#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dda s PRO 2 N 0.00 2.14 0.21 2.12 0.04 -1.26 -4.93 135.00 133.32 3dda s PRO 2 Ca 0.00 1.41 -0.03 0.00 0.04 0.00 0.00 61.00 62.42 3dda s PRO 2 Cb 0.00 -1.87 0.17 0.00 0.04 0.00 0.00 34.50 32.84 3dda s PRO 2 CO 0.00 -1.76 1.57 0.35 0.04 0.00 0.00 177.00 177.19 3dda h PHE 3 N -0.81 0.74 -3.59 0.56 3.57 -1.93 -3.38 116.94 112.10 3dda h PHE 3 Ca -0.45 -0.22 -0.70 0.00 3.53 0.00 0.00 57.97 60.13 3dda h PHE 3 Cb 1.25 -0.16 -0.31 0.00 2.79 0.00 0.00 35.95 39.53 3dda h PHE 3 CO 0.54 0.93 -0.58 0.08 -2.23 0.00 0.00 178.31 177.05 3dda s VAL 4 N -4.25 3.58 -2.00 1.41 1.01 -1.26 -4.71 120.40 114.19 3dda s VAL 4 Ca -0.08 -1.50 0.07 0.00 0.00 0.00 0.00 61.98 60.46 3dda s VAL 4 Cb 0.12 -3.19 0.19 0.00 0.00 0.00 0.00 36.38 33.50 3dda s VAL 4 CO 0.83 -0.38 1.18 0.59 0.00 0.00 0.00 175.10 177.32 3dda n ASN 5 N 4.74 0.00 -3.68 3.32 3.02 -1.26 -4.68 115.26 116.71 3dda n ASN 5 Ca -0.09 -1.60 -0.16 0.00 -0.03 0.00 0.00 54.58 52.70 3dda n ASN 5 Cb 0.43 0.00 -0.15 0.00 -0.61 0.00 0.00 39.78 39.45 3dda n ASN 5 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3dda s LYS 6 N -2.00 0.04 -1.37 3.52 1.02 -1.26 -5.06 119.74 114.63 3dda s LYS 6 Ca 0.10 0.53 -0.14 0.00 0.02 0.00 0.00 55.97 56.48 3dda s LYS 6 Cb 0.05 -0.25 0.08 0.00 -0.52 0.00 0.00 37.83 37.18 3dda s LYS 6 CO 0.08 -0.28 1.99 1.04 -0.92 0.00 0.00 175.35 177.26 3dda n GLN 7 N 5.12 3.10 -1.59 1.68 1.13 -1.26 -4.97 117.38 120.59 3dda n GLN 7 Ca -0.09 -3.02 -0.39 0.00 -1.94 0.00 0.00 57.00 51.57 3dda n GLN 7 Cb 0.50 -3.26 0.04 0.00 0.11 0.00 0.00 30.24 27.63 3dda n GLN 7 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 3dda n PHE 8 N 6.28 0.68 -5.26 1.08 3.72 -1.26 -5.03 117.46 117.67 3dda n PHE 8 Ca 0.48 0.47 -0.31 0.00 -0.05 0.00 0.00 57.45 58.04 3dda n PHE 8 Cb 0.41 -2.13 -0.16 0.00 -0.94 0.00 0.00 39.48 36.65 3dda n PHE 8 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 3dda s ASN 9 N -1.10 2.98 0.40 4.37 -0.87 -1.26 -4.80 114.94 114.66 3dda s ASN 9 Ca 0.71 -0.47 0.12 0.00 -1.57 0.00 0.00 52.86 51.65 3dda s ASN 9 Cb -0.46 -0.50 0.94 0.00 -0.02 0.00 0.00 41.25 41.22 3dda s ASN 9 CO 0.51 0.29 1.92 0.22 -2.57 0.00 0.00 177.10 177.46 3dda h TYR 10 N 5.70 0.61 -0.04 2.20 3.20 -1.88 -1.37 116.97 125.38 3dda h TYR 10 Ca -0.39 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.50 3dda h TYR 10 Cb 1.14 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 39.22 3dda h TYR 10 CO 0.40 0.25 