.15 3duz n ASP 50 Ca -0.03 -0.59 -0.43 0.00 0.71 0.00 0.00 54.79 54.45 3duz n ASP 50 Cb 0.55 -4.90 -0.02 0.00 -0.02 0.00 0.00 41.12 36.73 3duz n ASP 50 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3duz s VAL 51 N -3.34 4.63 0.00 2.53 1.01 0.63 -4.64 120.40 121.22 3duz s VAL 51 Ca 0.46 1.93 -0.30 0.00 0.00 0.00 0.00 61.98 64.06 3duz s VAL 51 Cb -0.21 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 31.90 3duz s VAL 51 CO 0.74 -0.04 1.11 -1.61 0.00 0.00 0.00 175.10 175.30 3duz s GLU 52 N 2.36 4.46 -0.01 2.72 2.02 -1.26 -0.31 118.70 128.68 3duz s GLU 52 Ca 0.49 1.60 0.01 0.00 0.02 0.00 0.00 54.97 57.09 3duz s GLU 52 Cb -0.19 -3.44 0.00 0.00 0.10 0.00 0.00 34.13 30.60 3duz s GLU 52 CO 0.16 -0.23 -0.03 0.42 0.02 0.00 0.00 175.26 175.60 3duz s ILE 53 N 1.36 0.24 -0.21 -1.63 1.01 0.19 -1.62 121.20 120.54 3duz s ILE 53 Ca 0.55 -0.12 -0.05 0.00 0.00 0.00 0.00 60.65 61.03 3duz s ILE 53 Cb -0.25 -0.22 -0.02 0.00 0.01 0.00 0.00 42.46 41.98 3duz s ILE 53 CO 0.26 0.08 0.01 -0.89 0.00 0.00 0.00 174.94 174.40 3duz s THR 54 N 0.03 3.99 -0.16 2.92 2.01 -0.00 -0.98 115.64 123.45 3duz s THR 54 Ca 0.00 -0.30 -0.04 0.00 0.31 0.00 0.00 61.69 61.66 3duz s THR 54 Cb -0.02 -2.81 -0.03 0.00 0.01 0.00 0.00 72.50 69.64 3duz s THR 54 CO -0.00 0.42 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.70 3duz s ILE 55 N 1.09 4.07 -0.10 1.82 1.01 0.42 -1.86 121.20 127.65 3duz s ILE 55 Ca 0.03 -0.30 0.04 0.00 0.00 0.00 0.00 60.65 60.42 3duz s ILE 55 Cb -0.14 -2.79 0.00 0.00 0.01 0.00 0.00 42.46 39.54 3duz s ILE 55 CO 0.02 0.49 -0.23 -0.69 0.00 0.00 0.00 174.94 174.53 3duz s VAL 56 N 0.30 1.99 -0.02 2.92 1.01 0.68 -0.45 120.40 126.84 3duz s VAL 56 Ca -0.02 -0.98 -0.02 0.00 0.00 0.00 0.00 61.98 60.96 3duz s VAL 56 Cb -0.14 -1.73 0.00 0.00 0.00 0.00 0.00 36.38 34.52 3duz s VAL 56 CO 0.02 0.54 0.06 -0.70 0.00 0.00 0.00 175.10 175.03 3duz s GLU 57 N 0.39 0.15 0.49 2.72 2.12 0.02 0.20 118.70 124.79 3duz s GLU 57 Ca -0.18 -0.07 0.04 0.00 0.36 0.00 0.00 54.97 55.12 3duz s GLU 57 Cb -0.18 0.07 -0.02 0.00 0.26 0.00 0.00 34.13 34.26 3duz s GLU 57 CO 0.08 -0.03 0.08 -0.08 -0.54 0.00 0.00 175.26 174.77 3duz s THR 58 N -0.34 1.51 0.43 -1.70 -1.32 -0.59 -1.21 115.64 112.43 3duz s THR 58 Ca -0.04 -1.90 -0.26 0.00 -1.21 0.00 0.00 61.69 58.28 3duz s THR 58 Cb -0.03 -2.41 -0.09 0.00 -1.51 0.00 0.00 72.50 68.46 3duz s THR 58 CO 0.00 0.00 1.44 0.47 -2.21 0.00 0.00 174.62 174.32 3duz n ASP 59 N -1.27 3.42 -0.18 8.08 8.00 -1.26 -4.88 116.55 128.46 3duz n ASP 59 Ca -0.12 1.15 -0.01 0.00 0.71 0.00 0.00 54.79 56.52 3duz n ASP 59 Cb 0.66 -1.60 0.09 0.00 -0.02 0.00 0.00 41.12 40.25 3duz n ASP 59 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 3duz h TYR 60 N 2.46 0.26 -3.46 1.24 0.05 -1.94 -3.41 116.97 112.17 3duz h TYR 60 Ca -0.51 0.03 -0.32 0.00 0.05 0.00 0.00 58.73 57.99 3duz h TYR 60 Cb 1.26 -0.03 -0.15 0.00 1.01 0.00 0.00 36.73 38.82 3duz h TYR 60 CO 0.50 0.03 -0.70 0.54 -1.05 0.00 0.00 178.16 177.49 3duz s ASN 61 N -5.34 1.67 0.11 3.88 2.20 -1.26 -1.00 114.94 115.19 3duz s ASN 61 Ca -0.13 -1.05 0.10 0.00 -0.94 0.00 0.00 52.86 50.85 3duz s ASN 61 Cb 0.16 0.02 -0.04 0.00 -2.00 0.00 0.00 41.25 39.39 3duz s ASN 61 CO 0.74 -0.39 -0.27 -1.61 -2.94 0.00 0.00 177.10 172.63 3duz s GLU 62 N -3.78 1.52 -0.25 3.55 0.41 0.78 -4.85 118.70 116.08 3duz s GLU 62 Ca 0.18 -1.28 -0.29 0.00 -0.41 0.00 0.00 54.97 53.17 3duz s GLU 62 Cb 0.03 -1.93 0.01 0.00 -1.78 0.00 0.00 34.13 30.46 3duz s GLU 62 CO 0.01 0.47 1.13 -0.80 -0.49 0.00 0.00 175.26 175.58 3duz s ASN 63 N -1.84 6.97 -0.20 -0.19 -0.87 -1.26 -1.28 114.94 116.27 3duz s ASN 63 Ca 0.13 1.34 -0.00 0.00 -1.57 0.00 0.00 52.86 52.77 3duz s ASN 63 Cb -0.10 -2.54 0.01 0.00 -0.02 0.00 0.00 41.25 38.60 3duz s ASN 63 CO 0.05 -0.80 -0.15 -0.69 -2.57 0.00 0.00 177.10 172.94 3duz s VAL 64 N 3.54 2.42 -0.21 1.60 1.01 0.20 -3.04 120.40 125.92 3duz s VAL 64 Ca 0.48 -0.86 -0.29 0.00 0.00 0.00 0.00 61.98 61.31 3duz s VAL 64 Cb -0.16 -2.07 -0.01 0.00 0.00 0.00 0.00 36.38 34.14 3duz s VAL 64 CO 0.13 0.47 1.29 -0.63 0.00 0.00 0.00 175.10 176.36 3duz s ILE 65 N 1.33 4.20 -0.18 2.22 1.01 -0.76 -0.34 121.20 128.69 3duz s ILE 65 Ca 0.04 1.42 -0.00 0.00 0.00 0.00 0.00 60.65 62.11 3duz s ILE 65 Cb -0.14 -4.03 0.01 0.00 0.01 0.00 0.00 42.46 38.30 3duz s ILE 65 CO -0.10 -0.25 -0.15 -0.63 0.00 0.00 0.00 174.94 173.81 3duz s ILE 66 N 3.87 2.55 0.01 2.92 1.01 0.18 -2.24 121.20 129.50 3duz s ILE 66 Ca 0.56 -0.79 0.02 0.00 0.00 0.00 0.00 60.65 60.44 3duz s ILE 66 Cb -0.20 -2.09 -0.01 0.00 0.01 0.00 0.00 42.46 40.16 3duz s ILE 66 CO 0.18 0.51 -0.07 -0.83 0.00 0.00 0.00 174.94 174.73 3duz s GLY 67 N 1.14 0.35 0.08 6.18 0.00 -0.37 -0.96 107.32 113.74 3duz s GLY 67 Ca 0.01 -0.39 0.01 0.00 0.00 0.00 0.00 44.72 44.35 3duz s GLY 67 CO -0.06 -0.37 -0.06 -2.52 0.00 0.00 0.00 173.10 170.09 3duz s TYR 68 N -0.46 0.77 0.07 1.90 1.13 -0.82 -0.94 117.35 119.01 3duz s TYR 68 Ca -0.01 -0.92 -0.24 0.00 -1.41 0.00 0.00 57.07 54.49 3duz s TYR 68 Cb -0.04 -0.47 0.06 0.00 -1.10 0.00 0.00 41.96 40.41 3duz s TYR 68 CO -0.00 -0.21 0.58 0.21 -2.51 0.00 0.00 175.55 173.63 3duz s LYS 69 N -3.67 1.13 0.00 -3.49 2.20 -1.26 -2.36 119.74 112.30 3duz s LYS 69 Ca 0.09 -0.23 0.00 0.00 -0.36 0.00 0.00 55.97 55.47 3duz s LYS 69 Cb 0.05 0.52 0.00 0.00 -1.51 0.00 0.00 37.83 36.89 3duz s LYS 69 CO -0.06 -0.43 0.00 0.41 -0.36 0.00 0.00 175.35 174.91 3duz n GLY 70 N 0.20 0.99 3.05 5.54 0.00 -1.16 -1.41 105.19 112.40 3duz n GLY 70 Ca -0.18 -0.97 -0.08 0.00 0.00 0.00 0.00 46.02 44.79 3duz n GLY 70 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3duz s TYR 71 N -2.00 0.37 -0.15 1.61 1.13 -0.73 -0.29 117.35 117.29 3duz s TYR 71 Ca 0.00 -0.78 -0.01 0.00 -1.41 0.00 0.00 57.07 54.86 3duz s TYR 71 Cb 0.00 -0.28 -0.02 0.00 -1.10 0.00 0.00 41.96 40.57 3duz s TYR 71 CO 0.00 -0.31 -0.10 -0.47 -2.51 0.00 0.00 175.55 172.16 3duz s TYR 72 N -2.80 2.88 -0.03 -3.49 5.04 -0.25 -2.23 117.35 116.47 3duz s TYR 72 Ca -0.03 -0.65 0.06 0.00 -2.44 0.00 0.00 57.07 54.00 3duz s TYR 72 Cb -0.00 -1.91 -0.01 0.00 0.35 0.00 0.00 41.96 40.38 3duz s TYR 72 CO -0.06 -0.25 -0.21 -1.14 -1.34 0.00 0.00 175.55 172.55 3duz s GLN 73 N 0.57 1.96 -0.35 4.97 0.74 0.31 -1.43 119.66 126.43 3duz s GLN 73 Ca -0.06 -0.77 0.01 0.00 0.05 0.00 0.00 55.36 54.59 3duz s GLN 73 Cb -0.15 -1.78 0.11 0.00 1.10 0.00 0.00 33.01 32.29 3duz s GLN 73 CO 0.03 0.39 0.12 0.00 -0.55 0.00 0.00 175.29 175.28 3duz s ALA 74 N -0.29 2.02 -0.33 1.58 0.00 0.27 -1.27 121.76 123.75 3duz s ALA 74 Ca 0.02 -2.10 -0.14 0.00 0.00 0.00 0.00 51.96 49.75 3duz s ALA 74 Cb -0.10 -1.77 -0.02 0.00 0.00 0.00 0.00 23.12 21.23 3duz s ALA 74 CO 0.01 -1.76 0.30 -0.47 0.00 0.00 0.00 175.76 173.84 3duz s TYR 75 N 1.16 3.22 0.18 0.00 6.14 -0.51 -2.31 117.35 125.22 3duz s TYR 75 Ca 0.12 -0.07 0.08 0.00 0.64 0.00 0.00 57.07 57.84 3duz s TYR 75 Cb -0.19 -2.57 -0.04 0.00 0.42 0.00 0.00 41.96 39.58 3duz s TYR 75 CO -0.16 -0.38 -0.17 0.00 0.64 0.00 0.00 175.55 175.48 3duz s ALA 76 N 1.88 2.01 -0.03 3.97 0.00 0.28 -1.26 121.76 128.62 3duz s ALA 76 Ca 0.09 -1.53 0.01 0.00 0.00 0.00 0.00 51.96 50.53 3duz s ALA 76 Cb -0.17 -0.16 0.01 0.00 0.00 0.00 0.00 23.12 22.81 3duz s ALA 76 CO 0.11 0.19 -0.05 -0.47 0.00 0.00 0.00 175.76 175.54 3duz s TYR 77 N -2.28 0.65 -0.39 0.00 5.04 -0.86 0.19 117.35 119.70 3duz s TYR 77 Ca 0.17 -0.15 -0.05 0.00 -2.44 0.00 0.00 57.07 54.61 3duz s TYR 77 Cb -0.05 -0.54 0.09 0.00 0.35 0.00 0.00 41.96 41.81 3duz s TYR 77 CO 0.07 -0.12 0.18 1.21 -1.34 0.00 0.00 175.55 175.55 3duz s ASN 78 N 0.55 5.30 -0.18 4.32 2.47 -0.94 -2.59 114.94 123.87 3duz s ASN 78 Ca -0.07 -1.72 0.16 0.00 0.42 0.00 0.00 52.86 51.65 3duz s ASN 78 Cb -0.10 -1.85 0.48 0.00 -1.45 0.00 0.00 41.25 38.32 3duz s ASN 78 CO -0.00 -0.49 1.37 0.61 -3.72 0.00 0.00 177.10 174.87 3duz n GLY 79 N 4.70 4.32 0.20 1.21 0.00 -1.26 0.39 105.19 114.74 3duz n GLY 79 Ca -0.07 -1.09 0.03 0.00 0.00 0.00 0.00 46.02 44.89 3duz n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3duz n GLY 80 N -0.77 -1.65 0.30 -0.02 0.00 -1.26 -3.72 105.19 98.07 3duz n GLY 80 Ca 0.21 -1.47 0.19 0.00 0.00 0.00 0.00 46.02 44.95 3duz n GLY 80 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3duz h SER 81 N -0.19 0.00 -0.17 1.61 0.02 -1.99 -2.81 113.55 110.03 3duz h SER 81 Ca -0.00 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.80 3duz h SER 81 Cb 0.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.73 3duz h SER 81 CO 0.00 0.03 -0.47 -0.07 -1.14 0.00 0.00 176.83 175.18 3duz h LEU 82 N 0.00 0.71 -9.38 5.07 3.38 -2.02 -3.44 115.31 109.62 3duz h LEU 82 Ca -0.00 -0.58 -0.54 0.00 0.09 0.00 0.00 57.88 56.84 3duz h LEU 82 Cb 0.22 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 3duz h LEU 82 CO 0.00 1.16 0.77 -0.62 0.09 0.00 0.00 178.44 179.85 3duz s ASP 83 N -6.69 6.91 0.49 -0.43 -1.08 -1.06 -4.90 116.67 109.92 3duz s ASP 83 Ca -0.12 2.06 0.33 0.00 -0.52 0.00 0.00 52.55 54.30 3duz s ASP 83 Cb 0.07 -2.56 1.61 0.00 -1.46 0.00 0.00 42.92 40.58 3duz s ASP 83 CO 0.84 -0.66 2.00 -0.65 0.52 0.00 0.00 175.17 177.22 3duz h PRO 84 N 7.58 0.00 -0.00 4.34 0.11 -1.87 -2.93 132.00 139.23 3duz h PRO 84 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 3duz h PRO 84 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3duz h PRO 84 CO 0.89 0.00 -0.08 0.09 -0.21 0.00 0.00 178.00 178.69 3duz n ASN 85 N -2.77 0.34 -4.59 -2.05 3.02 -1.26 -4.70 115.26 103.25 3duz n ASN 85 Ca -0.01 -0.50 -0.42 0.00 -0.03 0.00 0.00 54.58 53.63 3duz n ASN 85 Cb 0.16 -0.12 -0.03 0.00 -0.61 0.00 0.00 39.78 39.19 3duz n ASN 85 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3duz s THR 86 N -2.47 3.67 0.17 3.41 2.01 -1.11 -4.52 115.64 116.81 3duz s THR 86 Ca 0.30 0.62 -0.22 0.00 0.31 0.00 0.00 61.69 62.70 3duz s THR 86 Cb 0.20 -4.07 0.06 0.00 0.01 0.00 0.00 72.50 68.70 3duz s THR 86 CO 0.47 -0.79 0.60 0.00 -0.69 0.00 0.00 174.62 174.21 3duz s ARG 87 N 5.60 1.33 -0.38 4.92 1.70 -1.07 -5.00 118.95 126.06 3duz s ARG 87 Ca 0.65 -0.56 0.02 0.00 -0.47 0.00 0.00 55.73 55.38 3duz s ARG 87 Cb -0.15 0.58 0.11 0.00 -0.57 0.00 0.00 34.95 34.93 3duz s ARG 87 CO 0.29 -0.59 0.14 0.08 -1.08 0.00 0.00 175.30 174.15 3duz s VAL 88 N -3.78 1.70 -0.22 4.99 1.01 -1.26 -2.04 120.40 120.81 3duz s VAL 88 Ca 0.03 -2.27 -0.29 0.00 0.00 0.00 0.00 61.98 59.44 3duz s VAL 88 Cb -0.01 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 34.13 3duz s VAL 88 CO -0.10 -0.73 1.16 -1.61 0.00 0.00 0.00 175.10 173.82 3duz s GLU 89 N 0.79 4.19 -0.09 2.72 2.02 -0.39 -4.92 118.70 123.02 3duz s GLU 89 Ca 0.13 1.44 0.01 0.00 0.02 0.00 0.00 54.97 56.57 3duz s GLU 89 Cb -0.21 -3.73 -0.03 0.00 0.10 0.00 0.00 34.13 30.27 3duz s GLU 89 CO -0.10 -0.74 -0.10 -1.21 0.02 0.00 0.00 175.26 173.13 3duz s GLU 90 N 3.47 2.93 0.01 1.61 2.02 -1.26 -1.42 118.70 126.05 3duz s GLU 90 Ca 0.50 -0.62 0.00 0.00 0.02 0.00 0.00 54.97 54.87 3duz s GLU 90 Cb -0.18 -2.58 -0.01 0.00 0.10 0.00 0.00 34.13 31.47 3duz s GLU 90 CO 0.12 0.50 -0.02 0.95 0.02 0.00 0.00 175.26 176.84 3duz s THR 91 N -0.39 0.08 -0.43 3.63 -4.23 -0.40 -5.01 115.64 108.89 3duz s THR 91 Ca 0.05 -0.38 0.03 0.00 -1.18 0.00 0.00 61.69 60.21 3duz s THR 91 Cb -0.12 -0.14 0.12 0.00 1.34 0.00 0.00 72.50 73.70 3duz s THR 91 CO 0.02 -0.19 0.20 -0.32 -0.54 0.00 0.00 174.62 173.79 3duz s MET 92 N -0.59 1.43 0.12 3.99 1.75 -1.26 -0.53 119.30 124.21 3duz s MET 92 Ca -0.06 -2.03 -0.30 0.00 -1.25 0.00 0.00 55.69 52.05 3duz s MET 92 Cb -0.04 -2.70 -0.06 0.00 2.84 0.00 0.00 34.83 34.87 3duz s MET 92 CO -0.00 -1.09 0.98 0.15 -0.65 0.00 0.00 175.02 174.41 3duz s LYS 93 N 0.43 4.69 -0.19 4.11 -0.14 -0.95 -4.95 119.74 122.74 3duz s LYS 93 Ca 0.15 1.49 -0.08 0.00 -1.36 0.00 0.00 55.97 56.17 3duz s LYS 93 Cb -0.23 -3.36 -0.04 0.00 -1.68 0.00 0.00 37.83 32.51 3duz s LYS 93 CO -0.05 0.20 0.09 0.99 -0.76 0.00 0.00 175.35 175.83 3duz s THR 94 N -0.06 5.02 0.23 2.17 2.01 -1.26 -1.77 115.64 121.98 3duz s THR 94 Ca 0.47 0.05 0.07 0.00 0.31 0.00 0.00 61.69 62.59 3duz s THR 94 Cb -0.24 -3.28 -0.04 0.00 0.01 0.00 0.00 72.50 68.95 3duz s THR 94 CO 0.31 0.44 0.15 -0.76 -0.69 0.00 0.00 174.62 174.06 3duz s LEU 95 N 0.44 3.70 0.20 4.42 1.43 -0.50 -4.97 118.68 123.40 3duz s LEU 95 Ca 0.05 -0.29 -0.16 0.00 -1.03 0.00 0.00 54.13 52.70 3duz s LEU 95 Cb -0.12 -2.25 -0.08 0.00 0.03 0.00 0.00 46.19 43.77 3duz s LEU 95 CO -0.00 -0.00 0.63 0.20 0.23 0.00 0.00 176.35 177.41 3duz s ASN 96 N -3.62 6.89 -0.18 2.29 0.02 -1.26 -4.20 114.94 114.88 3duz s ASN 96 Ca 0.32 1.21 -0.06 0.00 -1.02 0.00 0.00 52.86 53.31 3duz s ASN 96 Cb -0.08 -2.34 -0.03 0.00 0.02 0.00 0.00 41.25 38.81 3duz s ASN 96 CO 0.24 0.03 0.02 -0.69 0.02 0.00 0.00 177.10 176.72 3duz s VAL 97 N -1.57 4.36 0.54 1.60 1.01 -1.26 -4.99 120.40 120.09 3duz s VAL 97 Ca 0.42 -0.18 -0.12 0.00 0.00 0.00 0.00 61.98 62.10 3duz s VAL 97 Cb -0.15 -2.95 -0.05 0.00 0.00 0.00 0.00 36.38 33.22 3duz s VAL 97 CO 0.20 0.46 0.95 -0.83 0.00 0.00 0.00 175.10 175.88 3duz s GLY 98 N 0.49 1.80 0.13 4.51 0.00 -1.26 -4.79 107.32 108.20 3duz s GLY 98 Ca 0.00 -0.08 -0.26 0.00 0.00 0.00 0.00 44.72 44.39 3duz s GLY 98 CO 0.02 0.17 1.45 1.70 0.00 0.00 0.00 173.10 176.44 3duz h LYS 99 N 0.32 -0.03 -0.29 2.90 3.64 -1.98 0.17 116.57 121.31 3duz h LYS 99 Ca -0.46 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 58.94 3duz h LYS 99 Cb 1.19 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.00 3duz h LYS 99 CO 0.62 -0.02 0.17 0.93 -2.27 0.00 0.00 179.45 178.88 3duz h GLU 100 N -0.03 0.34 -0.33 1.90 4.39 -1.99 -0.48 114.58 118.39 3duz h GLU 100 Ca 0.13 -0.02 0.02 0.00 0.34 0.00 0.00 59.36 59.82 3duz h GLU 100 Cb 0.36 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.91 3duz h GLU 100 CO -0.77 0.22 0.18 -0.44 -1.16 0.00 0.00 179.01 177.05 3duz h ASP 101 N 0.35 0.29 -0.81 1.42 5.19 -1.76 -1.14 116.42 119.97 3duz h ASP 101 Ca 0.11 0.01 0.04 0.00 -0.62 0.00 0.00 57.03 56.57 3duz h ASP 101 Cb -0.01 -0.06 -0.05 0.00 0.18 0.00 0.00 39.33 39.40 3duz h ASP 101 CO -0.05 0.22 0.51 0.25 -3.12 0.00 0.00 179.24 177.05 3duz h LEU 102 N 0.38 0.83 -0.09 1.55 5.85 -0.17 0.34 115.31 124.00 3duz h LEU 102 Ca 0.13 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 3duz h LEU 102 Cb 0.01 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 40.86 3duz h LEU 102 CO -0.07 0.57 0.04 -0.07 -0.34 0.00 0.00 178.44 178.57 3duz h LEU 103 N 0.98 0.11 -0.56 2.25 3.38 -0.89 -2.01 115.31 118.58 3duz h LEU 103 Ca 0.33 -0.12 0.08 0.00 0.09 0.00 0.00 57.88 58.25 3duz h LEU 103 Cb 0.05 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 40.71 3duz h LEU 103 CO -0.13 0.20 0.23 -0.03 0.09 0.00 0.00 178.44 178.80 3duz h MET 104 N 0.02 0.41 -0.23 1.13 4.05 -0.17 -1.18 114.93 118.96 3duz h MET 104 Ca 0.03 -0.02 0.05 0.00 -0.28 0.00 0.00 59.70 59.48 3duz h MET 104 Cb 0.12 -0.09 -0.05 0.00 -0.80 0.00 0.00 31.60 30.77 3duz h MET 104 CO -0.00 0.27 -0.12 -1.49 0.23 0.00 0.00 176.91 175.80 3duz h TRP 105 N 0.43 -0.28 -0.05 1.39 4.06 -0.23 -2.01 115.95 119.25 3duz h TRP 105 Ca 0.27 0.03 0.03 0.00 2.06 0.00 0.00 58.89 61.28 3duz h TRP 105 Cb 0.29 0.16 -0.04 0.00 -1.00 0.00 0.00 29.16 28.56 3duz h TRP 105 CO -0.15 -0.18 -0.20 1.03 -3.56 0.00 0.00 178.44 175.38 3duz h SER 106 N -0.09 -0.60 -0.72 -3.49 0.87 -0.72 0.11 113.55 108.90 3duz h SER 106 Ca 0.12 0.09 0.10 0.00 -1.23 0.00 0.00 61.79 60.87 3duz h SER 106 Cb 0.28 0.26 -0.05 0.00 -0.44 0.00 0.00 62.40 62.45 3duz h SER 106 CO -0.29 -0.26 0.48 0.40 -0.53 0.00 0.00 176.83 176.63 3duz h ILE 107 N -0.29 0.92 -0.02 2.23 2.04 -0.99 -2.32 117.51 119.08 3duz h ILE 107 Ca 0.07 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.73 3duz h ILE 107 Cb 0.40 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 36.74 3duz h ILE 107 CO -0.22 0.11 -0.41 -1.14 0.00 0.00 0.00 178.15 176.49 3duz n ARG 108 N -4.49 1.33 -4.17 2.37 0.63 -0.78 -4.95 116.66 106.59 3duz n ARG 108 Ca 0.12 -1.08 -0.29 0.00 -0.92 0.00 0.00 57.85 55.68 3duz n ARG 108 Cb 0.35 -1.48 -0.09 0.00 0.45 0.00 0.00 32.46 31.69 3duz n ARG 108 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 3duz n GLN 109 N 0.11 -0.92 -3.58 -0.14 1.13 -0.02 -4.93 117.38 109.02 3duz n GLN 109 Ca 0.10 0.08 -0.15 0.00 -1.94 0.00 0.00 57.00 55.09 3duz n GLN 109 Cb 0.48 -3.26 -0.06 0.00 0.11 0.00 0.00 30.24 27.51 3duz n GLN 109 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 3duz s GLN 110 N -7.05 0.98 0.16 -1.09 -0.21 -0.91 -4.74 119.66 106.81 3duz s GLN 110 Ca 0.01 -0.06 0.08 0.00 0.02 0.00 0.00 55.36 55.42 3duz s GLN 110 Cb -0.01 0.45 -0.04 0.00 1.00 0.00 0.00 33.01 34.41 3duz s GLN 110 CO 0.92 -0.33 -0.17 0.00 -2.12 0.00 0.00 175.29 173.59 3duz s GLU 112 N -2.87 3.27 0.27 0.00 2.12 -1.26 -2.18 118.70 118.04 3duz s GLU 112 Ca 0.16 -0.50 0.02 0.00 0.36 0.00 0.00 54.97 55.00 3duz s GLU 112 Cb -0.05 -2.80 -0.05 0.00 0.26 0.00 0.00 34.13 31.49 3duz s GLU 112 CO 0.06 0.46 0.08 0.14 -0.54 0.00 0.00 175.26 175.47 3duz s VAL 113 N -0.24 0.72 0.68 3.70 -7.23 -0.10 -4.81 120.40 113.12 3duz s VAL 113 Ca 0.04 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.13 3duz s VAL 113 Cb -0.13 -2.66 0.15 0.00 0.56 0.00 0.00 36.38 34.30 3duz s VAL 113 CO 0.02 -0.01 0.93 0.61 -0.31 0.00 0.00 175.10 176.34 3duz n GLY 114 N -0.51 -0.57 3.77 2.32 0.00 -1.24 -0.90 105.19 108.05 3duz n GLY 114 Ca -0.01 -1.83 -0.38 0.00 0.00 0.00 0.00 46.02 43.80 3duz n GLY 114 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3duz s GLU 115 N -4.94 4.39 -0.25 1.61 2.12 -1.26 -4.71 118.70 115.66 3duz s GLU 115 Ca 0.55 1.67 -0.29 0.00 0.36 0.00 0.00 54.97 57.27 3duz s GLU 115 Cb -0.02 -2.87 0.01 0.00 0.26 0.00 0.00 34.13 31.51 3duz s GLU 115 CO 0.38 0.02 1.06 -2.00 -0.54 0.00 0.00 175.26 174.18 3duz s GLU 116 N -1.97 4.21 -0.36 4.30 2.56 -1.26 -4.90 118.70 121.28 3duz s GLU 116 Ca 0.51 1.31 -0.08 0.00 0.00 0.00 0.00 54.97 56.71 3duz s GLU 116 Cb -0.27 -3.67 0.04 0.00 2.00 0.00 0.00 34.13 32.23 3duz s GLU 116 CO 0.35 -0.70 0.15 -0.51 -0.56 0.00 0.00 175.26 173.99 3duz s LEU 117 N 3.33 4.54 -0.13 2.70 1.43 -1.01 -5.01 118.68 124.53 3duz s LEU 117 Ca 0.45 -1.15 -0.01 0.00 -1.03 0.00 0.00 54.13 52.40 3duz s LEU 117 Cb -0.15 -1.93 -0.02 0.00 0.03 0.00 0.00 46.19 44.13 3duz s LEU 117 CO 0.09 -0.37 -0.11 -0.63 0.23 0.00 0.00 176.35 175.56 3duz s ILE 118 N 1.45 3.22 -1.57 -0.59 1.01 -1.26 -1.46 121.20 122.00 3duz s ILE 118 Ca -0.00 -0.60 -0.12 0.00 0.00 0.00 0.00 60.65 59.92 3duz s ILE 118 Cb -0.20 -2.37 0.10 0.00 0.01 0.00 0.00 42.46 40.00 3duz s ILE 118 CO 0.04 0.52 0.76 -0.67 0.00 0.00 0.00 174.94 175.59 3duz n ASP 119 N 3.51 -3.02 -4.50 3.58 2.03 -1.19 -4.90 116.55 112.06 3duz n ASP 119 Ca -0.18 -0.93 -0.43 0.00 0.52 0.00 0.00 54.79 53.77 3duz n ASP 119 Cb 0.53 -3.21 -0.04 0.00 -0.72 0.00 0.00 41.12 37.67 3duz n ASP 119 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 3duz s ARG 120 N -6.72 3.27 0.37 -0.67 1.81 -0.87 -4.92 118.95 111.22 3duz s ARG 120 Ca 0.53 -0.42 0.00 0.00 -1.72 0.00 0.00 55.73 54.12 3duz s ARG 120 Cb -0.28 -4.09 -0.00 0.00 -0.45 0.00 0.00 34.95 30.13 3duz s ARG 120 CO 0.89 -1.53 0.01 -2.67 -0.68 0.00 0.00 175.30 171.31 3duz n TRP 121 N 7.42 0.80 0.00 -0.53 4.27 -1.26 -1.09 117.44 127.06 3duz n TRP 121 Ca 0.00 -1.83 0.00 0.00 -3.89 0.00 0.00 57.50 51.78 3duz n TRP 121 Cb 0.47 -0.23 0.00 0.00 -1.36 0.00 0.00 31.31 30.19 3duz n TRP 121 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 3duz n GLY 122 N 0.55 3.60 0.04 -1.67 0.00 -1.04 -1.67 105.19 105.00 3duz n GLY 122 Ca -0.15 -0.07 0.13 0.00 0.00 0.00 0.00 46.02 45.93 3duz n GLY 122 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3duz n SER 123 N 8.95 0.38 -0.29 1.61 3.41 -1.26 -3.22 113.62 123.20 3duz n SER 123 Ca 0.00 -0.13 0.14 0.00 -0.26 0.00 0.00 58.87 58.62 3duz n SER 123 Cb 0.00 -0.04 0.55 0.00 -0.26 0.00 0.00 64.21 64.47 3duz n SER 123 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3duz n ASP 124 N -1.34 1.00 0.25 4.04 8.00 -0.67 -4.00 116.55 123.82 3duz n ASP 124 Ca 0.08 -1.10 0.10 0.00 0.71 0.00 0.00 54.79 54.58 3duz n ASP 124 Cb 0.33 0.02 0.55 0.00 -0.02 0.00 0.00 41.12 41.99 3duz n ASP 124 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 3duz h SER 125 N 1.43 0.00 0.02 -2.24 0.02 -1.62 -1.42 113.55 109.73 3duz h SER 125 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3duz h SER 125 Cb 0.41 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.95 3duz h SER 125 CO 0.00 0.00 -0.65 0.47 -1.14 0.00 0.00 176.83 175.51 3duz n ASP 126 N -2.44 1.58 -0.27 3.07 9.92 -1.26 -3.79 116.55 123.37 3duz n ASP 126 Ca -0.01 -1.27 0.17 0.00 -0.53 0.00 0.00 54.79 53.14 3duz n ASP 126 Cb 0.37 0.64 0.46 0.00 -0.64 0.00 0.00 41.12 41.95 3duz n ASP 126 CO 0.00 0.00 0.00 0.44 0.13 0.00 0.00 177.20 177.77 3duz h ASP 127 N 1.46 0.52 -0.75 -2.24 3.32 -1.55 -1.92 116.42 115.25 3duz h ASP 127 Ca 0.00 0.05 0.16 0.00 0.02 0.00 0.00 57.03 57.27 3duz h ASP 127 Cb 0.65 -0.04 -0.14 0.00 0.22 0.00 0.00 39.33 40.02 3duz h ASP 127 CO 0.00 0.21 -0.08 0.00 -1.72 0.00 0.00 179.24 177.64 3duz n PHE 129 N -5.41 0.00 -0.05 0.00 3.72 -0.73 -4.36 117.46 110.63 3duz n PHE 129 Ca 0.12 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.40 3duz n PHE 129 Cb 0.43 -0.12 -0.06 0.00 -0.94 0.00 0.00 39.48 38.80 3duz n PHE 129 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3duz h ARG 130 N 1.20 0.26 -4.38 -1.08 3.08 -1.43 -3.43 114.38 108.61 3duz h ARG 130 Ca 0.00 -0.08 -0.60 0.00 0.07 0.00 0.00 59.98 59.37 3duz h ARG 130 Cb 0.46 -0.03 -0.38 0.00 0.08 0.00 0.00 29.97 30.11 3duz h ARG 130 CO 0.00 0.47 -0.80 0.34 -1.07 0.00 0.00 179.97 178.92 3duz s ASP 131 N -5.75 3.37 0.00 7.04 2.15 -1.26 -4.96 116.67 117.27 3duz s ASP 131 Ca -0.14 -0.91 0.03 0.00 0.43 0.00 0.00 52.55 51.96 3duz s ASP 131 Cb 0.06 -1.12 0.06 0.00 -0.30 0.00 0.00 42.92 41.62 3duz s ASP 131 CO 0.71 -0.19 0.86 0.59 -0.17 0.00 0.00 175.17 176.97 3duz n ASN 132 N 4.74 1.81 -0.10 -0.34 3.02 -1.26 -4.53 115.26 118.60 3duz n ASN 132 Ca -0.13 -1.60 -0.17 0.00 -0.03 0.00 0.00 54.58 52.65 3duz n ASN 132 Cb 0.46 -0.04 -0.13 0.00 -0.61 0.00 0.00 39.78 39.46 3duz n ASN 132 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3duz n GLU 133 N -0.02 0.67 -0.65 3.52 1.02 -1.26 -5.08 120.64 118.85 3duz n GLU 133 Ca 0.03 0.15 0.00 0.00 -0.02 0.00 0.00 57.16 57.32 3duz n GLU 133 Cb 0.20 -1.56 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 3duz n GLU 133 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3duz n GLY 134 N 2.12 0.00 3.31 0.62 0.00 -1.26 -4.84 105.19 105.14 3duz n GLY 134 Ca -0.41 -0.42 -0.25 0.00 0.00 0.00 0.00 46.02 44.94 3duz n GLY 134 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3duz s ARG 135 N -0.93 1.18 0.00 1.61 1.81 -1.19 -3.64 118.95 117.79 3duz s ARG 135 Ca 0.00 -1.21 0.00 0.00 -1.72 0.00 0.00 55.73 52.80 3duz s ARG 135 Cb 0.00 -1.48 0.00 0.00 -0.45 0.00 0.00 34.95 33.02 3duz s ARG 135 CO 0.00 0.34 0.00 0.41 -0.68 0.00 0.00 175.30 175.37 3duz n GLY 136 N 1.02 1.74 3.28 -3.53 0.00 -1.19 -4.04 105.19 102.46 3duz n GLY 136 Ca -0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 3duz n GLY 136 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3duz s GLN 137 N -0.90 3.24 -0.23 1.61 -1.52 -0.08 -5.00 119.66 116.78 3duz s GLN 137 Ca 0.00 -0.74 -0.01 0.00 -1.95 0.00 0.00 55.36 52.66 3duz s GLN 137 Cb 0.00 -2.62 0.03 0.00 -0.22 0.00 0.00 33.01 30.20 3duz s GLN 137 CO 0.00 0.05 -0.09 -1.58 -0.25 0.00 0.00 175.29 173.42 3duz s TRP 138 N 0.73 3.02 0.25 0.91 0.52 -1.26 -0.93 118.94 122.19 3duz s TRP 138 Ca -0.07 -1.63 0.05 0.00 0.02 0.00 0.00 56.10 54.48 3duz s TRP 138 Cb -0.15 -2.02 -0.05 0.00 -1.15 0.00 0.00 33.47 30.09 3duz s TRP 138 CO 0.01 -0.75 -0.04 0.14 0.02 0.00 0.00 176.95 176.33 3duz s VAL 139 N 1.30 1.38 0.17 4.03 -7.23 -0.93 -4.97 120.40 114.15 3duz s VAL 139 Ca 0.00 -2.09 -0.10 0.00 -1.81 0.00 0.00 61.98 57.99 3duz s VAL 139 Cb -0.16 -2.36 0.03 0.00 0.56 0.00 0.00 36.38 34.44 3duz s VAL 139 CO -0.06 -0.34 1.58 0.11 -0.31 0.00 0.00 175.10 176.08 3duz h LYS 140 N 2.39 1.03 -1.32 4.82 1.57 -1.86 -1.72 116.57 121.48 3duz h LYS 140 Ca -0.39 -0.40 0.34 0.00 -1.87 0.00 0.00 60.65 58.33 3duz h LYS 140 Cb 1.23 -0.06 -0.13 0.00 0.08 0.00 0.00 32.23 33.35 3duz h LYS 140 CO 0.66 1.09 0.88 0.20 -0.57 0.00 0.00 179.45 181.70 3duz s GLY 141 N -3.68 -0.42 -0.15 3.86 0.00 -1.26 -4.44 107.32 101.23 3duz s GLY 141 Ca -0.11 0.89 -0.28 0.00 0.00 0.00 0.00 44.72 45.21 3duz s GLY 141 CO 0.87 0.19 0.72 1.25 0.00 0.00 0.00 173.10 176.13 3duz s LYS 142 N -2.31 0.94 0.09 2.90 2.20 -0.25 -4.94 119.74 118.37 3duz s LYS 142 Ca 0.14 0.56 0.07 0.00 -0.36 0.00 0.00 55.97 56.38 3duz s LYS 142 Cb 0.05 0.45 -0.04 0.00 -1.51 0.00 0.00 37.83 36.78 3duz s LYS 142 CO -0.05 -0.22 -0.14 -2.00 -0.36 0.00 0.00 175.35 172.58 3duz s GLU 143 N -0.52 2.04 0.74 4.03 2.56 -1.26 -0.42 118.70 125.86 3duz s GLU 143 Ca -0.06 -1.05 -0.16 0.00 0.00 0.00 0.00 54.97 53.70 3duz s GLU 143 Cb -0.02 -2.24 -0.03 0.00 2.00 0.00 0.00 34.13 33.84 3duz s GLU 143 CO 0.06 0.51 0.52 1.28 -0.56 0.00 0.00 175.26 177.07 3duz n LEU 144 N 0.91 0.78 -3.96 2.70 4.77 -1.25 -4.71 117.00 116.24 3duz n LEU 144 Ca -0.15 0.57 -0.27 0.00 -0.03 0.00 0.00 56.01 56.13 3duz n LEU 144 Cb 0.52 -1.22 -0.17 0.00 -2.33 0.00 0.00 43.42 40.23 3duz n LEU 144 CO 0.31 -3.14 -0.46 -0.69 -1.33 0.00 0.00 177.39 172.08 3duz s VAL 145 N -1.95 1.20 -1.39 4.08 1.01 -1.26 -4.94 120.40 117.15 3duz s VAL 145 Ca 0.65 -0.42 -0.15 0.00 0.00 0.00 0.00 61.98 62.06 3duz s VAL 145 Cb -0.34 -1.17 0.04 0.00 0.00 0.00 0.00 36.38 34.91 3duz s VAL 145 CO 0.59 0.39 2.10 1.17 0.00 0.00 0.00 175.10 179.35 3duz n LYS 146 N 4.70 2.85 -3.34 2.72 4.81 -1.26 -4.59 118.16 124.05 3duz n LYS 146 Ca -0.15 -2.72 -0.38 0.00 -0.87 0.00 0.00 58.31 54.18 3duz n LYS 146 Cb 0.50 -3.33 -0.06 0.00 0.02 0.00 0.00 35.03 32.17 3duz n LYS 146 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 3duz s ARG 147 N 3.56 4.19 -0.22 1.64 0.52 -1.26 -0.10 118.95 127.28 3duz s ARG 147 Ca 0.49 0.55 -0.20 0.00 -0.52 0.00 0.00 55.73 56.05 3duz s ARG 147 Cb 0.12 -3.32 0.06 0.00 0.52 0.00 0.00 34.95 32.32 3duz s ARG 147 CO -0.04 0.44 0.58 -1.14 0.02 0.00 0.00 175.30 175.16 3duz s GLN 148 N -0.34 0.67 0.12 3.54 0.74 -0.00 -4.55 119.66 119.84 3duz s GLN 148 Ca 0.27 0.81 -0.20 0.00 0.05 0.00 0.00 55.36 56.28 3duz s GLN 148 Cb -0.17 0.32 0.05 0.00 1.10 0.00 0.00 33.01 34.31 3duz s GLN 148 CO 0.14 -0.08 0.51 0.54 -0.55 0.00 0.00 175.29 175.85 3duz s ASN 149 N 0.34 -0.42 -0.25 6.67 4.22 -1.26 -3.13 114.94 121.11 3duz s ASN 149 Ca -0.00 -0.07 0.18 0.00 -2.14 0.00 0.00 52.86 50.83 3duz s ASN 149 Cb -0.04 0.53 0.43 0.00 1.28 0.00 0.00 41.25 43.45 3duz s ASN 149 CO 0.00 -0.86 1.27 -3.20 -2.04 0.00 0.00 177.10 172.27 3duz n ASN 150 N -0.13 0.20 -1.89 3.54 5.15 -1.26 -4.71 115.26 116.17 3duz n ASN 150 Ca -0.17 -2.09 -0.09 0.00 -0.60 0.00 0.00 54.58 51.63 3duz n ASN 150 Cb 0.63 0.03 0.23 0.00 -0.53 0.00 0.00 39.78 40.15 3duz n ASN 150 CO 0.00 0.00 0.00 -0.46 1.40 0.00 0.00 177.26 178.20 3duz n ASN 151 N -0.83 4.21 -4.06 1.20 6.94 -1.26 -4.62 115.26 116.84 3duz n ASN 151 Ca -0.05 -3.12 -0.34 0.00 -0.02 0.00 0.00 54.58 51.06 3duz n ASN 151 Cb 0.85 -0.73 -0.12 0.00 -2.36 0.00 0.00 39.78 37.42 3duz n ASN 151 CO 0.00 0.00 0.00 -1.00 -1.03 0.00 0.00 177.26 175.23 3duz s HIS 152 N -2.65 3.53 0.36 -2.53 3.76 -1.26 -5.09 115.29 111.40 3duz s HIS 152 Ca 0.47 -2.76 -0.28 0.00 -0.15 0.00 0.00 55.06 52.34 3duz s HIS 152 Cb 0.38 -3.08 -0.11 0.00 1.11 0.00 0.00 32.58 30.88 3duz s HIS 152 CO 0.11 -0.90 1.48 0.34 -0.85 0.00 0.00 174.74 174.92 3duz n PHE 153 N 4.01 2.87 -1.45 1.40 7.35 -1.26 -1.82 117.46 128.55 3duz n PHE 153 Ca 0.03 0.43 -0.16 0.00 -0.76 0.00 0.00 57.45 56.99 3duz n PHE 153 Cb 0.39 -2.53 -0.07 0.00 0.35 0.00 0.00 39.48 37.63 3duz n PHE 153 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3duz n ALA 154 N 0.69 -0.24 -2.62 3.13 0.00 0.16 -4.99 120.51 116.64 3duz n ALA 154 Ca 0.03 0.25 -0.11 0.00 0.00 0.00 0.00 53.44 53.61 3duz n ALA 154 Cb 0.38 -1.75 -0.11 0.00 0.00 0.00 0.00 19.45 17.97 3duz n ALA 154 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 3duz s HIS 155 N -2.49 0.61 0.42 0.00 3.76 -0.76 -4.98 115.29 111.86 3duz s HIS 155 Ca 0.00 -0.68 -0.21 0.00 -0.15 0.00 0.00 55.06 54.03 3duz s HIS 155 Cb 0.00 -0.38 -0.11 0.00 1.11 0.00 0.00 32.58 33.20 3duz s HIS 155 CO 0.00 -0.16 0.93 -1.01 -0.85 0.00 0.00 174.74 173.65 3duz s HIS 156 N -2.26 3.33 -0.04 1.40 3.76 -1.26 -2.22 115.29 118.00 3duz s HIS 156 Ca -0.04 1.58 0.03 0.00 -0.15 0.00 0.00 55.06 56.48 3duz s HIS 156 Cb -0.04 -2.82 0.00 0.00 1.11 0.00 0.00 32.58 30.83 3duz s HIS 156 CO -0.02 -0.08 -0.13 0.99 -0.85 0.00 0.00 174.74 174.64 3duz s THR 157 N -2.15 1.14 -0.05 1.30 2.01 0.13 -2.51 115.64 115.52 3duz s THR 157 Ca 0.61 -0.54 0.06 0.00 0.31 0.00 0.00 61.69 62.13 3duz s THR 157 Cb -0.09 -1.01 -0.01 0.00 0.01 0.00 0.00 72.50 71.40 3duz s THR 157 CO 0.14 0.34 -0.24 0.00 -0.69 0.00 0.00 174.62 174.17 3duz s ASN 159 N -0.19 0.63 -0.22 0.00 0.01 -0.98 -2.06 114.94 112.14 3duz s ASN 159 Ca -0.02 -0.08 -0.03 0.00 -0.71 0.00 0.00 52.86 52.01 3duz s ASN 159 Cb -0.13 -0.23 0.11 0.00 0.41 0.00 0.00 41.25 41.41 3duz s ASN 159 CO 0.03 -0.02 0.26 -0.75 -1.51 0.00 0.00 177.10 175.11 3duz s LYS 160 N 0.52 0.24 -0.03 -0.60 2.20 -0.53 -0.56 119.74 120.97 3duz s LYS 160 Ca -0.06 0.23 -0.00 0.00 -0.36 0.00 0.00 55.97 55.78 3duz s LYS 160 Cb -0.09 -1.00 -0.04 0.00 -1.51 0.00 0.00 37.83 35.20 3duz s LYS 160 CO -0.00 -0.70 0.04 0.45 -0.36 0.00 0.00 175.35 174.77 3duz s SER 161 N 2.38 5.41 0.06 1.43 0.15 -0.51 -2.39 113.70 120.22 3duz s SER 161 Ca 0.08 0.11 0.04 0.00 0.70 0.00 0.00 55.95 56.89 3duz s SER 161 Cb -0.15 -1.51 -0.04 0.00 -1.71 0.00 0.00 66.02 62.61 3duz s SER 161 CO -0.15 0.31 -0.02 0.26 1.20 0.00 0.00 173.24 174.83 3duz s TRP 162 N -1.07 2.96 0.25 3.44 0.52 -1.26 -1.09 118.94 122.69 3duz s TRP 162 Ca 0.19 -0.03 0.11 0.00 0.02 0.00 0.00 56.10 56.39 3duz s TRP 162 Cb -0.12 -1.55 -0.05 0.00 -1.15 0.00 0.00 33.47 30.60 3duz s TRP 162 CO 0.09 0.45 -0.19 -0.98 0.02 0.00 0.00 176.95 176.35 3duz s ARG 163 N -2.05 1.56 -0.28 4.98 1.70 0.60 -3.79 118.95 121.68 3duz s ARG 163 Ca 0.23 -1.70 -0.22 0.00 -0.47 0.00 0.00 55.73 53.57 3duz s ARG 163 Cb -0.11 -1.57 0.10 0.00 -0.57 0.00 0.00 34.95 32.80 3duz s ARG 163 CO 0.15 0.29 0.87 0.00 -1.08 0.00 0.00 175.30 175.53 3duz s GLY 165 N 0.71 -0.38 -0.04 0.00 0.00 -0.99 -1.09 107.32 105.52 3duz s GLY 165 Ca -0.02 2.30 -0.02 0.00 0.00 0.00 0.00 44.72 46.98 3duz s GLY 165 CO -0.08 1.79 0.10 -1.50 0.00 0.00 0.00 173.10 173.40 3duz s ILE 166 N 0.32 -0.04 -0.11 0.90 1.10 -1.26 -1.94 121.20 120.16 3duz s ILE 166 Ca 0.01 0.16 -0.09 0.00 -0.51 0.00 0.00 60.65 60.22 3duz s ILE 166 Cb -0.05 -0.17 0.04 0.00 0.15 0.00 0.00 42.46 42.43 3duz s ILE 166 CO -0.02 0.06 0.29 -0.55 -2.11 0.00 0.00 174.94 172.61 3duz s SER 167 N 0.93 -0.31 -0.69 4.50 0.15 -0.14 -4.94 113.70 113.19 3duz s SER 167 Ca -0.07 0.59 -0.15 0.00 0.70 0.00 0.00 55.95 57.02 3duz s SER 167 Cb -0.10 0.56 0.18 0.00 -1.71 0.00 0.00 66.02 64.94 3duz s SER 167 CO -0.04 -0.13 0.64 -0.89 1.20 0.00 0.00 173.24 174.03 3duz s THR 168 N 0.56 5.42 0.49 6.45 2.01 -1.26 0.51 115.64 129.82 3duz s THR 168 Ca -0.03 -2.01 0.07 0.00 0.31 0.00 0.00 61.69 60.02 3duz s THR 168 Cb -0.05 -4.41 0.07 0.00 0.01 0.00 0.00 72.50 68.12 3duz s THR 168 CO -0.03 -0.95 0.54 -1.20 -0.69 0.00 0.00 174.62 172.29 3duz n SER 169 N 4.58 2.12 -4.77 3.53 7.64 0.54 -4.83 113.62 122.43 3duz n SER 169 Ca 0.01 -2.45 -0.31 0.00 1.01 0.00 0.00 58.87 57.12 3duz n SER 169 Cb 0.44 -0.22 -0.07 0.00 -1.01 0.00 0.00 64.21 63.35 3duz n SER 169 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 3duz s LYS 170 N -4.12 2.88 0.01 1.43 -0.14 -1.26 0.62 119.74 119.16 3duz s LYS 170 Ca 0.41 -0.68 -0.03 0.00 -1.36 0.00 0.00 55.97 54.32 3duz s LYS 170 Cb -0.03 -2.73 -0.01 0.00 -1.68 0.00 0.00 37.83 33.38 3duz s LYS 170 CO 0.26 0.57 0.03 -1.64 -0.76 0.00 0.00 175.35 173.82 3duz s MET 171 N -2.30 0.37 0.14 1.68 -1.94 -0.40 -1.55 119.30 115.28 3duz s MET 171 Ca 0.28 -0.52 -0.30 0.00 -1.71 0.00 0.00 55.69 53.44 3duz s MET 171 Cb -0.12 0.14 -0.07 0.00 2.01 0.00 0.00 34.83 36.79 3duz s MET 171 CO 0.21 -0.07 1.06 0.71 -0.01 0.00 0.00 175.02 176.91 3duz s TYR 172 N -1.40 3.66 0.46 -0.03 1.51 -1.26 -0.15 117.35 120.14 3duz s TYR 172 Ca -0.15 1.65 -0.19 0.00 -1.01 0.00 0.00 57.07 57.36 3duz s TYR 172 Cb -0.09 -3.20 -0.10 0.00 -0.11 0.00 0.00 41.96 38.46 3duz s TYR 172 CO -0.00 -0.36 0.97 -1.12 -1.11 0.00 0.00 175.55 173.93 3duz s SER 173 N 0.07 6.76 -0.06 2.29 0.01 -0.17 -2.46 113.70 120.12 3duz s SER 173 Ca 0.49 1.68 -0.02 0.00 1.31 0.00 0.00 55.95 59.42 3duz s SER 173 Cb -0.27 -2.53 0.03 0.00 0.21 0.00 0.00 66.02 63.46 3duz s SER 173 CO 0.32 -0.49 0.03 -0.60 0.41 0.00 0.00 173.24 172.91 3duz s ARG 174 N -3.47 0.33 0.31 12.44 3.52 0.80 -4.39 118.95 128.49 3duz s ARG 174 Ca 0.62 0.20 -0.19 0.00 -0.13 0.00 0.00 55.73 56.23 3duz s ARG 174 Cb -0.10 -0.84 -0.09 0.00 -1.56 0.00 0.00 34.95 32.36 3duz s ARG 174 CO 0.20 -0.33 0.79 -1.17 -0.81 0.00 0.00 175.30 173.98 3duz s LEU 175 N 2.05 4.15 -0.16 -0.88 2.96 -0.13 -0.34 118.68 126.34 3duz s LEU 175 Ca 0.05 1.45 -0.10 0.00 -0.22 0.00 0.00 54.13 55.31 3duz s LEU 175 Cb -0.12 -4.02 0.05 0.00 0.50 0.00 0.00 46.19 42.60 3duz s LEU 175 CO -0.05 -0.15 0.39 -0.70 -1.32 0.00 0.00 176.35 174.52 3duz s GLU 176 N -2.63 0.39 0.06 1.98 2.56 -0.79 -4.74 118.70 115.53 3duz s GLU 176 Ca 0.52 0.70 0.05 0.00 0.00 0.00 0.00 54.97 56.24 3duz s GLU 176 Cb -0.13 0.03 -0.03 0.00 2.00 0.00 0.00 34.13 36.01 3duz s GLU 176 CO 0.18 -0.13 -0.14 0.00 -0.56 0.00 0.00 175.26 174.61 3duz s GLN 178 N -1.49 3.76 0.26 0.00 -1.52 -0.74 -4.85 119.66 115.08 3duz s GLN 178 Ca -0.00 -0.17 0.06 0.00 -1.95 0.00 0.00 55.36 53.30 3duz s GLN 178 Cb -0.09 -3.28 0.34 0.00 -0.22 0.00 0.00 33.01 29.76 3duz s GLN 178 CO 0.02 0.57 1.62 -0.44 -0.25 0.00 0.00 175.29 176.81 3duz h ASP 179 N 5.70 0.22 0.10 5.90 5.19 -1.97 0.76 116.42 132.32 3duz h ASP 179 Ca -0.49 -0.11 0.00 0.00 -0.62 0.00 0.00 57.03 55.81 3duz h ASP 179 Cb 1.20 -0.06 -0.02 0.00 0.18 0.00 0.00 39.33 40.63 3duz h ASP 179 CO 0.66 0.71 -0.23 0.44 -3.12 0.00 0.00 179.24 177.71 3duz h ASP 180 N 0.15 -0.66 -0.00 6.45 3.32 -1.99 -3.37 116.42 120.32 3duz h ASP 180 Ca 0.00 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3duz h ASP 180 Cb 1.00 0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.79 3duz h ASP 180 CO 0.08 -0.26 -0.09 1.07 -1.72 0.00 0.00 179.24 178.33 3duz n THR 181 N -3.72 0.00 -3.46 0.35 5.66 -1.21 -4.99 114.28 106.91 3duz n THR 181 Ca -0.04 -0.46 -0.25 0.00 -3.05 0.00 0.00 64.05 60.26 3duz n THR 181 Cb 0.18 1.06 -0.01 0.00 -1.55 0.00 0.00 70.33 70.02 3duz n THR 181 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 3duz n ASP 182 N -0.29 -3.68 -4.89 1.09 8.00 0.26 -4.96 116.55 112.08 3duz n ASP 182 Ca 0.02 -0.46 -0.35 0.00 0.71 0.00 0.00 54.79 54.72 3duz n ASP 182 Cb 0.10 -3.04 -0.05 0.00 -0.02 0.00 0.00 41.12 38.11 3duz n ASP 182 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3duz s GLU 183 N -6.12 3.56 0.23 -1.24 2.02 -1.25 -4.83 118.70 111.07 3duz s GLU 183 Ca 0.44 -0.10 0.11 0.00 0.02 0.00 0.00 54.97 55.44 3duz s GLU 183 Cb -0.23 -3.08 -0.05 0.00 0.10 0.00 0.00 34.13 30.87 3duz s GLU 183 CO 0.54 0.66 -0.20 0.00 0.02 0.00 0.00 175.26 176.27 3duz s GLN 185 N -3.15 0.28 -0.33 0.00 -0.21 -0.15 -4.99 119.66 111.11 3duz s GLN 185 Ca 0.24 -0.27 -0.14 0.00 0.02 0.00 0.00 55.36 55.21 3duz s GLN 185 Cb -0.06 0.11 -0.02 0.00 1.00 0.00 0.00 33.01 34.05 3duz s GLN 185 CO 0.11 -0.06 0.30 0.08 -2.12 0.00 0.00 175.29 173.61 3duz s VAL 186 N -0.86 5.22 -0.00 1.09 1.01 -1.26 -1.89 120.40 123.71 3duz s VAL 186 Ca -0.09 0.02 -0.13 0.00 0.00 0.00 0.00 61.98 61.78 3duz s VAL 186 Cb -0.06 -3.74 -0.05 0.00 0.00 0.00 0.00 36.38 32.53 3duz s VAL 186 CO 0.00 -0.01 0.36 -0.31 0.00 0.00 0.00 175.10 175.15 3duz s TYR 187 N 1.90 3.68 -0.20 5.22 1.51 0.54 -4.89 117.35 125.11 3duz s TYR 187 Ca 0.10 0.88 -0.09 0.00 -1.01 0.00 0.00 57.07 56.95 3duz s TYR 187 Cb -0.17 -2.21 -0.04 0.00 -0.11 0.00 0.00 41.96 39.43 3duz s TYR 187 CO 0.11 0.64 0.10 0.42 -1.11 0.00 0.00 175.55 175.71 3duz s ILE 188 N -1.13 5.01 0.05 2.71 1.09 -1.26 -0.14 121.20 127.52 3duz s ILE 188 Ca 0.24 0.05 0.01 0.00 -1.10 0.00 0.00 60.65 59.85 3duz s ILE 188 Cb -0.15 -3.29 -0.04 0.00 -1.06 0.00 0.00 42.46 37.92 3duz s ILE 188 CO 0.13 0.42 0.13 -0.76 -0.10 0.00 0.00 174.94 174.76 3duz s LEU 189 N 0.63 4.05 0.00 2.97 1.02 -1.03 -0.17 118.68 126.15 3duz s LEU 189 Ca 0.05 0.14 -0.12 0.00 0.02 0.00 0.00 54.13 54.23 3duz s LEU 189 Cb -0.13 -2.59 0.18 0.00 0.02 0.00 0.00 46.19 43.67 3duz s LEU 189 CO 0.01 0.20 1.12 -0.90 0.02 0.00 0.00 176.35 176.80 3duz n ASP 190 N 0.61 0.32 0.20 2.29 5.68 0.82 -4.53 116.55 121.94 3duz n ASP 190 Ca -0.09 -1.55 0.14 0.00 -0.50 0.00 0.00 54.79 52.80 3duz n ASP 190 Cb 0.52 -0.83 0.71 0.00 -1.14 0.00 0.00 41.12 40.38 3duz n ASP 190 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3duz h ALA 191 N -1.56 1.00 -0.02 2.12 0.00 -1.89 -2.43 119.26 116.48 3duz h ALA 191 Ca -0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3duz h ALA 191 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3duz h ALA 191 CO 0.28 0.00 -0.31 0.39 0.00 0.00 0.00 179.25 179.61 3duz n GLU 192 N -2.49 1.54 -0.05 0.00 4.71 -1.26 -3.62 120.64 119.48 3duz n GLU 192 Ca -0.01 -1.10 0.00 0.00 -0.01 0.00 0.00 57.16 56.04 3duz n GLU 192 Cb 0.10 -1.38 0.00 0.00 -1.01 0.00 0.00 31.44 29.15 3duz n GLU 192 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3duz n GLY 193 N 1.26 0.77 3.77 0.62 0.00 -0.92 -4.86 105.19 105.84 3duz n GLY 193 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 3duz n GLY 193 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3duz s ASN 194 N -2.46 7.15 0.60 1.61 -0.87 -1.26 -1.31 114.94 118.39 3duz s ASN 194 Ca 0.00 1.37 -0.18 0.00 -1.57 0.00 0.00 52.86 52.47 3duz s ASN 194 Cb 0.00 -2.42 -0.03 0.00 -0.02 0.00 0.00 41.25 38.78 3duz s ASN 194 CO 0.00 0.15 1.19 -2.84 -2.57 0.00 0.00 177.10 173.02 3duz s PRO 195 N -0.59 2.99 0.02 -0.60 0.02 -1.26 -0.13 135.00 135.45 3duz s PRO 195 Ca 0.33 1.76 0.05 0.00 0.02 0.00 0.00 61.00 63.16 3duz s PRO 195 Cb -0.20 -1.94 -0.02 0.00 0.02 0.00 0.00 34.50 32.36 3duz s PRO 195 CO 0.21 -1.18 -0.16 0.96 -0.33 0.00 0.00 177.00 176.51 3duz s ILE 196 N -1.69 1.25 -1.18 2.83 -4.36 0.77 -4.80 121.20 114.01 3duz s ILE 196 Ca 0.76 -0.91 -0.21 0.00 -0.26 0.00 0.00 60.65 60.03 3duz s ILE 196 Cb -0.28 -1.09 0.01 0.00 1.25 0.00 0.00 42.46 42.34 3duz s ILE 196 CO 0.33 0.16 1.78 0.21 0.24 0.00 0.00 174.94 177.66 3duz s ASN 197 N -0.86 6.07 -0.22 4.36 2.47 -1.26 -4.56 114.94 120.94 3duz s ASN 197 Ca 0.04 -1.89 -0.01 0.00 0.42 0.00 0.00 52.86 51.43 3duz s ASN 197 Cb -0.07 -2.58 0.02 0.00 -1.45 0.00 0.00 41.25 37.17 3duz s ASN 197 CO 0.01 -1.96 -0.11 -0.69 -3.72 0.00 0.00 177.10 170.62 3duz s VAL 198 N 6.99 2.63 0.47 -5.21 1.01 -1.26 -4.67 120.40 120.36 3duz s VAL 198 Ca 0.59 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.68 3duz s VAL 198 Cb 0.01 -2.23 -0.02 0.00 0.00 0.00 0.00 36.38 34.14 3duz s VAL 198 CO 0.06 0.37 0.05 0.42 0.00 0.00 0.00 175.10 176.00 3duz s THR 199 N 1.33 0.93 -0.18 3.92 -4.23 -1.26 -4.82 115.64 111.34 3duz s THR 199 Ca 0.03 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 58.72 3duz s THR 199 Cb -0.15 -2.23 -0.02 0.00 1.34 0.00 0.00 72.50 71.45 3duz s THR 199 CO -0.08 0.00 1.10 0.58 -0.54 0.00 0.00 174.62 175.68 3duz h VAL 200 N 1.51 0.46 0.00 2.29 2.07 -1.89 -2.10 116.25 118.59 3duz h VAL 200 Ca -0.40 -1.78 -0.11 0.00 0.82 0.00 0.00 66.70 65.23 3duz h VAL 200 Cb 1.30 2.03 -0.02 0.00 -1.52 0.00 0.00 31.29 33.08 3duz h VAL 200 CO 0.67 0.26 -2.04 0.47 0.02 0.00 0.00 177.57 176.95 3duz n ASP 201 N -2.96 0.35 -4.05 0.57 8.00 -1.26 -4.77 116.55 112.43 3duz n ASP 201 Ca -0.03 0.00 -0.24 0.00 0.71 0.00 0.00 54.79 55.23 3duz n ASP 201 Cb 0.73 1.62 -0.16 0.00 -0.02 0.00 0.00 41.12 43.29 3duz n ASP 201 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3duz s THR 202 N -3.11 1.14 0.25 -3.53 2.01 -1.26 -5.03 115.64 106.11 3duz s THR 202 Ca -0.08 -0.52 -0.30 0.00 0.31 0.00 0.00 61.69 61.10 3duz s THR 202 Cb 0.11 -1.01 -0.09 0.00 0.01 0.00 0.00 72.50 71.52 3duz s THR 202 CO 0.82 0.34 1.13 0.54 -0.69 0.00 0.00 174.62 176.76 3duz s VAL 203 N 0.34 3.51 -0.19 3.82 0.11 -1.26 -4.00 120.40 122.73 3duz s VAL 203 Ca -0.08 1.44 -0.09 0.00 -2.93 0.00 0.00 61.98 60.32 3duz s VAL 203 Cb -0.13 -3.92 -0.05 0.00 -1.53 0.00 0.00 36.38 30.76 3duz s VAL 203 CO 0.02 0.31 0.12 -0.22 -3.33 0.00 0.00 175.10 172.00 3duz s LEU 204 N -1.12 4.15 -0.32 2.54 2.96 0.84 -4.91 118.68 122.82 3duz s LEU 204 Ca 0.47 0.23 -0.08 0.00 -0.22 0.00 0.00 54.13 54.53 3duz s LEU 204 Cb -0.32 -2.06 0.02 0.00 0.50 0.00 0.00 46.19 44.33 3duz s LEU 204 CO 0.40 0.21 0.12 -1.00 -1.32 0.00 0.00 176.35 174.76 3duz s HIS 205 N 0.18 3.20 -0.11 5.38 3.76 -1.26 -0.43 115.29 126.01 3duz s HIS 205 Ca 0.08 -1.05 -0.24 0.00 -0.15 0.00 0.00 55.06 53.70 3duz s HIS 205 Cb -0.11 -2.31 0.06 0.00 1.11 0.00 0.00 32.58 31.33 3duz s HIS 205 CO -0.01 -0.62 0.58 0.50 -0.85 0.00 0.00 174.74 174.35 3duz s ARG 206 N 1.50 0.85 -1.53 1.40 3.52 -0.40 -4.92 118.95 119.37 3duz s ARG 206 Ca 0.02 0.39 -0.14 0.00 -0.13 0.00 0.00 55.73 55.87 3duz s ARG 206 Cb -0.18 0.40 0.10 0.00 -1.56 0.00 0.00 34.95 33.71 3duz s ARG 206 CO 0.04 -0.21 0.86 -0.25 -0.81 0.00 0.00 175.30 174.93 3duz n ASP 207 N 1.66 -4.45 -1.16 -2.12 8.00 -1.26 -1.54 116.55 115.68 3duz n ASP 207 Ca -0.18 -0.74 -0.13 0.00 0.71 0.00 0.00 54.79 54.46 3duz n ASP 207 Cb 0.56 -3.58 -0.03 0.00 -0.02 0.00 0.00 41.12 38.05 3duz n ASP 207 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3duz n GLY 208 N -1.55 0.73 3.15 0.44 0.00 -1.26 -4.99 105.19 101.71 3duz n GLY 208 Ca 0.04 -0.40 -0.08 0.00 0.00 0.00 0.00 46.02 45.57 3duz n GLY 208 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3duz s VAL 209 N -2.54 0.16 -0.13 1.61 1.01 -0.59 -4.80 120.40 115.13 3duz s VAL 209 Ca 0.00 -1.72 0.01 0.00 0.00 0.00 0.00 61.98 60.27 3duz s VAL 209 Cb 0.00 -1.70 -0.01 0.00 0.00 0.00 0.00 36.38 34.67 3duz s VAL 209 CO 0.00 -0.72 -0.16 -0.44 0.00 0.00 0.00 175.10 173.78 3duz s SER 210 N -2.96 3.71 -0.02 3.32 0.01 -0.11 -1.27 113.70 116.38 3duz s SER 210 Ca 0.13 -0.41 0.04 0.00 1.31 0.00 0.00 55.95 57.02 3duz s SER 210 Cb 0.07 -1.55 -0.01 0.00 0.21 0.00 0.00 66.02 64.74 3duz s SER 210 CO -0.05 0.15 -0.14 -0.04 0.41 0.00 0.00 173.24 173.57 3duz s MET 211 N 0.43 1.20 -0.01 12.44 1.00 0.43 -1.24 119.30 133.54 3duz s MET 211 Ca -0.12 -0.49 -0.17 0.00 0.00 0.00 0.00 55.69 54.91 3duz s MET 211 Cb -0.16 -1.13 0.03 0.00 0.00 0.00 0.00 34.83 33.56 3duz s MET 211 CO 0.06 0.27 0.36 -1.50 0.00 0.00 0.00 175.02 174.21 3duz s ILE 212 N -0.23 0.05 0.11 2.53 2.07 -0.95 -0.11 121.20 124.67 3duz s ILE 212 Ca 0.03 -0.44 -0.29 0.00 -1.41 0.00 0.00 60.65 58.54 3duz s ILE 212 Cb -0.07 -0.70 -0.06 0.00 0.13 0.00 0.00 42.46 41.76 3duz s ILE 212 CO -0.00 -0.24 0.93 -0.76 -1.91 0.00 0.00 174.94 172.95 3duz s LEU 213 N -1.42 4.50 0.15 8.50 1.43 -0.79 -1.82 118.68 129.23 3duz s LEU 213 Ca -0.12 1.74 -0.11 0.00 -1.03 0.00 0.00 54.13 54.61 3duz s LEU 213 Cb -0.04 -3.53 -0.01 0.00 0.03 0.00 0.00 46.19 42.64 3duz s LEU 213 CO 0.04 -0.04 1.53 0.50 0.23 0.00 0.00 176.35 178.60 3duz h LYS 214 N 5.52 0.93 -5.44 1.70 3.64 -1.88 -3.42 116.57 117.62 3duz h LYS 214 Ca -0.43 -0.41 -0.53 0.00 -1.27 0.00 0.00 60.65 58.01 3duz h LYS 214 Cb 1.21 -0.03 -0.30 0.00 -0.41 0.00 0.00 32.23 32.70 3duz h LYS 214 CO 0.71 1.06 -0.83 -1.14 -2.27 0.00 0.00 179.45 176.99 3duz s GLN 215 N -4.64 1.44 0.23 1.90 0.74 -1.26 -5.08 119.66 112.98 3duz s GLN 215 Ca -0.12 -0.58 -0.32 0.00 0.05 0.00 0.00 55.36 54.40 3duz s GLN 215 Cb 0.11 -1.35 -0.12 0.00 1.10 0.00 0.00 33.01 32.76 3duz s GLN 215 CO 0.86 0.31 1.65 1.17 -0.55 0.00 0.00 175.29 178.73 3duz n LYS 216 N 2.84 2.63 -2.06 1.67 4.81 -1.26 -4.87 118.16 121.92 3duz n LYS 216 Ca -0.16 0.95 -0.42 0.00 -0.87 0.00 0.00 58.31 57.81 3duz n LYS 216 Cb 0.54 -2.75 -0.03 0.00 0.02 0.00 0.00 35.03 32.81 3duz n LYS 216 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 3duz s SER 217 N 0.90 6.71 -0.09 3.14 0.01 -1.26 -4.99 113.70 118.11 3duz s SER 217 Ca 0.72 2.24 0.02 0.00 1.31 0.00 0.00 55.95 60.25 3duz s SER 217 Cb -0.53 -2.55 -0.02 0.00 0.21 0.00 0.00 66.02 63.13 3duz s SER 217 CO 0.39 -0.86 -0.17 0.28 0.41 0.00 0.00 173.24 173.29 3duz s THR 218 N 3.28 2.78 0.29 1.44 -1.32 -1.26 -4.86 115.64 115.98 3duz s THR 218 Ca 0.70 -0.78 0.01 0.00 -1.21 0.00 0.00 61.69 60.41 3duz s THR 218 Cb -0.34 -2.11 0.01 0.00 -1.51 0.00 0.00 72.50 68.55 3duz s THR 218 CO 0.29 0.55 0.09 2.22 -2.21 0.00 0.00 174.62 175.56 3duz n PHE 219 N 3.13 0.03 -3.55 9.09 -1.74 -1.26 -4.30 117.46 118.85 3duz n PHE 219 Ca -0.18 -1.36 -0.17 0.00 -0.56 0.00 0.00 57.45 55.19 3duz n PHE 219 Cb 0.52 -0.21 -0.06 0.00 1.52 0.00 0.00 39.48 41.25 3duz n PHE 219 CO 0.00 0.00 0.00 -0.08 -0.56 0.00 0.00 176.76 176.12 3duz s THR 220 N -1.83 0.00 0.19 1.97 -1.32 -0.35 -4.98 115.64 109.33 3duz s THR 220 Ca 0.06 0.00 0.07 0.00 -1.21 0.00 0.00 61.69 60.62 3duz s THR 220 Cb -0.01 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.94 3duz s THR 220 CO 0.04 0.00 0.02 0.42 -2.21 0.00 0.00 174.62 172.89 3duz s THR 221 N -0.78 3.77 -0.13 5.08 -4.23 -1.26 -0.80 115.64 117.28 3duz s THR 221 Ca -0.08 -1.47 -0.07 0.00 -1.18 0.00 0.00 61.69 58.89 3duz s THR 221 Cb -0.01 -2.92 0.05 0.00 1.34 0.00 0.00 72.50 70.95 3duz s THR 221 CO 0.08 -0.16 0.32 -0.60 -0.54 0.00 0.00 174.62 173.71 3duz s ARG 222 N -3.11 0.29 -0.15 3.99 3.52 0.41 -4.99 118.95 118.90 3duz s ARG 222 Ca 0.28 0.64 -0.07 0.00 -0.13 0.00 0.00 55.73 56.46 3duz s ARG 222 Cb -0.09 -0.08 -0.04 0.00 -1.56 0.00 0.00 34.95 33.18 3duz s ARG 222 CO 0.19 -0.16 0.09 -0.65 -0.81 0.00 0.00 175.30 173.96 3duz s GLN 223 N 1.31 3.64 0.10 5.12 -1.52 -1.26 -0.44 119.66 126.62 3duz s GLN 223 Ca -0.09 -0.26 0.01 0.00 -1.95 0.00 0.00 55.36 53.06 3duz s GLN 223 Cb -0.09 -3.16 -0.04 0.00 -0.22 0.00 0.00 33.01 29.49 3duz s GLN 223 CO -0.10 0.53 -0.04 0.96 -0.25 0.00 0.00 175.29 176.39 3duz s ILE 224 N -0.35 0.56 -0.18 1.08 -4.36 -0.15 -5.00 121.20 112.80 3duz s ILE 224 Ca 0.10 -1.92 -0.03 0.00 -0.26 0.00 0.00 60.65 58.54 3duz s ILE 224 Cb -0.12 -1.75 -0.02 0.00 1.25 0.00 0.00 42.46 41.83 3duz s ILE 224 CO 0.01 -0.81 -0.05 -0.54 0.24 0.00 0.00 174.94 173.80 3duz s LYS 225 N -3.88 3.49 0.11 0.37 1.02 -1.26 -0.64 119.74 118.96 3duz s LYS 225 Ca 0.14 -0.59 0.05 0.00 0.02 0.00 0.00 55.97 55.58 3duz s LYS 225 Cb 0.06 -2.91 -0.04 0.00 -0.52 0.00 0.00 37.83 34.42 3duz s LYS 225 CO -0.04 0.04 -0.12 0.00 -0.92 0.00 0.00 175.35 174.31 3duz s ALA 226 N 0.87 1.29 -0.14 5.17 0.00 0.57 -4.76 121.76 124.75 3duz s ALA 226 Ca -0.01 -1.24 -0.26 0.00 0.00 0.00 0.00 51.96 50.45 3duz s ALA 226 Cb -0.15 -0.02 -0.02 0.00 0.00 0.00 0.00 23.12 22.94 3duz s ALA 226 CO 0.01 0.03 0.87 0.00 0.00 0.00 0.00 175.76 176.67 3duz s ALA 227 N -2.30 3.47 -0.03 0.00 0.00 -1.26 -0.27 121.76 121.37 3duz s ALA 227 Ca 0.07 0.14 0.06 0.00 0.00 0.00 0.00 51.96 52.23 3duz s ALA 227 Cb -0.04 -3.27 -0.01 0.00 0.00 0.00 0.00 23.12 19.80 3duz s ALA 227 CO 0.01 -0.60 -0.23 0.00 0.00 0.00 0.00 175.76 174.95 3duz s LEU 229 N -0.35 4.15 -0.01 0.00 2.96 0.14 -1.00 118.68 124.58 3duz s LEU 229 Ca 0.04 0.64 0.03 0.00 -0.22 0.00 0.00 54.13 54.61 3duz s LEU 229 Cb -0.11 -2.65 -0.03 0.00 0.50 0.00 0.00 46.19 43.90 3duz s LEU 229 CO 0.01 -0.14 -0.05 -0.76 -1.32 0.00 0.00 176.35 174.08 3duz s LEU 230 N 1.50 3.25 -0.06 -0.68 1.02 0.13 -1.22 118.68 122.61 3duz s LEU 230 Ca 0.23 -0.10 0.01 0.00 0.02 0.00 0.00 54.13 54.29 3duz s LEU 230 Cb -0.15 -1.84 0.02 0.00 0.02 0.00 0.00 46.19 44.23 3duz s LEU 230 CO 0.09 0.29 -0.08 -0.63 0.02 0.00 0.00 176.35 176.04 3duz s ILE 231 N -0.99 0.86 -0.57 -0.59 1.01 -0.50 -0.74 121.20 119.67 3duz s ILE 231 Ca 0.17 -0.30 0.06 0.00 0.00 0.00 0.00 60.65 60.58 3duz s ILE 231 Cb -0.11 -0.83 0.22 0.00 0.01 0.00 0.00 42.46 41.75 3duz s ILE 231 CO 0.07 0.30 0.57 0.29 0.00 0.00 0.00 174.94 176.18 3duz n LYS 232 N 4.04 1.63 -0.56 2.79 5.02 -0.98 -0.71 118.16 129.39 3duz n LYS 232 Ca -0.22 -4.11 0.04 0.00 -2.02 0.00 0.00 58.31 52.00 3duz n LYS 232 Cb 0.51 -1.96 0.24 0.00 -0.02 0.00 0.00 35.03 33.80 3duz n LYS 232 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3duz n ASP 233 N 1.55 3.53 -4.48 4.39 5.68 -1.26 -4.89 116.55 121.07 3duz n ASP 233 Ca 0.25 -3.23 -0.43 0.00 -0.50 0.00 0.00 54.79 50.88 3duz n ASP 233 Cb 0.43 -0.58 -0.05 0.00 -1.14 0.00 0.00 41.12 39.78 3duz n ASP 233 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3duz s ASP 234 N -2.06 6.28 0.46 -1.12 2.15 -1.26 -4.93 116.67 116.18 3duz s ASP 234 Ca 0.43 -0.66 0.13 0.00 0.43 0.00 0.00 52.55 52.89 3duz s ASP 234 Cb 0.36 -2.37 1.08 0.00 -0.30 0.00 0.00 42.92 41.69 3duz s ASP 234 CO 0.07 -1.08 2.05 0.11 -0.17 0.00 0.00 175.17 176.15 3duz h LYS 235 N 9.17 0.30 -0.17 4.34 1.57 -1.99 -1.21 116.57 128.58 3duz h LYS 235 Ca -0.27 -0.02 -0.21 0.00 -1.87 0.00 0.00 60.65 58.28 3duz h LYS 235 Cb 1.08 -0.07 0.01 0.00 0.08 0.00 0.00 32.23 33.33 3duz h LYS 235 CO 1.04 0.20 -0.73 -0.91 -0.57 0.00 0.00 179.45 178.47 3duz h ASN 236 N 0.31 0.88 -2.95 0.86 2.35 -2.01 -3.38 115.58 111.64 3duz h ASN 236 Ca 0.16 -0.55 -0.62 0.00 -0.55 0.00 0.00 56.30 54.74 3duz h ASN 236 Cb 0.26 -0.26 -0.42 0.00 0.05 0.00 0.00 38.32 37.95 3duz h ASN 236 CO -0.03 1.34 -0.56 0.59 -1.65 0.00 0.00 177.43 177.12 3duz n ASN 237 N -3.93 3.21 0.00 5.81 3.02 -0.48 -4.96 115.26 117.93 3duz n ASN 237 Ca -0.06 -3.25 0.01 0.00 -0.03 0.00 0.00 54.58 51.24 3duz n ASN 237 Cb 0.72 -0.76 0.07 0.00 -0.61 0.00 0.00 39.78 39.20 3duz n ASN 237 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 3duz n PRO 238 N 1.78 0.32 -0.00 3.52 -0.02 -1.08 -1.50 135.00 138.01 3duz n PRO 238 Ca 0.22 0.00 0.01 0.00 -2.02 0.00 0.00 63.50 61.70 3duz n PRO 238 Cb 0.36 -1.11 -0.01 0.00 -0.02 0.00 0.00 33.50 32.72 3duz n PRO 238 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3duz n GLU 239 N -0.61 0.13 -1.86 -0.52 -0.58 -1.26 -4.97 120.64 110.97 3duz n GLU 239 Ca 0.02 -0.01 -0.41 0.00 -0.42 0.00 0.00 57.16 56.33 3duz n GLU 239 Cb 0.01 -1.03 -0.01 0.00 -0.57 0.00 0.00 31.44 29.83 3duz n GLU 239 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 3duz s SER 240 N -2.17 6.45 -0.69 1.62 0.15 -0.57 -4.97 113.70 113.53 3duz s SER 240 Ca -0.00 2.91 -0.16 0.00 0.70 0.00 0.00 55.95 59.39 3duz s SER 240 Cb 0.01 -2.65 0.16 0.00 -1.71 0.00 0.00 66.02 61.83 3duz s SER 240 CO 0.05 -0.82 0.69 -0.69 1.20 0.00 0.00 173.24 173.67 3duz s VAL 241 N -0.49 5.25 0.26 4.45 1.01 -1.26 -4.45 120.40 125.16 3duz s VAL 241 Ca 0.58 -1.77 0.06 0.00 0.00 0.00 0.00 61.98 60.84 3duz s VAL 241 Cb -0.45 -4.46 -0.01 0.00 0.00 0.00 0.00 36.38 31.46 3duz s VAL 241 CO 0.53 -1.04 1.62 0.71 0.00 0.00 0.00 175.10 176.92 3duz h THR 242 N 5.47 1.36 -3.28 3.92 1.35 -1.29 -3.44 112.91 117.00 3duz h THR 242 Ca -0.11 -1.81 -0.18 0.00 -0.55 0.00 0.00 66.41 63.76 3duz h THR 242 Cb 1.07 1.90 -0.26 0.00 -1.73 0.00 0.00 68.15 69.12 3duz h THR 242 CO 0.95 0.54 -0.50 -0.13 -0.25 0.00 0.00 175.52 176.12 3duz s ARG 243 N -3.89 0.22 -0.08 4.72 0.52 -1.21 -4.94 118.95 114.29 3duz s ARG 243 Ca -0.04 0.26 0.01 0.00 -0.52 0.00 0.00 55.73 55.44 3duz s ARG 243 Cb 0.13 0.10 0.02 0.00 0.52 0.00 0.00 34.95 35.71 3duz s ARG 243 CO 0.78 -0.03 -0.09 -2.00 0.02 0.00 0.00 175.30 173.99 3duz s GLU 244 N 0.13 1.43 -0.14 3.54 2.12 -1.26 -1.41 118.70 123.11 3duz s GLU 244 Ca -0.00 -0.28 -0.02 0.00 0.36 0.00 0.00 54.97 55.03 3duz s GLU 244 Cb -0.02 -1.34 -0.02 0.00 0.26 0.00 0.00 34.13 33.01 3duz s GLU 244 CO 0.00 -0.11 -0.09 -1.01 -0.54 0.00 0.00 175.26 173.52 3duz s HIS 245 N 1.13 2.91 -0.01 5.30 3.76 -0.36 -0.78 115.29 127.25 3duz s HIS 245 Ca -0.06 -0.48 0.06 0.00 -0.15 0.00 0.00 55.06 54.43 3duz s HIS 245 Cb -0.14 -1.90 -0.02 0.00 1.11 0.00 0.00 32.58 31.63 3duz s HIS 245 CO -0.01 -0.13 -0.19 0.00 -0.85 0.00 0.00 174.74 173.56 3duz s LEU 247 N -0.52 3.86 -0.34 0.00 1.43 -0.71 -0.88 118.68 121.52 3duz s LEU 247 Ca 0.07 0.60 -0.03 0.00 -1.03 0.00 0.00 54.13 53.73 3duz s LEU 247 Cb -0.07 -3.42 0.07 0.00 0.03 0.00 0.00 46.19 42.79 3duz s LEU 247 CO -0.01 -1.03 0.09 -0.63 0.23 0.00 0.00 176.35 175.01 3duz s ILE 248 N 3.90 3.31 -1.07 -0.59 1.09 -0.08 -4.41 121.20 123.35 3duz s ILE 248 Ca 0.43 -1.51 -0.20 0.00 -1.10 0.00 0.00 60.65 58.27 3duz s ILE 248 Cb -0.10 -3.01 0.01 0.00 -1.06 0.00 0.00 42.46 38.30 3duz s ILE 248 CO 0.23 -0.31 0.72 0.47 -0.10 0.00 0.00 174.94 175.96 3duz n ASP 249 N 4.67 -5.10 -3.26 3.58 8.00 -1.26 -1.87 116.55 121.32 3duz n ASP 249 Ca -0.10 -1.02 -0.23 0.00 0.71 0.00 0.00 54.79 54.15 3duz n ASP 249 Cb 0.43 -2.71 0.02 0.00 -0.02 0.00 0.00 41.12 38.84 3duz n ASP 249 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3duz n ASN 250 N -2.44 -4.85 -3.76 -2.24 5.03 -1.26 -4.66 115.26 101.08 3duz n ASN 250 Ca -0.13 -0.37 -0.13 0.00 0.87 0.00 0.00 54.58 54.81 3duz n ASN 250 Cb 0.59 -3.95 -0.14 0.00 -1.02 0.00 0.00 39.78 35.26 3duz n ASN 250 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3duz s ASP 251 N -2.76 -0.12 0.00 6.41 2.15 -0.78 -1.19 116.67 120.38 3duz s ASP 251 Ca 0.38 0.30 -0.17 0.00 0.43 0.00 0.00 52.55 53.49 3duz s ASP 251 Cb -0.19 0.21 -0.06 0.00 -0.30 0.00 0.00 42.92 42.59 3duz s ASP 251 CO 0.47 -0.13 0.48 -0.51 -0.17 0.00 0.00 175.17 175.31 3duz s ILE 252 N 0.94 4.96 0.02 4.11 1.10 -1.26 -0.91 121.20 130.16 3duz s ILE 252 Ca -0.07 0.99 0.02 0.00 -0.51 0.00 0.00 60.65 61.08 3duz s ILE 252 Cb -0.09 -3.80 -0.02 0.00 0.15 0.00 0.00 42.46 38.71 3duz s ILE 252 CO -0.05 0.52 -0.08 -0.31 -2.11 0.00 0.00 174.94 172.92 3duz s TYR 253 N -0.76 0.67 -0.29 3.50 2.02 -0.06 -4.94 117.35 117.48 3duz s TYR 253 Ca 0.26 -0.32 -0.23 0.00 -0.37 0.00 0.00 57.07 56.41 3duz s TYR 253 Cb -0.17 -0.41 -0.00 0.00 -0.40 0.00 0.00 41.96 40.98 3duz s TYR 253 CO 0.15 -0.04 0.75 0.34 -1.57 0.00 0.00 175.55 175.18 3duz s ASP 254 N -0.96 6.65 -0.13 2.29 2.15 -1.26 0.05 116.67 125.46 3duz s ASP 254 Ca -0.04 0.68 0.17 0.00 0.43 0.00 0.00 52.55 53.79 3duz s ASP 254 Cb -0.07 -2.39 0.43 0.00 -0.30 0.00 0.00 42.92 40.59 3duz s ASP 254 CO 0.00 -0.56 1.20 0.18 -0.17 0.00 0.00 175.17 175.82 3duz n LEU 255 N 6.08 2.09 0.20 -1.34 4.77 0.04 -4.86 117.00 123.99 3duz n LEU 255 Ca 0.03 -3.17 -0.12 0.00 -0.03 0.00 0.00 56.01 52.71 3duz n LEU 255 Cb 0.48 -0.29 -0.07 0.00 -2.33 0.00 0.00 43.42 41.21 3duz n LEU 255 CO 0.48 1.07 0.52 0.77 -1.33 0.00 0.00 177.39 178.90 3duz h SER 256 N 1.07 -0.94 -2.79 -1.43 4.64 -1.89 -3.40 113.55 108.81 3duz h SER 256 Ca -0.08 0.08 -0.54 0.00 -0.47 0.00 0.00 61.79 60.77 3duz h SER 256 Cb 1.37 0.31 0.07 0.00 -0.31 0.00 0.00 62.40 63.84 3duz h SER 256 CO 0.07 -0.46 0.88 0.29 -0.87 0.00 0.00 176.83 176.74 3duz n LYS 257 N -4.47 2.55 -0.74 4.77 5.02 -1.26 -4.85 118.16 119.17 3duz n LYS 257 Ca -0.08 0.91 -0.01 0.00 -2.02 0.00 0.00 58.31 57.11 3duz n LYS 257 Cb 0.31 -2.70 0.26 0.00 -0.02 0.00 0.00 35.03 32.88 3duz n LYS 257 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3duz n ASN 258 N 3.04 4.29 -4.85 4.39 6.94 -1.26 -4.88 115.26 122.93 3duz n ASN 258 Ca 0.13 -2.83 -0.30 0.00 -0.02 0.00 0.00 54.58 51.57 3duz n ASN 258 Cb 0.34 -0.67 0.08 0.00 -2.36 0.00 0.00 39.78 37.17 3duz n ASN 258 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 3duz s THR 259 N -2.35 2.93 0.31 5.53 -4.23 -1.26 -4.85 115.64 111.72 3duz s THR 259 Ca 0.41 0.30 -0.30 0.00 -1.18 0.00 0.00 61.69 60.93 3duz s THR 259 Cb 0.32 -3.19 -0.11 0.00 1.34 0.00 0.00 72.50 70.86 3duz s THR 259 CO 0.11 -0.40 1.57 0.26 -0.54 0.00 0.00 174.62 175.63 3duz s TRP 260 N -3.32 2.71 -0.31 3.99 0.52 -1.26 -4.79 118.94 116.48 3duz s TRP 260 Ca 0.60 0.86 -0.07 0.00 0.02 0.00 0.00 56.10 57.52 3duz s TRP 260 Cb -0.13 -4.07 0.02 0.00 -1.15 0.00 0.00 33.47 28.15 3duz s TRP 260 CO 0.52 -3.48 0.09 1.21 0.02 0.00 0.00 176.95 175.31 3duz s ASN 261 N 0.35 5.17 -0.07 2.95 3.84 0.86 -4.96 114.94 123.08 3duz s ASN 261 Ca 0.61 -0.86 0.03 0.00 0.21 0.00 0.00 52.86 52.84 3duz s ASN 261 Cb -0.48 -1.87 0.01 0.00 -0.55 0.00 0.00 41.25 38.36 3duz s ASN 261 CO 0.52 -0.24 -0.15 0.00 -2.79 0.00 0.00 177.10 174.44 3duz s LYS 263 N 0.60 0.15 2.93 0.00 -0.14 -0.88 -5.03 119.74 117.37 3duz s LYS 263 Ca -0.15 0.21 0.00 0.00 -1.36 0.00 0.00 55.97 54.67 3duz s LYS 263 Cb -0.16 0.05 0.00 0.00 -1.68 0.00 0.00 37.83 36.03 3duz s LYS 263 CO 0.05 -0.04 0.00 1.19 -0.76 0.00 0.00 175.35 175.79 3duz n PHE 264 N 3.15 0.00 -0.01 3.18 3.72 -1.26 -1.58 117.46 124.66 3duz n PHE 264 Ca -0.14 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.35 3duz n PHE 264 Cb 0.58 0.00 0.21 0.00 -0.94 0.00 0.00 39.48 39.33 3duz n PHE 264 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 3duz n ASN 265 N 6.57 3.29 -4.13 4.37 6.94 -1.26 -0.95 115.26 130.08 3duz n ASN 265 Ca 0.00 -1.94 -0.20 0.00 -0.02 0.00 0.00 54.58 52.42 3duz n ASN 265 Cb 0.00 -0.28 -0.13 0.00 -2.36 0.00 0.00 39.78 37.00 3duz n ASN 265 CO 0.00 0.00 0.00 -0.60 -1.03 0.00 0.00 177.26 175.63 3duz s ARG 266 N -1.15 0.90 -0.02 -3.83 3.52 -0.61 -1.54 118.95 116.22 3duz s ARG 266 Ca 0.34 -0.73 0.04 0.00 -0.13 0.00 0.00 55.73 55.25 3duz s ARG 266 Cb 0.19 -0.90 -0.01 0.00 -1.56 0.00 0.00 34.95 32.68 3duz s ARG 266 CO 0.26 0.22 -0.14 0.00 -0.81 0.00 0.00 175.30 174.82 3duz s ILE 268 N -0.13 0.96 -0.14 0.00 1.01 0.78 -0.23 121.20 123.44 3duz s ILE 268 Ca 0.01 -0.61 -0.13 0.00 0.00 0.00 0.00 60.65 59.93 3duz s ILE 268 Cb -0.08 -0.82 0.04 0.00 0.01 0.00 0.00 42.46 41.61 3duz s ILE 268 CO 0.00 0.20 0.38 -0.75 0.00 0.00 0.00 174.94 174.78 3duz s LYS 269 N -0.46 0.44 0.01 2.79 2.20 -0.77 -0.10 119.74 123.84 3duz s LYS 269 Ca 0.04 0.54 -0.30 0.00 -0.36 0.00 0.00 55.97 55.89 3duz s LYS 269 Cb -0.05 0.20 -0.07 0.00 -1.51 0.00 0.00 37.83 36.40 3duz s LYS 269 CO -0.00 -0.06 1.67 1.03 -0.36 0.00 0.00 175.35 177.63 3duz s ARG 270 N 0.28 4.19 -0.45 4.03 0.52 -1.26 -0.82 118.95 125.43 3duz s ARG 270 Ca -0.01 2.28 -0.04 0.00 -0.52 0.00 0.00 55.73 57.45 3duz s ARG 270 Cb -0.03 -3.82 -0.15 0.00 0.52 0.00 0.00 34.95 31.47 3duz s ARG 270 CO -0.00 -0.80 1.41 1.17 0.02 0.00 0.00 175.30 177.10 3duz n LYS 271 N 6.44 0.00 -3.82 3.54 4.81 -0.64 -4.90 118.16 123.58 3duz n LYS 271 Ca 0.17 0.00 -0.25 0.00 -0.87 0.00 0.00 58.31 57.35 3duz n LYS 271 Cb 0.42 -0.90 -0.17 0.00 0.02 0.00 0.00 35.03 34.40 3duz n LYS 271 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 3duz s ARG 288 N 5.38 0.99 0.50 1.64 0.52 -1.26 -5.03 118.95 121.70 3duz s ARG 288 Ca 0.59 -0.16 0.06 0.00 -0.52 0.00 0.00 55.73 55.70 3duz s ARG 288 Cb -0.38 -1.46 0.01 0.00 0.52 0.00 0.00 34.95 33.64 3duz s ARG 288 CO 0.26 -0.36 0.36 0.00 0.02 0.00 0.00 175.30 175.58 3duz s ALA 289 N 1.83 4.23 -0.16 2.13 0.00 -1.26 -4.96 121.76 123.58 3duz s ALA 289 Ca 0.04 -1.50 -0.29 0.00 0.00 0.00 0.00 51.96 50.21 3duz s ALA 289 Cb -0.13 -0.72 -0.04 0.00 0.00 0.00 0.00 23.12 22.22 3duz s ALA 289 CO -0.07 -0.36 1.70 0.21 0.00 0.00 0.00 175.76 177.24 3duz s LYS 290 N -4.19 3.86 0.59 0.00 2.20 -1.26 -4.65 119.74 116.28 3duz s LYS 290 Ca 0.37 1.89 -0.16 0.00 -0.36 0.00 0.00 55.97 57.71 3duz s LYS 290 Cb -0.01 -4.06 -0.04 0.00 -1.51 0.00 0.00 37.83 32.21 3duz s LYS 290 CO 0.22 -1.23 1.06 0.71 -0.36 0.00 0.00 175.35 175.76 3duz s TYR 291 N 5.13 2.96 0.00 4.03 1.51 -0.43 -4.97 117.35 125.58 3duz s TYR 291 Ca 0.75 1.52 0.00 0.00 -1.01 0.00 0.00 57.07 58.33 3duz s TYR 291 Cb -0.29 -3.03 0.00 0.00 -0.11 0.00 0.00 41.96 38.53 3duz s TYR 291 CO 0.31 -1.14 0.00 -2.37 -1.11 0.00 0.00 175.55 171.24 3duz n THR 292 N -1.94 0.00 0.17 -0.71 5.66 -1.26 -4.59 114.28 111.61 3duz n THR 292 Ca 0.09 -0.06 0.05 0.00 -3.05 0.00 0.00 64.05 61.09 3duz n THR 292 Cb 0.53 0.42 0.52 0.00 -1.55 0.00 0.00 70.33 70.25 3duz n THR 292 CO 0.00 0.00 0.00 1.05 -3.05 0.00 0.00 175.07 173.07 3duz h GLU 293 N 0.00 0.16 -0.44 1.09 9.09 -1.98 -2.08 114.58 120.42 3duz h GLU 293 Ca 0.00 -0.02 0.00 0.00 0.05 0.00 0.00 59.36 59.39 3duz h GLU 293 Cb 0.00 -0.03 0.00 0.00 -1.65 0.00 0.00 28.75 27.07 3duz h GLU 293 CO 0.00 0.19 0.00 0.41 0.05 0.00 0.00 179.01 179.66 3duz n GLY 294 N -1.29 0.81 3.78 1.06 0.00 -1.26 -4.88 105.19 103.41 3duz n GLY 294 Ca -0.01 -0.32 -0.33 0.00 0.00 0.00 0.00 46.02 45.36 3duz n GLY 294 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3duz s ASP 295 N -0.80 5.39 0.07 1.61 1.01 -0.79 -1.39 116.67 121.77 3duz s ASP 295 Ca 0.19 1.97 -0.31 0.00 0.71 0.00 0.00 52.55 55.12 3duz s ASP 295 Cb 0.12 -2.55 -0.06 0.00 1.01 0.00 0.00 42.92 41.43 3duz s ASP 295 CO 0.11 -1.44 1.25 0.42 0.21 0.00 0.00 175.17 175.72 3duz s THR 296 N -2.29 3.86 0.52 -1.27 -4.23 -1.26 -4.92 115.64 106.04 3duz s THR 296 Ca 0.67 1.32 -0.12 0.00 -1.18 0.00 0.00 61.69 62.38 3duz s THR 296 Cb -0.20 -3.85 -0.06 0.00 1.34 0.00 0.00 72.50 69.74 3duz s THR 296 CO 0.38 0.09 0.93 0.00 -0.54 0.00 0.00 174.62 175.48 3duz s ALA 297 N 1.17 3.18 -0.02 3.99 0.00 -1.26 -5.08 121.76 123.75 3duz s ALA 297 Ca 0.60 -0.07 -0.01 0.00 0.00 0.00 0.00 51.96 52.48 3duz s ALA 297 Cb -0.31 -2.95 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 3duz s ALA 297 CO 0.29 -0.33 0.08 0.95 0.00 0.00 0.00 175.76 176.74 3duz s THR 298 N -2.75 4.74 0.34 0.00 -4.23 -1.26 -5.00 115.64 107.49 3duz s THR 298 Ca 0.55 -0.35 0.13 0.00 -1.18 0.00 0.00 61.69 60.83 3duz s THR 298 Cb -0.10 -3.15 0.33 0.00 1.34 0.00 0.00 72.50 70.92 3duz s THR 298 CO 0.40 0.39 1.72 0.50 -0.54 0.00 0.00 174.62 177.09 3duz h LYS 299 N 4.25 0.47 -0.86 3.99 3.64 -1.99 -1.61 116.57 124.46 3duz h LYS 299 Ca -0.50 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 58.83 3duz h LYS 299 Cb 1.19 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 32.86 3duz h LYS 299 CO 0.61 0.31 0.44 0.78 -2.27 0.00 0.00 179.45 179.32 3duz h GLY 300 N 0.48 1.31 1.96 5.01 0.00 -1.99 -1.28 103.07 108.56 3duz h GLY 300 Ca 0.66 -0.63 -0.16 0.00 0.00 0.00 0.00 47.33 47.21 3duz h GLY 300 CO -0.47 0.60 -0.75 -0.55 0.00 0.00 0.00 176.54 175.37 3duz h ASP 301 N 1.22 0.04 -0.19 0.19 3.32 -1.72 -2.64 116.42 116.64 3duz h ASP 301 Ca 0.30 -0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.34 3duz h ASP 301 Cb 0.08 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 3duz h ASP 301 CO -0.04 0.78 0.04 -0.07 -1.72 0.00 0.00 179.24 178.22 3duz h LEU 302 N 0.02 0.01 -1.46 1.55 -0.00 -1.14 -2.17 115.31 112.12 3duz h LEU 302 Ca -0.01 0.03 -0.04 0.00 -0.00 0.00 0.00 57.88 57.85 3duz h LEU 302 Cb 1.32 0.04 -0.01 0.00 -0.00 0.00 0.00 40.66 42.01 3duz h LEU 302 CO 0.10 0.03 -0.10 0.24 -0.00 0.00 0.00 178.44 178.71 3duz h MET 303 N 0.11 0.23 -0.18 1.13 2.86 -1.09 0.17 114.93 118.16 3duz h MET 303 Ca 0.08 -0.05 -0.13 0.00 -2.06 0.00 0.00 59.70 57.54 3duz h MET 303 Cb 0.08 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.71 3duz h MET 303 CO -0.11 0.34 -0.42 1.25 1.06 0.00 0.00 176.91 179.03 3duz h HIS 304 N 0.22 0.76 -0.83 -0.22 -0.00 -1.34 -0.52 115.15 113.20 3duz h HIS 304 Ca 0.05 -0.29 0.10 0.00 -0.00 0.00 0.00 60.37 60.23 3duz h HIS 304 Cb 0.32 -0.14 -0.06 0.00 -0.00 0.00 0.00 27.41 27.54 3duz h HIS 304 CO 0.00 1.05 0.54 0.82 -0.00 0.00 0.00 177.93 180.34 3duz h ILE 305 N 0.25 0.95 -0.46 6.26 1.08 -0.72 0.84 117.51 125.71 3duz h ILE 305 Ca -0.00 -0.27 -0.04 0.00 -0.39 0.00 0.00 64.86 64.16 3duz h ILE 305 Cb 1.03 0.10 -0.02 0.00 -3.07 0.00 0.00 36.82 34.85 3duz h ILE 305 CO 0.09 0.14 0.13 -0.61 -0.69 0.00 0.00 178.15 177.22 3duz h GLN 306 N 0.78 0.73 -0.57 2.37 5.75 -0.30 -1.41 115.11 122.46 3duz h GLN 306 Ca 0.39 -0.16 -0.07 0.00 -0.15 0.00 0.00 58.65 58.65 3duz h GLN 306 Cb 0.45 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 28.87 3duz h GLN 306 CO -0.16 0.70 0.07 1.49 -2.65 0.00 0.00 178.83 178.29 3duz h GLU 307 N 0.61 0.94 -0.38 1.69 4.57 -0.28 -0.84 114.58 120.89 3duz h GLU 307 Ca 0.15 -0.24 -0.00 0.00 -1.18 0.00 0.00 59.36 58.08 3duz h GLU 307 Cb 0.29 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.74 3duz h GLU 307 CO -0.00 0.88 0.22 0.93 -1.18 0.00 0.00 179.01 179.86 3duz h GLU 308 N 0.88 0.51 0.09 1.92 5.08 -0.62 0.24 114.58 122.69 3duz h GLU 308 Ca 0.18 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.49 3duz h GLU 308 Cb 0.42 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.56 3duz h GLU 308 CO 0.01 0.37 -0.05 1.25 -1.00 0.00 0.00 179.01 179.60 3duz h LEU 309 N 0.52 -0.11 -0.65 1.33 7.12 -0.72 -0.77 115.31 122.03 3duz h LEU 309 Ca 0.14 -0.47 0.13 0.00 0.13 0.00 0.00 57.88 57.81 3duz h LEU 309 Cb -0.00 0.03 -0.12 0.00 -0.53 0.00 0.00 40.66 40.03 3duz h LEU 309 CO -0.02 0.47 -0.18 0.24 -0.13 0.00 0.00 178.44 178.82 3duz h MET 310 N -0.75 -0.01 -0.41 1.25 2.86 -0.98 -0.07 114.93 116.83 3duz h MET 310 Ca -0.01 0.00 0.04 0.00 -2.06 0.00 0.00 59.70 57.67 3duz h MET 310 Cb 0.57 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.19 3duz h MET 310 CO 0.02 -0.01 0.18 -0.92 1.06 0.00 0.00 176.91 177.25 3duz h TYR 311 N -0.01 0.33 -0.95 -0.22 3.20 -0.45 -1.76 116.97 117.11 3duz h TYR 311 Ca 0.31 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.21 3duz h TYR 311 Cb 0.49 -0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.62 3duz h TYR 311 CO -0.54 0.16 0.63 0.93 -1.64 0.00 0.00 178.16 177.70 3duz h GLU 312 N 0.37 1.26 0.04 1.82 4.39 0.36 0.46 114.58 123.29 3duz h GLU 312 Ca 0.18 -0.08 -0.00 0.00 0.34 0.00 0.00 59.36 59.80 3duz h GLU 312 Cb 0.12 -0.28 0.00 0.00 -0.10 0.00 0.00 28.75 28.48 3duz h GLU 312 CO -0.15 0.84 -0.02 -0.97 -1.16 0.00 0.00 179.01 177.55 3duz h ASN 313 N 1.29 -0.05 0.47 1.42 -0.73 -0.68 0.26 115.58 117.57 3duz h ASN 313 Ca 0.35 -0.07 -0.04 0.00 1.87 0.00 0.00 56.30 58.41 3duz h ASN 313 Cb -0.15 0.01 -0.01 0.00 0.27 0.00 0.00 38.32 38.45 3duz h ASN 313 CO -0.07 0.03 -0.20 0.44 -0.37 0.00 0.00 177.43 177.26 3duz h ASP 314 N -0.13 0.00 -0.13 1.15 3.32 -0.88 -1.44 116.42 118.31 3duz h ASP 314 Ca -0.01 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.82 3duz h ASP 314 Cb 0.11 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.67 3duz h ASP 314 CO 0.01 0.20 -0.79 0.25 -1.72 0.00 0.00 179.24 177.19 3duz h LEU 315 N 0.00 0.93 -0.49 1.55 5.85 0.39 -2.16 115.31 121.38 3duz h LEU 315 Ca -0.00 -0.61 0.01 0.00 0.84 0.00 0.00 57.88 58.11 3duz h LEU 315 Cb 0.49 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 3duz h LEU 315 CO 0.03 1.41 0.32 0.25 -0.34 0.00 0.00 178.44 180.11 3duz h LEU 316 N 0.53 0.55 -0.31 2.25 7.12 -0.01 -2.62 115.31 122.83 3duz h LEU 316 Ca -0.05 -0.01 -0.04 0.00 0.13 0.00 0.00 57.88 57.90 3duz h LEU 316 Cb 1.41 -0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 41.40 3duz h LEU 316 CO 0.16 0.40 0.03 0.50 -0.13 0.00 0.00 178.44 179.39 3duz h LYS 317 N 0.65 0.52 0.15 1.25 3.64 -1.24 -1.11 116.57 120.44 3duz h LYS 317 Ca 0.18 -0.15 0.01 0.00 -1.27 0.00 0.00 60.65 59.42 3duz h LYS 317 Cb -0.06 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 3duz h LYS 317 CO -0.05 0.64 -0.17 1.98 -2.27 0.00 0.00 179.45 179.58 3duz h MET 318 N 0.33 -0.35 -0.32 1.90 4.05 -1.37 -1.28 114.93 117.89 3duz h MET 318 Ca 0.09 0.02 -0.12 0.00 -0.28 0.00 0.00 59.70 59.42 3duz h MET 318 Cb 0.39 0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 31.26 3duz h MET 318 CO 0.01 -0.24 -0.27 -0.91 0.23 0.00 0.00 176.91 175.74 3duz h ASN 319 N -0.37 0.79 -0.54 1.39 2.35 -1.41 0.23 115.58 118.02 3duz h ASN 319 Ca 0.01 -0.45 0.07 0.00 -0.55 0.00 0.00 56.30 55.38 3duz h ASN 319 Cb 0.36 -0.22 -0.06 0.00 0.05 0.00 0.00 38.32 38.45 3duz h ASN 319 CO -0.06 1.07 0.21 0.40 -1.65 0.00 0.00 177.43 177.40 3duz h ILE 320 N 0.51 0.83 -0.05 2.81 1.08 -1.20 -0.98 117.51 120.50 3duz h ILE 320 Ca 0.06 -0.14 -0.17 0.00 -0.39 0.00 0.00 64.86 64.22 3duz h ILE 320 Cb 0.83 0.40 -0.01 0.00 -3.07 0.00 0.00 36.82 34.97 3duz h ILE 320 CO 0.07 0.07 -0.71 -0.33 -0.69 0.00 0.00 178.15 176.57 3duz h GLU 321 N 0.40 0.26 -0.32 2.37 4.39 -0.88 0.73 114.58 121.53 3duz h GLU 321 Ca 0.26 -0.21 -0.03 0.00 0.34 0.00 0.00 59.36 59.72 3duz h GLU 321 Cb 0.28 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.96 3duz h GLU 321 CO -0.25 0.86 0.07 1.25 -1.16 0.00 0.00 179.01 179.78 3duz h LEU 322 N 0.18 0.43 -0.00 1.33 5.85 -0.19 -0.77 115.31 122.13 3duz h LEU 322 Ca -0.02 -0.06 -0.14 0.00 0.84 0.00 0.00 57.88 58.50 3duz h LEU 322 Cb 1.26 -0.11 0.01 0.00 0.37 0.00 0.00 40.66 42.19 3duz h LEU 322 CO 0.11 0.44 -0.55 -0.03 -0.34 0.00 0.00 178.44 178.07 3duz h MET 323 N 0.46 0.38 -0.51 1.25 4.05 -0.82 -3.00 114.93 116.74 3duz h MET 323 Ca 0.11 -0.40 0.10 0.00 -0.28 0.00 0.00 59.70 59.23 3duz h MET 323 Cb 0.20 0.11 -0.10 0.00 -0.80 0.00 0.00 31.60 31.01 3duz h MET 323 CO -0.00 1.08 -0.25 1.25 0.23 0.00 0.00 176.91 179.21 3duz h HIS 324 N -0.16 -0.66 -0.55 1.39 -0.00 -0.54 -1.63 115.15 113.00 3duz h HIS 324 Ca -0.07 0.06 -0.01 0.00 -0.00 0.00 0.00 60.37 60.35 3duz h HIS 324 Cb 1.27 0.37 -0.03 0.00 -0.00 0.00 0.00 27.41 29.02 3duz h HIS 324 CO 0.15 -0.33 0.30 0.00 -0.00 0.00 0.00 177.93 178.05 3duz h ALA 325 N 1.15 0.71 -0.24 5.26 0.00 -1.22 -1.74 119.26 123.18 3duz h ALA 325 Ca 0.23 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.05 3duz h ALA 325 Cb 0.50 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3duz h ALA 325 CO -0.59 0.23 0.14 1.25 0.00 0.00 0.00 179.25 180.28 3duz h HIS 326 N 0.74 0.26 -0.72 0.00 2.76 -1.29 -1.59 115.15 115.31 3duz h HIS 326 Ca 0.19 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.36 3duz h HIS 326 Cb 0.06 -0.08 -0.03 0.00 1.55 0.00 0.00 27.41 28.90 3duz h HIS 326 CO -0.01 0.16 0.41 0.82 -1.30 0.00 0.00 177.93 178.00 3duz h ILE 327 N 0.29 1.22 -0.79 6.26 2.04 -1.08 -1.41 117.51 124.04 3duz h ILE 327 Ca 0.09 -0.53 0.01 0.00 1.00 0.00 0.00 64.86 65.43 3duz h ILE 327 Cb -0.01 0.25 -0.04 0.00 -0.74 0.00 0.00 36.82 36.28 3duz h ILE 327 CO -0.04 0.24 0.52 0.78 0.00 0.00 0.00 178.15 179.65 3duz h ASN 328 N 0.99 0.90 -0.30 1.72 4.21 -1.00 0.71 115.58 122.81 3duz h ASN 328 Ca 0.26 -0.02 0.05 0.00 1.21 0.00 0.00 56.30 57.79 3duz h ASN 328 Cb 0.02 -0.22 -0.05 0.00 -1.12 0.00 0.00 38.32 36.95 3duz h ASN 328 CO -0.04 0.65 0.02 0.11 -1.29 0.00 0.00 177.43 176.88 3duz h LYS 329 N 1.06 0.11 -0.42 0.81 1.57 -0.73 -1.20 116.57 117.78 3duz h LYS 329 Ca 0.29 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 59.05 3duz h LYS 329 Cb -0.12 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 3duz h LYS 329 CO -0.06 0.07 0.23 1.25 -0.57 0.00 0.00 179.45 180.37 3duz h LEU 330 N 0.11 0.52 -0.86 2.94 5.85 -0.24 -2.06 115.31 121.59 3duz h LEU 330 Ca 0.14 -0.09 0.16 0.00 0.84 0.00 0.00 57.88 58.93 3duz h LEU 330 Cb 0.18 -0.13 -0.10 0.00 0.37 0.00 0.00 40.66 40.98 3duz h LEU 330 CO -0.22 0.46 0.43 -1.13 -0.34 0.00 0.00 178.44 177.64 3duz h ASN 331 N 0.54 0.48 0.69 1.25 -0.73 0.66 -1.59 115.58 116.89 3duz h ASN 331 Ca 0.15 0.10 -0.11 0.00 1.87 0.00 0.00 56.30 58.31 3duz h ASN 331 Cb 0.06 0.04 -0.02 0.00 0.27 0.00 0.00 38.32 38.67 3duz h ASN 331 CO -0.02 0.17 -0.54 0.78 -0.37 0.00 0.00 177.43 177.45 3duz h ASN 332 N 0.57 0.00 -0.37 1.15 2.35 -0.64 -2.46 115.58 116.18 3duz h ASN 332 Ca 0.48 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 56.20 3duz h ASN 332 Cb 0.74 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.09 3duz h ASN 332 CO -0.40 0.54 0.12 0.24 -1.65 0.00 0.00 177.43 176.28 3duz h MET 333 N 0.00 0.58 -0.06 0.81 2.86 -0.65 -2.35 114.93 116.11 3duz h MET 333 Ca -0.01 -0.12 0.02 0.00 -2.06 0.00 0.00 59.70 57.53 3duz h MET 333 Cb 1.03 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 32.60 3duz h MET 333 CO 0.07 0.59 0.07 1.25 1.06 0.00 0.00 176.91 179.95 3duz h LEU 334 N 0.45 0.00 0.05 1.22 7.12 -0.94 -1.11 115.31 122.11 3duz h LEU 334 Ca 0.12 0.00 -0.00 0.00 0.13 0.00 0.00 57.88 58.13 3duz h LEU 334 Cb 0.25 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.38 3duz h LEU 334 CO -0.00 0.00 -0.02 0.45 -0.13 0.00 0.00 178.44 178.73 3duz h HIS 335 N 0.00 -0.06 -0.93 1.25 3.86 -0.99 -1.60 115.15 116.67 3duz h HIS 335 Ca 0.03 -0.00 0.12 0.00 -1.16 0.00 0.00 60.37 59.36 3duz h HIS 335 Cb 0.18 0.02 -0.08 0.00 1.06 0.00 0.00 27.41 28.58 3duz h HIS 335 CO 0.00 0.46 0.56 -0.44 0.86 0.00 0.00 177.93 179.37 3duz h ASP 336 N -0.61 0.79 0.31 2.45 5.19 -0.97 -1.06 116.42 122.51 3duz h ASP 336 Ca -0.01 0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.47 3duz h ASP 336 Cb 0.54 -0.09 -0.03 0.00 0.18 0.00 0.00 39.33 39.93 3duz h ASP 336 CO 0.01 0.40 -0.39 -0.07 -3.12 0.00 0.00 179.24 176.08 3duz h LEU 337 N 0.86 -1.08 -0.05 1.55 -0.00 -1.23 -3.01 115.31 112.36 3duz h LEU 337 Ca 0.47 0.10 0.02 0.00 -0.00 0.00 0.00 57.88 58.47 3duz h LEU 337 Cb 0.52 0.38 -0.05 0.00 -0.00 0.00 0.00 40.66 41.51 3duz h LEU 337 CO -0.29 -0.51 -0.41 0.40 -0.00 0.00 0.00 178.44 177.63 3duz h ILE 338 N -0.74 0.00 -1.01 1.22 2.04 -0.20 -1.82 117.51 117.00 3duz h ILE 338 Ca -0.01 0.00 0.27 0.00 1.00 0.00 0.00 64.86 66.12 3duz h ILE 338 Cb 0.69 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.64 3duz h ILE 338 CO -0.11 0.00 0.59 -0.37 0.00 0.00 0.00 178.15 178.26 3duz h VAL 339 N -0.48 0.46 0.17 1.67 -1.51 -1.33 0.16 116.25 115.40 3duz h VAL 339 Ca 0.02 -0.17 -0.01 0.00 -1.23 0.00 0.00 66.70 65.31 3duz h VAL 339 Cb 0.53 -0.08 0.00 0.00 -2.13 0.00 0.00 31.29 29.62 3duz h VAL 339 CO -0.30 0.09 -0.08 -1.28 -1.23 0.00 0.00 177.57 174.77 3duz h SER 340 N 0.50 -0.20 1.15 4.19 0.87 -1.28 -3.20 113.55 115.59 3duz h SER 340 Ca 0.67 -0.24 0.00 0.00 -1.23 0.00 0.00 61.79 60.99 3duz h SER 340 Cb 1.38 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.39 3duz h SER 340 CO -0.51 0.15 0.00 0.55 -0.53 0.00 0.00 176.83 176.49 3duz n VAL 341 N -5.05 0.49 0.18 2.23 3.14 -0.49 -2.85 118.33 115.98 3duz n VAL 341 Ca -0.09 -0.08 0.06 0.00 -2.96 0.00 0.00 64.34 61.27 3duz n VAL 341 Cb 0.23 -0.68 0.18 0.00 -1.06 0.00 0.00 33.84 32.51 3duz n VAL 341 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3duz h ALA 342 N 2.62 0.84 0.00 1.55 0.00 -0.73 -1.35 119.26 122.19 3duz h ALA 342 Ca 0.00 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 3duz h ALA 342 Cb 0.57 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 3duz h ALA 342 CO 0.00 0.41 -0.10 0.87 0.00 0.00 0.00 179.25 180.43 3duz h LYS 343 N 0.00 0.00 0.02 0.00 1.57 -1.53 -2.77 116.57 113.86 3duz h LYS 343 Ca -0.00 0.00 -0.37 0.00 -1.87 0.00 0.00 60.65 58.41 3duz h LYS 343 Cb 1.12 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.37 3duz h LYS 343 CO 0.04 0.10 -2.29 1.33 -0.57 0.00 0.00 179.45 178.06 3duz n VAL 344 N -3.81 1.50 -3.65 0.50 0.24 -1.14 -4.85 118.33 107.12 3duz n VAL 344 Ca -0.02 -0.72 -0.39 0.00 -2.04 0.00 0.00 64.34 61.17 3duz n VAL 344 Cb 0.20 -1.04 -0.10 0.00 -1.47 0.00 0.00 33.84 31.43 3duz n VAL 344 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3duz s ASP 345 N -6.13 5.51 0.42 -1.34 -1.08 -0.52 -4.95 116.67 108.57 3duz s ASP 345 Ca -0.20 -1.89 0.29 0.00 -0.52 0.00 0.00 52.55 50.23 3duz s ASP 345 Cb 0.07 -1.93 1.08 0.00 -1.46 0.00 0.00 42.92 40.68 3duz s ASP 345 CO 0.74 -0.61 1.84 -0.33 0.52 0.00 0.00 175.17 177.33 3duz h GLU 346 N 8.28 0.00 -0.04 4.34 5.08 -1.85 -3.17 114.58 127.22 3duz h GLU 346 Ca -0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 3duz h GLU 346 Cb 1.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.31 3duz h GLU 346 CO 0.78 0.00 0.00 0.54 -1.00 0.00 0.00 179.01 179.33 3duz n ARG 347 N -2.77 1.54 0.02 2.33 1.74 -1.26 -0.32 116.66 117.94 3duz n ARG 347 Ca 0.02 -1.60 -0.13 0.00 -0.77 0.00 0.00 57.85 55.37 3duz n ARG 347 Cb 0.32 -1.35 -0.08 0.00 -1.02 0.00 0.00 32.46 30.33 3duz n ARG 347 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3duz h LEU 348 N 3.53 -0.02 -1.21 0.55 5.85 -1.82 -2.29 115.31 119.90 3duz h LEU 348 Ca 0.00 -0.25 0.05 0.00 0.84 0.00 0.00 57.88 58.53 3duz h LEU 348 Cb 0.76 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.74 3duz h LEU 348 CO 0.00 0.24 0.55 0.40 -0.34 0.00 0.00 178.44 179.29 3duz h ILE 349 N -0.27 1.08 -0.50 4.05 2.04 -1.82 0.97 117.51 123.05 3duz h ILE 349 Ca -0.00 -0.33 0.04 0.00 1.00 0.00 0.00 64.86 65.57 3duz h ILE 349 Cb 0.26 0.02 -0.04 0.00 -0.74 0.00 0.00 36.82 36.32 3duz h ILE 349 CO 0.00 0.18 0.25 1.23 0.00 0.00 0.00 178.15 179.81 3duz h GLY 350 N 0.98 0.70 0.97 5.37 0.00 -1.60 -1.62 103.07 107.86 3duz h GLY 350 Ca 0.35 -0.17 -0.00 0.00 0.00 0.00 0.00 47.33 47.51 3duz h GLY 350 CO -0.12 0.11 0.08 3.43 0.00 0.00 0.00 176.54 180.04 3duz h ASN 351 N 0.49 0.16 -0.32 0.19 -0.26 -0.29 0.57 115.58 116.12 3duz h ASN 351 Ca 0.22 -0.05 0.02 0.00 -0.56 0.00 0.00 56.30 55.94 3duz h ASN 351 Cb 0.13 -0.04 -0.03 0.00 -1.06 0.00 0.00 38.32 37.32 3duz h ASN 351 CO -0.15 0.16 0.15 -0.07 -1.06 0.00 0.00 177.43 176.46 3duz h LEU 352 N 0.15 0.21 0.00 1.61 3.38 -1.02 -0.83 115.31 118.81 3duz h LEU 352 Ca 0.05 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3duz h LEU 352 Cb 0.03 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.76 3duz h LEU 352 CO -0.01 0.16 0.00 0.23 0.09 0.00 0.00 178.44 178.91 3duz n MET 353 N -4.97 0.43 -3.69 1.13 2.81 -0.62 -4.92 117.12 107.28 3duz n MET 353 Ca -0.00 0.05 -0.24 0.00 -1.81 0.00 0.00 57.70 55.70 3duz n MET 353 Cb 0.08 -1.50 0.03 0.00 -0.71 0.00 0.00 33.22 31.12 3duz n MET 353 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3duz n ASN 354 N -1.22 -2.54 -3.64 7.83 5.15 -0.29 -5.02 115.26 115.52 3duz n ASN 354 Ca 0.13 -0.89 -0.05 0.00 -0.60 0.00 0.00 54.58 53.16 3duz n ASN 354 Cb 0.16 -3.84 -0.07 0.00 -0.53 0.00 0.00 39.78 35.51 3duz n ASN 354 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3duz s ASN 355 N -4.06 -0.82 -0.52 1.20 2.20 0.03 -5.03 114.94 107.95 3duz s ASN 355 Ca 0.16 1.31 -0.27 0.00 -0.94 0.00 0.00 52.86 53.12 3duz s ASN 355 Cb -0.05 1.37 -0.02 0.00 -2.00 0.00 0.00 41.25 40.55 3duz s ASN 355 CO 0.83 -0.21 1.86 -0.44 -2.94 0.00 0.00 177.10 176.21 3duz s SER 356 N 1.61 5.43 -0.02 3.54 0.01 -1.26 -4.32 113.70 118.68 3duz s SER 356 Ca -0.09 0.67 -0.04 0.00 1.31 0.00 0.00 55.95 57.80 3duz s SER 356 Cb -0.05 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.66 3duz s SER 356 CO -0.18 -2.19 0.09 0.68 0.41 0.00 0.00 173.24 172.05 3duz s VAL 357 N 8.55 0.03 -0.14 3.43 -7.23 -1.26 -0.38 120.40 123.40 3duz s VAL 357 Ca 0.72 -0.26 -0.06 0.00 -1.81 0.00 0.00 61.98 60.58 3duz s VAL 357 Cb -0.16 -0.22 -0.04 0.00 0.56 0.00 0.00 36.38 36.52 3duz s VAL 357 CO 0.25 -0.14 0.06 -0.55 -0.31 0.00 0.00 175.10 174.41 3duz s SER 358 N -0.43 5.68 -0.11 4.85 0.15 -0.53 -3.75 113.70 119.56 3duz s SER 358 Ca -0.05 0.19 -0.05 0.00 0.70 0.00 0.00 55.95 56.74 3duz s SER 358 Cb -0.03 -1.84 -0.04 0.00 -1.71 0.00 0.00 66.02 62.40 3duz s SER 358 CO 0.00 0.29 0.07 -0.94 1.20 0.00 0.00 173.24 173.86 3duz s SER 359 N -0.31 5.80 -0.11 5.45 1.04 0.56 -2.04 113.70 124.09 3duz s SER 359 Ca 0.09 0.30 -0.00 0.00 0.48 0.00 0.00 55.95 56.81 3duz s SER 359 Cb -0.12 -1.78 0.02 0.00 0.10 0.00 0.00 66.02 64.25 3duz s SER 359 CO 0.02 0.38 -0.09 -0.89 0.98 0.00 0.00 173.24 173.64 3duz s THR 360 N -0.89 1.11 0.30 2.02 2.01 -0.54 -4.74 115.64 114.91 3duz s THR 360 Ca 0.14 -0.35 -0.13 0.00 0.31 0.00 0.00 61.69 61.66 3duz s THR 360 Cb -0.12 -1.10 -0.08 0.00 0.01 0.00 0.00 72.50 71.21 3duz s THR 360 CO 0.03 0.38 0.68 -0.36 -0.69 0.00 0.00 174.62 174.66 3duz s PHE 361 N 1.59 3.40 -0.10 4.92 0.08 -1.26 -0.28 117.98 126.32 3duz s PHE 361 Ca 0.03 1.09 -0.05 0.00 0.12 0.00 0.00 56.93 58.12 3duz s PHE 361 Cb -0.13 -2.44 -0.04 0.00 -0.57 0.00 0.00 43.02 39.84 3duz s PHE 361 CO -0.07 0.12 -0.12 1.28 -0.10 0.00 0.00 175.22 176.33 3duz n LEU 362 N -0.41 0.67 0.00 -0.37 4.77 -0.63 -4.94 117.00 116.09 3duz n LEU 362 Ca 0.02 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 3duz n LEU 362 Cb 0.53 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 3duz n LEU 362 CO 0.43 0.20 0.00 -1.54 -1.33 0.00 0.00 177.39 175.15 3duz n SER 363 N -3.43 1.28 0.14 -1.43 3.41 -1.20 -5.00 113.62 107.39 3duz n SER 363 Ca -0.19 -0.28 0.01 0.00 -0.26 0.00 0.00 58.87 58.15 3duz n SER 363 Cb 0.63 0.00 0.14 0.00 -0.26 0.00 0.00 64.21 64.72 3duz n SER 363 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3duz h ASP 364 N 0.00 0.00 0.00 4.04 3.32 -1.97 -3.37 116.42 118.44 3duz h ASP 364 Ca 0.00 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.90 3duz h ASP 364 Cb 0.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 3duz h ASP 364 CO 0.00 0.59 -0.84 -0.78 -1.72 0.00 0.00 179.24 176.49 3duz h ASP 365 N 0.00 0.01 -2.64 6.45 1.82 -1.95 -3.45 116.42 116.67 3duz h ASP 365 Ca -0.01 -0.68 -0.58 0.00 -0.39 0.00 0.00 57.03 55.38 3duz h ASP 365 Cb 1.23 -0.00 -0.09 0.00 0.68 0.00 0.00 39.33 41.14 3duz h ASP 365 CO 0.08 1.33 -0.62 0.42 -1.61 0.00 0.00 179.24 178.84 3duz s THR 366 N -2.32 3.92 0.25 2.25 -4.23 -1.26 -5.06 115.64 109.20 3duz s THR 366 Ca -0.25 -1.44 -0.18 0.00 -1.18 0.00 0.00 61.69 58.64 3duz s THR 366 Cb 0.03 -3.02 0.02 0.00 1.34 0.00 0.00 72.50 70.87 3duz s THR 366 CO 0.63 -0.19 0.62 0.72 -0.54 0.00 0.00 174.62 175.86 3duz s PHE 367 N -1.89 -0.04 0.22 3.99 -0.71 -1.26 -1.60 117.98 116.69 3duz s PHE 367 Ca 0.29 -0.36 0.10 0.00 -1.04 0.00 0.00 56.93 55.92 3duz s PHE 367 Cb -0.09 0.51 -0.05 0.00 -1.21 0.00 0.00 43.02 42.19 3duz s PHE 367 CO 0.21 -1.10 -0.18 -0.51 -1.34 0.00 0.00 175.22 172.29 3duz s LEU 368 N -2.93 2.53 0.01 -1.99 1.43 0.61 -4.95 118.68 113.39 3duz s LEU 368 Ca 0.13 -0.97 0.06 0.00 -1.03 0.00 0.00 54.13 52.32 3duz s LEU 368 Cb -0.04 -0.89 -0.02 0.00 0.03 0.00 0.00 46.19 45.28 3duz s LEU 368 CO 0.05 -0.04 -0.19 -0.76 0.23 0.00 0.00 176.35 175.64 3duz s LEU 369 N -3.16 2.09 0.00 1.79 1.02 -1.26 -1.46 118.68 117.70 3duz s LEU 369 Ca 0.23 -0.41 0.04 0.00 0.02 0.00 0.00 54.13 54.01 3duz s LEU 369 Cb -0.04 -0.94 -0.01 0.00 0.02 0.00 0.00 46.19 45.22 3duz s LEU 369 CO 0.10 0.19 -0.13 -0.04 0.02 0.00 0.00 176.35 176.49 3duz s MET 370 N -0.75 0.97 0.53 1.70 -1.94 -0.86 -4.98 119.30 113.97 3duz s MET 370 Ca 0.07 -0.51 -0.20 0.00 -1.71 0.00 0.00 55.69 53.33 3duz s MET 370 Cb -0.08 -0.94 -0.06 0.00 2.01 0.00 0.00 34.83 35.76 3duz s MET 370 CO 0.00 0.25 1.17 -1.25 -0.01 0.00 0.00 175.02 175.19 3duz s PRO 371 N -0.49 3.35 0.08 2.03 0.04 -1.26 -1.46 135.00 137.28 3duz s PRO 371 Ca 0.04 1.75 -0.11 0.00 0.04 0.00 0.00 61.00 62.72 3duz s PRO 371 Cb -0.05 -2.10 0.01 0.00 0.04 0.00 0.00 34.50 32.39 3duz s PRO 371 CO -0.00 -0.89 0.25 0.00 0.04 0.00 0.00 177.00 176.40 3duz s THR 373 N -3.35 -0.01 0.24 0.00 2.01 -1.26 -4.35 115.64 108.91 3duz s THR 373 Ca 0.01 0.02 0.11 0.00 0.31 0.00 0.00 61.69 62.14 3duz s THR 373 Cb 0.02 -0.73 -0.05 0.00 0.01 0.00 0.00 72.50 71.76 3duz s THR 373 CO -0.08 0.01 -0.18 0.20 -0.69 0.00 0.00 174.62 173.87 3duz s ASN 374 N 0.67 3.71 -0.52 3.53 -0.87 -1.26 -5.09 114.94 115.11 3duz s ASN 374 Ca -0.03 -0.88 -0.27 0.00 -1.57 0.00 0.00 52.86 50.10 3duz s ASN 374 Cb -0.05 -0.39 -0.01 0.00 -0.02 0.00 0.00 41.25 40.78 3duz s ASN 374 CO -0.04 0.07 1.73 -2.16 -2.57 0.00 0.00 177.10 174.12 3duz s PRO 375 N -3.16 3.00 0.00 -0.60 0.04 -1.26 -4.91 135.00 128.11 3duz s PRO 375 Ca 0.26 0.81 0.29 0.00 0.04 0.00 0.00 61.00 62.40 3duz s PRO 375 Cb -0.07 -4.26 1.24 0.00 0.04 0.00 0.00 34.50 31.45 3duz s PRO 375 CO 0.14 -2.27 1.86 -0.35 0.04 0.00 0.00 177.00 176.41 3duz n PRO 376 N 8.82 1.05 0.00 0.56 -0.04 -1.26 -4.24 135.00 139.89 3duz n PRO 376 Ca 0.19 -0.44 0.00 0.00 -0.04 0.00 0.00 63.50 63.22 3duz n PRO 376 Cb 0.50 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 3duz n PRO 376 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3duz n ALA 377 N -0.59 2.44 -1.74 0.55 0.00 -1.26 -4.80 120.51 115.11 3duz n ALA 377 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.23 3duz n ALA 377 Cb 0.28 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.70 3duz n ALA 377 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 3duz s HIS 378 N -1.87 1.32 -0.03 0.00 3.76 -1.26 -4.72 115.29 112.48 3duz s HIS 378 Ca 0.00 1.10 0.04 0.00 -0.15 0.00 0.00 55.06 56.05 3duz s HIS 378 Cb 0.00 -3.83 -0.06 0.00 1.11 0.00 0.00 32.58 29.81 3duz s HIS 378 CO 0.00 -2.78 0.05 2.41 -0.85 0.00 0.00 174.74 173.56 3duz n THR 379 N 7.70 0.17 -2.71 1.30 -1.04 -1.26 -4.99 114.28 113.46 3duz n THR 379 Ca 0.30 -0.14 -0.06 0.00 -2.04 0.00 0.00 64.05 62.11 3duz n THR 379 Cb 0.52 -0.40 0.03 0.00 -1.82 0.00 0.00 70.33 68.65 3duz n THR 379 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 3duz n SER 380 N -1.96 0.50 -1.51 8.00 3.41 -1.26 0.35 113.62 121.14 3duz n SER 380 Ca -0.04 -1.38 -0.00 0.00 -0.26 0.00 0.00 58.87 57.18 3duz n SER 380 Cb 0.44 -0.15 0.09 0.00 -0.26 0.00 0.00 64.21 64.32 3duz n SER 380 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3duz n ASN 381 N -2.89 1.89 -4.08 4.04 6.94 -1.22 -4.94 115.26 115.01 3duz n ASN 381 Ca 0.05 -2.86 -0.08 0.00 -0.02 0.00 0.00 54.58 51.66 3duz n ASN 381 Cb 0.17 -0.41 -0.10 0.00 -2.36 0.00 0.00 39.78 37.08 3duz n ASN 381 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3duz n TYR 383 N 0.05 0.00 -3.18 0.00 9.36 -1.26 -4.92 117.16 117.21 3duz n TYR 383 Ca -0.12 0.00 -0.24 0.00 3.32 0.00 0.00 57.90 60.85 3duz n TYR 383 Cb 0.62 0.22 -0.05 0.00 -0.63 0.00 0.00 39.34 39.49 3duz n TYR 383 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 3duz n ASN 384 N -1.96 2.68 -4.72 2.98 3.02 -1.26 -5.11 115.26 110.89 3duz n ASN 384 Ca 0.00 -3.29 -0.42 0.00 -0.03 0.00 0.00 54.58 50.85 3duz n ASN 384 Cb 0.00 -0.62 -0.03 0.00 -0.61 0.00 0.00 39.78 38.52 3duz n ASN 384 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3duz s ASN 385 N -2.54 7.21 -0.46 6.41 2.47 -1.26 -5.00 114.94 121.77 3duz s ASN 385 Ca 0.42 1.98 0.06 0.00 0.42 0.00 0.00 52.86 55.73 3duz s ASN 385 Cb 0.24 -2.59 0.19 0.00 -1.45 0.00 0.00 41.25 37.64 3duz s ASN 385 CO -0.08 -0.33 0.56 -0.24 -3.72 0.00 0.00 177.10 173.28 3duz n SER 386 N 3.31 -1.96 -3.44 -4.21 2.88 -1.26 -4.99 113.62 103.95 3duz n SER 386 Ca 0.06 -2.69 -0.24 0.00 -1.33 0.00 0.00 58.87 54.67 3duz n SER 386 Cb 0.47 0.64 0.02 0.00 -0.75 0.00 0.00 64.21 64.58 3duz n SER 386 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 3duz n ILE 387 N 2.75 -5.77 0.00 2.46 5.41 -1.26 -5.01 119.36 117.94 3duz n ILE 387 Ca 0.23 0.13 0.00 0.00 1.00 0.00 0.00 62.75 64.11 3duz n ILE 387 Cb 0.53 -4.43 0.00 0.00 -0.71 0.00 0.00 39.64 35.03 3duz n ILE 387 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 3duz n TYR 388 N -1.24 0.00 -1.35 1.39 4.02 -1.23 -4.96 117.16 113.79 3duz n TYR 388 Ca -0.12 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.47 3duz n TYR 388 Cb 0.63 0.00 0.22 0.00 -0.02 0.00 0.00 39.34 40.16 3duz n TYR 388 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 3duz s LYS 389 N 0.00 -0.52 0.86 -0.72 1.02 -1.25 -4.86 119.74 114.27 3duz s LYS 389 Ca 0.00 -0.12 -0.10 0.00 0.02 0.00 0.00 55.97 55.76 3duz s LYS 389 Cb 0.00 -1.68 0.11 0.00 -0.52 0.00 0.00 37.83 35.73 3duz s LYS 389 CO 0.00 -3.23 1.11 -1.21 -0.92 0.00 0.00 175.35 171.10 3duz s GLU 390 N -5.52 1.54 -0.94 1.68 0.41 -1.26 -2.80 118.70 111.81 3duz s GLU 390 Ca 0.71 1.28 0.00 0.00 -0.41 0.00 0.00 54.97 56.55 3duz s GLU 390 Cb -0.09 -1.81 0.00 0.00 -1.78 0.00 0.00 34.13 30.46 3duz s GLU 390 CO 0.55 -2.18 0.00 0.41 -0.49 0.00 0.00 175.26 173.55 3duz n GLY 391 N -0.56 0.84 2.87 -1.39 0.00 -1.26 -3.92 105.19 101.77 3duz n GLY 391 Ca 0.10 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.11 3duz n GLY 391 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3duz n ARG 392 N -0.57 -2.54 -3.99 1.61 1.85 -1.12 -5.18 116.66 106.72 3duz n ARG 392 Ca -0.09 2.19 -0.31 0.00 -1.00 0.00 0.00 57.85 58.64 3duz n ARG 392 Cb 0.53 -3.88 -0.16 0.00 -1.05 0.00 0.00 32.46 27.91 3duz n ARG 392 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 3duz s TRP 393 N -1.31 2.45 -0.18 2.89 0.51 -1.22 -5.00 118.94 117.08 3duz s TRP 393 Ca -0.02 -1.64 0.13 0.00 -2.12 0.00 0.00 56.10 52.45 3duz s TRP 393 Cb 0.00 -1.64 0.41 0.00 -0.81 0.00 0.00 33.47 31.43 3duz s TRP 393 CO 0.52 -0.75 1.21 -1.13 -0.51 0.00 0.00 176.95 176.29 3duz n SER 399 N 4.67 1.64 0.09 2.95 3.41 -1.26 -3.50 113.62 121.63 3duz n SER 399 Ca -0.14 -3.60 0.01 0.00 -0.26 0.00 0.00 58.87 54.88 3duz n SER 399 Cb 0.46 -0.49 -0.02 0.00 -0.26 0.00 0.00 64.21 63.89 3duz n SER 399 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 3duz h SER 400 N 0.94 0.00 0.00 4.04 0.87 -2.07 -3.05 113.55 114.27 3duz h SER 400 Ca -0.03 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 3duz h SER 400 Cb 1.12 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.08 3duz h SER 400 CO 0.01 0.55 0.00 0.00 -0.53 0.00 0.00 176.83 176.86 3duz n GLN 401 N -3.10 0.86 -3.48 2.24 1.13 -1.26 -4.59 117.38 109.18 3duz n GLN 401 Ca -0.02 0.00 -0.24 0.00 -1.94 0.00 0.00 57.00 54.79 3duz n GLN 401 Cb 0.78 -1.28 -0.13 0.00 0.11 0.00 0.00 30.24 29.72 3duz n GLN 401 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3duz s ILE 403 N 2.20 2.93 -0.05 0.00 1.01 -1.26 -4.94 121.20 121.10 3duz s ILE 403 Ca 0.09 -0.97 -0.18 0.00 0.00 0.00 0.00 60.65 59.59 3duz s ILE 403 Cb -0.15 -2.20 -0.05 0.00 0.01 0.00 0.00 42.46 40.07 3duz s ILE 403 CO -0.35 0.45 0.50 -0.62 0.00 0.00 0.00 174.94 174.91 3duz s ASP 404 N -1.14 6.82 -0.25 3.58 2.15 -1.26 -3.38 116.67 123.19 3duz s ASP 404 Ca 0.14 0.98 0.09 0.00 0.43 0.00 0.00 52.55 54.18 3duz s ASP 404 Cb -0.11 -2.30 0.44 0.00 -0.30 0.00 0.00 42.92 40.65 3duz s ASP 404 CO 0.03 0.12 1.25 2.22 -0.17 0.00 0.00 175.17 178.63 3duz n PHE 405 N 2.84 1.04 -0.01 -5.34 -1.74 0.16 -4.77 117.46 109.63 3duz n PHE 405 Ca -0.09 -1.77 -0.09 0.00 -0.56 0.00 0.00 57.45 54.94 3duz n PHE 405 Cb 0.52 -0.33 -0.03 0.00 1.52 0.00 0.00 39.48 41.16 3duz n PHE 405 CO 0.00 0.00 0.00 0.77 -0.56 0.00 0.00 176.76 176.97 3duz h SER 406 N 1.39 -0.81 -3.29 5.98 0.02 -1.96 -3.34 113.55 111.54 3duz h SER 406 Ca 0.15 0.13 -0.72 0.00 -0.84 0.00 0.00 61.79 60.52 3duz h SER 406 Cb 1.24 0.36 -0.21 0.00 0.14 0.00 0.00 62.40 63.93 3duz h SER 406 CO 0.31 -0.30 -0.18 0.20 -1.14 0.00 0.00 176.83 175.72 3duz s ASN 407 N -4.98 6.18 0.27 3.07 0.01 -1.26 -5.04 114.94 113.19 3duz s ASN 407 Ca -0.15 -1.13 0.05 0.00 -0.71 0.00 0.00 52.86 50.91 3duz s ASN 407 Cb 0.11 -2.23 -0.06 0.00 0.41 0.00 0.00 41.25 39.49 3duz s ASN 407 CO 0.67 -0.74 -0.01 -0.72 -1.51 0.00 0.00 177.10 174.79 3duz s TYR 408 N 2.05 1.77 0.15 2.20 1.13 -1.25 -5.15 117.35 118.24 3duz s TYR 408 Ca 0.09 -0.86 0.10 0.00 -1.41 0.00 0.00 57.07 54.98 3duz s TYR 408 Cb -0.22 -1.05 -0.04 0.00 -1.10 0.00 0.00 41.96 39.55 3duz s TYR 408 CO 0.09 0.07 -0.19 0.15 -2.51 0.00 0.00 175.55 173.16 3duz s LYS 409 N -3.83 1.71 0.09 -3.49 1.02 -1.26 -5.11 119.74 108.87 3duz s LYS 409 Ca 0.30 -1.31 -0.30 0.00 0.02 0.00 0.00 55.97 54.68 3duz s LYS 409 Cb 0.06 -2.02 -0.06 0.00 -0.52 0.00 0.00 37.83 35.28 3duz s LYS 409 CO 0.11 0.45 1.17 -1.21 -0.92 0.00 0.00 175.35 174.95 3duz s GLU 410 N -2.39 4.47 -0.33 1.68 0.41 -1.26 -5.02 118.70 116.26 3duz s GLU 410 Ca 0.19 1.76 -0.16 0.00 -0.41 0.00 0.00 54.97 56.35 3duz s GLU 410 Cb -0.09 -3.33 -0.01 0.00 -1.78 0.00 0.00 34.13 28.91 3duz s GLU 410 CO 0.10 -0.17 0.40 -1.17 -0.49 0.00 0.00 175.26 173.93 3duz s LEU 411 N 0.67 4.36 -0.78 1.80 2.96 -1.26 -5.03 118.68 121.40 3duz s LEU 411 Ca 0.56 -0.11 -0.24 0.00 -0.22 0.00 0.00 54.13 54.12 3duz s LEU 411 Cb -0.29 -2.41 0.05 0.00 0.50 0.00 0.00 46.19 44.04 3duz s LEU 411 CO 0.31 -0.35 1.21 0.00 -1.32 0.00 0.00 176.35 176.20 3duz s ALA 412 N 2.12 2.89 -1.79 5.97 0.00 -1.26 -4.77 121.76 124.92 3duz s ALA 412 Ca 0.14 -1.76 0.20 0.00 0.00 0.00 0.00 51.96 50.54 3duz s ALA 412 Cb -0.16 -4.18 -0.02 0.00 0.00 0.00 0.00 23.12 18.76 3duz s ALA 412 CO 0.12 -3.19 0.99 0.44 0.00 0.00 0.00 175.76 174.12 3duz n ILE 413 N 6.28 0.00 -4.32 0.00 -5.35 -1.26 -4.96 119.36 109.74 3duz n ILE 413 Ca 0.08 -0.28 -0.19 0.00 -0.27 0.00 0.00 62.75 62.09 3duz n ILE 413 Cb 0.48 1.22 -0.11 0.00 -1.74 0.00 0.00 39.64 39.50 3duz n ILE 413 CO 0.00 0.00 0.00 -1.81 -1.76 0.00 0.00 176.55 172.98 3duz s ASP 414 N -2.28 2.50 -0.09 7.28 1.01 -1.26 -5.14 116.67 118.69 3duz s ASP 414 Ca 0.16 -0.92 -0.00 0.00 0.71 0.00 0.00 52.55 52.50 3duz s ASP 414 Cb 0.16 -0.13 -0.03 0.00 1.01 0.00 0.00 42.92 43.93 3duz s ASP 414 CO 0.52 -0.12 -0.06 -1.81 0.21 0.00 0.00 175.17 173.91 3duz s ASP 415 N -2.92 4.69 0.34 0.27 1.01 -1.26 -5.11 116.67 113.69 3duz s ASP 415 Ca 0.17 -0.04 -0.24 0.00 0.71 0.00 0.00 52.55 53.15 3duz s ASP 415 Cb -0.03 -1.31 -0.10 0.00 1.01 0.00 0.00 42.92 42.49 3duz s ASP 415 CO 0.06 0.32 0.92 -0.62 0.21 0.00 0.00 175.17 176.06 3duz s ASP 416 N -0.58 7.21 0.36 0.27 2.15 -1.26 -5.06 116.67 119.76 3duz s ASP 416 Ca 0.09 1.75 -0.20 0.00 0.43 0.00 0.00 52.55 54.62 3duz s ASP 416 Cb -0.12 -2.55 -0.10 0.00 -0.30 0.00 0.00 42.92 39.85 3duz s ASP 416 CO 0.02 -0.13 0.86 0.54 -0.17 0.00 0.00 175.17 176.29 3duz s VAL 417 N -1.74 4.48 -0.13 1.11 0.11 -1.26 -5.08 120.40 117.89 3duz s VAL 417 Ca 0.52 1.34 0.02 0.00 -2.93 0.00 0.00 61.98 60.93 3duz s VAL 417 Cb -0.16 -3.68 0.02 0.00 -1.53 0.00 0.00 36.38 31.02 3duz s VAL 417 CO 0.21 -0.16 -0.17 -0.70 -3.33 0.00 0.00 175.10 170.95 3duz s GLU 418 N -2.85 2.43 -0.11 1.54 2.12 -1.26 -5.13 118.70 115.44 3duz s GLU 418 Ca 0.56 -0.63 -0.08 0.00 0.36 0.00 0.00 54.97 55.18 3duz s GLU 418 Cb -0.11 -2.07 -0.04 0.00 0.26 0.00 0.00 34.13 32.16 3duz s GLU 418 CO 0.17 -0.10 0.17 -0.06 -0.54 0.00 0.00 175.26 174.90 3duz s PHE 419 N 1.07 3.60 -0.45 5.30 0.08 -1.26 -5.06 117.98 121.26 3duz s PHE 419 Ca -0.04 0.57 -0.06 0.00 0.12 0.00 0.00 56.93 57.52 3duz s PHE 419 Cb -0.14 -2.00 0.12 0.00 -0.57 0.00 0.00 43.02 40.43 3duz s PHE 419 CO -0.04 0.70 0.29 -0.46 -0.10 0.00 0.00 175.22 175.60 3duz s TRP 420 N -0.94 3.50 -0.46 0.36 -0.00 -1.26 -4.98 118.94 115.17 3duz s TRP 420 Ca 0.16 -2.15 0.03 0.00 -0.00 0.00 0.00 56.10 54.14 3duz s TRP 420 Cb -0.12 -3.37 0.16 0.00 -0.00 0.00 0.00 33.47 30.14 3duz s TRP 420 CO 0.05 -0.98 0.34 0.42 -0.00 0.00 0.00 176.95 176.78 3duz s ILE 421 N 1.21 0.88 0.62 5.86 1.01 -1.26 -5.14 121.20 124.39 3duz s ILE 421 Ca 0.07 -2.82 -0.15 0.00 0.00 0.00 0.00 60.65 57.75 3duz s ILE 421 Cb -0.24 -1.61 -0.02 0.00 0.01 0.00 0.00 42.46 40.60 3duz s ILE 421 CO -0.02 -1.13 1.08 -2.16 0.00 0.00 0.00 174.94 172.70 3duz s PRO 422 N -0.06 3.09 0.28 2.79 0.04 -1.26 -5.01 135.00 134.87 3duz s PRO 422 Ca 0.28 1.28 -0.30 0.00 0.04 0.00 0.00 61.00 62.30 3duz s PRO 422 Cb -0.04 -2.00 -0.10 0.00 0.04 0.00 0.00 34.50 32.40 3duz s PRO 422 CO -0.15 -1.01 1.45 0.99 0.04 0.00 0.00 177.00 178.32 3duz s THR 423 N -2.42 2.54 0.21 1.26 2.01 -1.26 -5.02 115.64 112.97 3duz s THR 423 Ca 0.65 0.47 0.01 0.00 0.31 0.00 0.00 61.69 63.14 3duz s THR 423 Cb -0.18 -3.30 -0.00 0.00 0.01 0.00 0.00 72.50 69.02 3duz s THR 423 CO 0.39 0.08 0.04 2.30 -0.69 0.00 0.00 174.62 176.75 3duz n ILE 424 N 1.96 0.00 -0.19 1.82 -5.35 -1.26 -4.69 119.36 111.65 3duz n ILE 424 Ca 0.06 -1.12 0.00 0.00 -0.27 0.00 0.00 62.75 61.42 3duz n ILE 424 Cb 0.40 0.33 0.00 0.00 -1.74 0.00 0.00 39.64 38.63 3duz n ILE 424 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3duz n GLY 425 N 1.38 0.89 3.36 3.28 0.00 -0.33 -4.92 105.19 108.84 3duz n GLY 425 Ca -0.06 -0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 3duz n GLY 425 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3duz n ASN 426 N 0.33 4.90 -4.86 1.61 3.02 -0.71 -4.99 115.26 114.56 3duz n ASN 426 Ca 0.00 -2.95 -0.26 0.00 -0.03 0.00 0.00 54.58 51.34 3duz n ASN 426 Cb 0.00 -1.66 -0.04 0.00 -0.61 0.00 0.00 39.78 37.47 3duz n ASN 426 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3duz s THR 427 N 2.88 4.81 -0.03 3.41 -4.23 -1.26 -4.66 115.64 116.56 3duz s THR 427 Ca 0.48 -0.93 0.04 0.00 -1.18 0.00 0.00 61.69 60.09 3duz s THR 427 Cb 0.04 -3.47 -0.03 0.00 1.34 0.00 0.00 72.50 70.38 3duz s THR 427 CO 0.03 -0.11 -0.12 -0.89 -0.54 0.00 0.00 174.62 172.98 3duz s THR 428 N -1.76 3.23 -0.07 3.99 2.01 -1.26 -5.13 115.64 116.66 3duz s THR 428 Ca 0.32 -0.75 0.00 0.00 0.31 0.00 0.00 61.69 61.57 3duz s THR 428 Cb -0.10 -2.31 -0.03 0.00 0.01 0.00 0.00 72.50 70.07 3duz s THR 428 CO 0.25 0.53 -0.04 -0.31 -0.69 0.00 0.00 174.62 174.36 3duz s TYR 429 N -0.81 3.02 0.17 4.92 1.51 -1.26 -5.12 117.35 119.78 3duz s TYR 429 Ca 0.13 0.09 0.09 0.00 -1.01 0.00 0.00 57.07 56.37 3duz s TYR 429 Cb -0.11 -1.73 -0.04 0.00 -0.11 0.00 0.00 41.96 39.97 3duz s TYR 429 CO 0.02 0.39 -0.12 -1.01 -1.11 0.00 0.00 175.55 173.73 3duz s HIS 430 N -0.86 2.60 0.47 2.71 3.76 -1.26 -5.12 115.29 117.58 3duz s HIS 430 Ca 0.13 -0.23 -0.15 0.00 -0.15 0.00 0.00 55.06 54.66 3duz s HIS 430 Cb -0.11 -1.29 -0.08 0.00 1.11 0.00 0.00 32.58 32.21 3duz s HIS 430 CO 0.03 0.49 0.91 -0.51 -0.85 0.00 0.00 174.74 174.80 3duz s ASP 431 N -2.68 6.61 0.76 1.40 1.01 -1.26 -5.05 116.67 117.46 3duz s ASP 431 Ca 0.23 1.43 -0.11 0.00 0.71 0.00 0.00 52.55 54.81 3duz s ASP 431 Cb -0.09 -2.45 0.05 0.00 1.01 0.00 0.00 42.92 41.44 3duz s ASP 431 CO 0.14 -0.51 1.10 -0.94 0.21 0.00 0.00 175.17 175.17 3duz s SER 432 N -3.03 4.48 0.03 0.27 1.04 -1.26 -4.86 113.70 110.36 3duz s SER 432 Ca 0.56 1.89 0.19 0.00 0.48 0.00 0.00 55.95 59.08 3duz s SER 432 Cb -0.10 -2.53 0.82 0.00 0.10 0.00 0.00 66.02 64.31 3duz s SER 432 CO 0.30 -2.05 1.62 0.79 0.98 0.00 0.00 173.24 174.87 3duz n TRP 433 N -3.37 0.10 1.36 5.02 8.01 -0.48 -2.39 117.44 125.69 3duz n TRP 433 Ca 0.10 0.04 0.12 0.00 -1.31 0.00 0.00 57.50 56.44 3duz n TRP 433 Cb 0.53 -0.56 0.45 0.00 -2.01 0.00 0.00 31.31 29.72 3duz n TRP 433 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 3duz n LYS 434 N -1.59 1.66 -0.22 -0.99 5.02 -1.24 -4.06 118.16 116.75 3duz n LYS 434 Ca 0.04 -0.99 0.10 0.00 -2.02 0.00 0.00 58.31 55.45 3duz n LYS 434 Cb 0.23 -1.42 0.22 0.00 -0.02 0.00 0.00 35.03 34.03 3duz n LYS 434 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3duz n ASP 435 N 0.20 3.37 -4.66 4.39 8.00 -1.00 -4.90 116.55 121.94 3duz n ASP 435 Ca 0.17 -1.95 -0.42 0.00 0.71 0.00 0.00 54.79 53.30 3duz n ASP 435 Cb 0.32 -0.29 -0.03 0.00 -0.02 0.00 0.00 41.12 41.11 3duz n ASP 435 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3duz s ALA 436 N -1.21 3.60 0.30 2.24 0.00 -1.26 -4.88 121.76 120.55 3duz s ALA 436 Ca 0.36 0.91 0.06 0.00 0.00 0.00 0.00 51.96 53.29 3duz s ALA 436 Cb 0.20 -3.75 0.79 0.00 0.00 0.00 0.00 23.12 20.36 3duz s ALA 436 CO 0.28 -1.41 1.70 0.66 0.00 0.00 0.00 175.76 176.98 3duz h SER 437 N 9.56 0.43 -0.60 0.00 4.64 -1.94 0.01 113.55 125.64 3duz h SER 437 Ca -0.39 0.15 0.03 0.00 -0.47 0.00 0.00 61.79 61.12 3duz h SER 437 Cb 1.18 0.11 -0.03 0.00 -0.31 0.00 0.00 62.40 63.34 3duz h SER 437 CO 0.96 0.02 0.40 1.23 -0.87 0.00 0.00 176.83 178.56 3duz h GLY 438 N 0.44 0.80 1.81 -0.77 0.00 -1.61 -2.23 103.07 101.51 3duz h GLY 438 Ca 0.59 -0.28 -0.22 0.00 0.00 0.00 0.00 47.33 47.42 3duz h GLY 438 CO -0.52 0.24 -1.03 1.49 0.00 0.00 0.00 176.54 176.73 3duz h TRP 439 N 0.70 0.25 -0.03 5.60 4.06 -1.25 -2.69 115.95 122.60 3duz h TRP 439 Ca 0.24 -0.16 -0.13 0.00 2.06 0.00 0.00 58.89 60.89 3duz h TRP 439 Cb 0.09 -0.02 -0.02 0.00 -1.00 0.00 0.00 29.16 28.22 3duz h TRP 439 CO -0.00 1.07 -0.59 0.66 -3.56 0.00 0.00 178.44 176.02 3duz h SER 440 N 0.06 0.12 -0.42 -3.49 4.64 -1.38 -0.01 113.55 113.06 3duz h SER 440 Ca -0.06 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 3duz h SER 440 Cb 1.73 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 63.76 3duz h SER 440 CO 0.15 0.68 0.28 0.15 -0.87 0.00 0.00 176.83 177.22 3duz h PHE 441 N 0.08 0.54 -0.69 4.77 3.57 -1.34 0.23 116.94 124.09 3duz h PHE 441 Ca -0.01 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.43 3duz h PHE 441 Cb 1.06 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 39.59 3duz h PHE 441 CO 0.01 0.34 0.15 0.82 -2.23 0.00 0.00 178.31 177.40 3duz h ILE 442 N 0.57 1.26 -0.77 1.41 2.04 -1.26 -2.38 117.51 118.39 3duz h ILE 442 Ca 0.16 -1.00 -0.05 0.00 1.00 0.00 0.00 64.86 64.97 3duz h ILE 442 Cb -0.06 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 36.55 3duz h ILE 442 CO -0.03 0.38 0.30 0.00 0.00 0.00 0.00 178.15 178.79 3duz h ALA 443 N 1.09 1.08 0.45 1.87 0.00 -0.62 -2.77 119.26 120.36 3duz h ALA 443 Ca 0.22 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 3duz h ALA 443 Cb 0.40 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3duz h ALA 443 CO 0.01 0.65 -0.22 0.37 0.00 0.00 0.00 179.25 180.06 3duz h GLN 444 N 1.12 -0.59 -0.12 0.00 5.75 -0.10 -1.50 115.11 119.66 3duz h GLN 444 Ca 0.25 0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.78 3duz h GLN 444 Cb 0.22 0.13 -0.01 0.00 1.07 0.00 0.00 27.48 28.90 3duz h GLN 444 CO -0.02 -0.34 0.02 -0.56 -2.65 0.00 0.00 178.83 175.27 3duz h GLN 445 N -0.70 0.16 -0.44 1.69 -0.00 -1.47 0.19 115.11 114.54 3duz h GLN 445 Ca -0.06 -0.02 -0.07 0.00 -0.00 0.00 0.00 58.65 58.50 3duz h GLN 445 Cb 0.52 -0.03 -0.02 0.00 -0.00 0.00 0.00 27.48 27.95 3duz h GLN 445 CO 0.10 0.17 -0.01 -0.22 -0.00 0.00 0.00 178.83 178.87 3duz h LYS 446 N 0.17 0.78 -0.29 0.06 3.64 -1.32 -1.36 116.57 118.26 3duz h LYS 446 Ca 0.04 -0.25 -0.12 0.00 -1.27 0.00 0.00 60.65 59.05 3duz h LYS 446 Cb 0.09 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3duz h LYS 446 CO -0.00 0.85 -0.27 1.03 -2.27 0.00 0.00 179.45 178.79 3duz h SER 447 N 0.62 0.73 -0.94 4.20 0.87 -0.18 -2.41 113.55 116.45 3duz h SER 447 Ca 0.12 -0.47 0.03 0.00 -1.23 0.00 0.00 61.79 60.25 3duz h SER 447 Cb 0.51 -0.21 -0.05 0.00 -0.44 0.00 0.00 62.40 62.21 3duz h SER 447 CO 0.02 1.05 0.61 0.78 -0.53 0.00 0.00 176.83 178.77 3duz h ASN 448 N 0.43 1.03 -0.42 6.23 2.35 -0.56 -1.93 115.58 122.70 3duz h ASN 448 Ca 0.05 -0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.74 3duz h ASN 448 Cb 0.84 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.96 3duz h ASN 448 CO 0.07 0.71 0.10 0.25 -1.65 0.00 0.00 177.43 176.91 3duz h LEU 449 N 1.20 0.64 -0.97 1.61 5.85 -1.18 -2.48 115.31 119.98 3duz h LEU 449 Ca 0.37 -0.23 0.12 0.00 0.84 0.00 0.00 57.88 58.98 3duz h LEU 449 Cb -0.02 -0.17 -0.08 0.00 0.37 0.00 0.00 40.66 40.76 3duz h LEU 449 CO -0.11 0.71 0.60 0.40 -0.34 0.00 0.00 178.44 179.69 3duz h ILE 450 N 0.54 0.90 -0.01 4.05 2.04 -0.85 -1.85 117.51 122.33 3duz h ILE 450 Ca 0.13 -0.32 -0.17 0.00 1.00 0.00 0.00 64.86 65.50 3duz h ILE 450 Cb 0.32 -0.12 0.01 0.00 -0.74 0.00 0.00 36.82 36.29 3duz h ILE 450 CO 0.00 0.17 -0.66 0.00 0.00 0.00 0.00 178.15 177.66 3duz h THR 451 N 0.93 1.40 0.00 -0.27 1.03 -1.22 -3.30 112.91 111.49 3duz h THR 451 Ca 0.48 -2.08 -0.11 0.00 -0.01 0.00 0.00 66.41 64.69 3duz h THR 451 Cb 0.50 2.53 -0.02 0.00 -1.07 0.00 0.00 68.15 70.09 3duz h THR 451 CO -0.27 0.61 -0.54 0.00 -0.01 0.00 0.00 175.52 175.31 3duz h THR 452 N -0.01 1.38 -0.07 0.00 1.03 -1.25 -2.93 112.91 111.07 3duz h THR 452 Ca -0.08 -1.86 0.00 0.00 -0.01 0.00 0.00 66.41 64.46 3duz h THR 452 Cb 1.36 2.00 0.00 0.00 -1.07 0.00 0.00 68.15 70.44 3duz h THR 452 CO 0.13 0.53 0.00 0.23 -0.01 0.00 0.00 175.52 176.40 3duz n MET 453 N -3.89 1.30 0.00 0.00 2.00 -0.71 -2.97 117.12 112.85 3duz n MET 453 Ca -0.01 -0.31 0.00 0.00 0.00 0.00 0.00 57.70 57.38 3duz n MET 453 Cb 0.55 -1.34 0.00 0.00 0.00 0.00 0.00 33.22 32.43 3duz n MET 453 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 175.97 175.12 3duz n GLU 454 N -0.09 0.94 -3.88 0.03 0.28 -1.11 -4.93 120.64 111.89 3duz n GLU 454 Ca 0.03 -0.81 -0.34 0.00 -0.16 0.00 0.00 57.16 55.88 3duz n GLU 454 Cb 0.22 -0.66 -0.13 0.00 1.43 0.00 0.00 31.44 32.30 3duz n GLU 454 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 3duz s ASN 455 N -0.32 5.05 0.21 -1.84 0.01 -1.16 -5.09 114.94 111.81 3duz s ASN 455 Ca 0.00 -2.08 -0.30 0.00 -0.71 0.00 0.00 52.86 49.78 3duz s ASN 455 Cb 0.00 -1.75 -0.08 0.00 0.41 0.00 0.00 41.25 39.83 3duz s ASN 455 CO 0.00 -0.47 1.11 -0.89 -1.51 0.00 0.00 177.10 175.34 3duz s THR 456 N 1.04 3.70 0.07 1.60 2.01 -1.26 -4.27 115.64 118.54 3duz s THR 456 Ca 0.09 1.54 0.09 0.00 0.31 0.00 0.00 61.69 63.72 3duz s THR 456 Cb -0.21 -3.98 -0.03 0.00 0.01 0.00 0.00 72.50 68.28 3duz s THR 456 CO -0.06 0.30 -0.22 -0.54 -0.69 0.00 0.00 174.62 173.41 3duz s LYS 457 N -0.71 1.84 -0.30 4.92 -0.14 0.86 -5.01 119.74 121.19 3duz s LYS 457 Ca 0.48 -1.11 -0.19 0.00 -1.36 0.00 0.00 55.97 53.79 3duz s LYS 457 Cb -0.31 -2.07 -0.01 0.00 -1.68 0.00 0.00 37.83 33.76 3duz s LYS 457 CO 0.37 0.51 0.57 0.12 -0.76 0.00 0.00 175.35 176.16 3duz s PHE 458 N -0.95 3.23 -0.83 3.18 5.36 -1.26 -0.82 117.98 125.88 3duz s PHE 458 Ca 0.14 0.53 -0.03 0.00 -0.96 0.00 0.00 56.93 56.62 3duz s PHE 458 Cb -0.10 -2.89 0.23 0.00 -0.34 0.00 0.00 43.02 39.92 3duz s PHE 458 CO 0.05 -0.42 2.26 0.41 -1.46 0.00 0.00 175.22 176.06 3duz n GLY 459 N 4.48 5.25 0.19 13.12 0.00 -1.18 -4.87 105.19 122.17 3duz n GLY 459 Ca -0.03 -2.27 0.02 0.00 0.00 0.00 0.00 46.02 43.75 3duz n GLY 459 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93