0.00 1.63 -1.64 0.00 0.00 178.16 178.80 3dda n LYS 11 N -4.50 1.28 -1.78 1.82 5.02 -1.26 -4.90 118.16 113.85 3dda n LYS 11 Ca 0.14 -0.42 -0.41 0.00 -2.02 0.00 0.00 58.31 55.60 3dda n LYS 11 Cb 0.46 -1.39 -0.00 0.00 -0.02 0.00 0.00 35.03 34.07 3dda n LYS 11 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3dda s ASP 12 N -1.73 6.32 0.43 4.39 1.01 -0.52 -4.91 116.67 121.66 3dda s ASP 12 Ca 0.35 3.06 -0.26 0.00 0.71 0.00 0.00 52.55 56.41 3dda s ASP 12 Cb 0.17 -2.67 -0.09 0.00 1.01 0.00 0.00 42.92 41.35 3dda s ASP 12 CO 0.28 -0.90 1.44 -2.16 0.21 0.00 0.00 175.17 174.04 3dda s PRO 13 N -1.93 3.80 0.47 8.23 0.04 -1.26 -4.96 135.00 139.39 3dda s PRO 13 Ca 0.54 2.45 -0.23 0.00 0.04 0.00 0.00 61.00 63.80 3dda s PRO 13 Cb -0.47 -2.74 -0.07 0.00 0.04 0.00 0.00 34.50 31.27 3dda s PRO 13 CO 0.62 -0.74 1.23 0.14 0.04 0.00 0.00 177.00 178.29 3dda s VAL 14 N -1.18 2.81 0.00 -0.36 -7.23 -1.26 -4.91 120.40 108.27 3dda s VAL 14 Ca 0.59 0.62 0.00 0.00 -1.81 0.00 0.00 61.98 61.38 3dda s VAL 14 Cb -0.44 -3.32 0.00 0.00 0.56 0.00 0.00 36.38 33.17 3dda s VAL 14 CO 0.58 0.01 0.28 -0.46 -0.31 0.00 0.00 175.10 175.20 3dda n ASN 15 N -0.51 0.57 0.00 4.85 0.23 0.10 -5.00 115.26 115.50 3dda n ASN 15 Ca 0.07 -0.86 0.00 0.00 -0.53 0.00 0.00 54.58 53.26 3dda n ASN 15 Cb 0.47 0.16 0.00 0.00 -2.08 0.00 0.00 39.78 38.33 3dda n ASN 15 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3dda n GLY 16 N 0.16 0.45 0.65 4.83 0.00 -0.63 -4.68 105.19 105.98 3dda n GLY 16 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3dda n GLY 16 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3dda n VAL 17 N -2.56 0.00 0.55 1.61 0.31 -1.26 -4.69 118.33 112.29 3dda n VAL 17 Ca 0.00 0.00 0.06 0.00 -0.01 0.00 0.00 64.34 64.39 3dda n VAL 17 Cb 0.10 -0.79 0.02 0.00 -0.91 0.00 0.00 33.84 32.27 3dda n VAL 17 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 3dda n ASP 18 N -1.94 1.69 -3.71 4.52 5.75 -1.26 -4.79 116.55 116.81 3dda n ASP 18 Ca 0.00 -1.35 -0.28 0.00 -0.01 0.00 0.00 54.79 53.15 3dda n ASP 18 Cb 0.00 0.26 -0.16 0.00 -1.03 0.00 0.00 41.12 40.19 3dda n ASP 18 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 3dda s ILE 19 N -1.35 0.50 0.20 2.12 1.01 -1.26 -0.52 121.20 121.89 3dda s ILE 19 Ca 0.12 -0.74 -0.19 0.00 0.00 0.00 0.00 60.65 59.84 3dda s ILE 19 Cb 0.10 -1.14 0.04 0.00 0.01 0.00 0.00 42.46 41.47 3dda s ILE 19 CO 0.25 -0.37 0.57 0.00 0.00 0.00 0.00 174.94 175.38 3dda s ALA 20 N 1.85 -1.13 -0.04 9.38 0.00 -0.80 0.01 121.76 131.02 3dda s ALA 20 Ca 0.03 -0.08 -0.20 0.00 0.00 0.00 0.00 51.96 51.71 3dda s ALA 20 Cb -0.17 0.86 -0.05 0.00 0.00 0.00 0.00 23.12 23.76 3dda s ALA 20 CO -0.15 -0.84 0.57 0.71 0.00 0.00 0.00 175.76 176.06 3dda s TYR 21 N -3.85 3.63 0.22 0.00 2.02 -1.26 -0.16 117.35 117.94 3dda s TYR 21 Ca 0.08 1.12 0.00 0.00 -0.37 0.00 0.00 57.07 57.90 3dda s TYR 21 Cb -0.02 -2.61 -0.05 0.00 -0.40 0.00 0.00 41.96 38.89 3dda s TYR 21 CO -0.03 0.28 0.10 0.96 -1.57 0.00 0.00 175.55 175.28 3dda s ILE 22 N 0.12 0.33 0.03 2.71 -4.36 0.16 -1.41 121.20 118.78 3dda s ILE 22 Ca 0.30 -1.99 0.03 0.00 -0.26 0.00 0.00 60.65 58.74 3dda s ILE 22 Cb -0.17 -2.49 -0.02 0.00 1.25 0.00 0.00 42.46 41.03 3dda s ILE 22 CO 0.15 -0.09 -0.10 -0.54 0.24 0.00 0.00 174.94 174.60 3dda s LYS 23 N -4.07 0.70 0.12 0.37 1.02 -0.52 -1.27 119.74 116.09 3dda s LYS 23 Ca 0.36 -0.62 0.05 0.00 0.02 0.00 0.00 55.97 55.77 3dda s LYS 23 Cb 0.07 -0.63 -0.04 0.00 -0.52 0.00 0.00 37.83 36.71 3dda s LYS 23 CO 0.11 0.15 0.07 0.96 -0.92 0.00 0.00 175.35 175.72 3dda s ILE 24 N -0.83 4.31 -1.21 2.17 -4.36 -1.26 -1.27 121.20 118.75 3dda s ILE 24 Ca -0.02 -1.00 -0.17 0.00 -0.26 0.00 0.00 60.65 59.20 3dda s ILE 24 Cb -0.07 -3.12 -0.03 0.00 1.25 0.00 0.00 42.46 40.49 3dda s ILE 24 CO 0.01 0.02 2.10 -0.81 0.24 0.00 0.00 174.94 176.49 3dda n PRO 25 N 0.14 2.39 -0.60 0.37 -0.04 -1.26 -4.65 135.00 131.35 3dda n PRO 25 Ca -0.09 -2.38 0.08 0.00 -0.04 0.00 0.00 63.50 61.07 3dda n PRO 25 Cb 0.53 -3.19 0.33 0.00 -0.04 0.00 0.00 33.50 31.13 3dda n PRO 25 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 3dda n ASN 26 N 6.87 4.47 -1.83 3.54 6.94 -1.26 -4.90 115.26 129.08 3dda n ASN 26 Ca 0.51 -2.48 -0.19 0.00 -0.02 0.00 0.00 54.58 52.39 3dda n ASN 26 Cb 0.40 -0.57 -0.06 0.00 -2.36 0.00 0.00 39.78 37.19 3dda n ASN 26 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3dda n ALA 27 N 0.89 -0.41 -3.07 -2.53 0.00 -1.26 -4.91 120.51 109.22 3dda n ALA 27 Ca 0.23 0.26 -0.01 0.00 0.00 0.00 0.00 53.44 53.92 3dda n ALA 27 Cb 0.86 -1.96 -0.00 0.00 0.00 0.00 0.00 19.45 18.35 3dda n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dda n GLY 28 N -0.55 3.57 3.86 0.00 0.00 -1.26 -5.16 105.19 105.65 3dda n GLY 28 Ca -0.20 -1.55 -0.32 0.00 0.00 0.00 0.00 46.02 43.95 3dda n GLY 28 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dda s GLN 29 N -2.07 3.25 -0.04 1.61 -1.52 -1.26 -5.05 119.66 114.58 3dda s GLN 29 Ca 0.02 -0.47 -0.30 0.00 -1.95 0.00 0.00 55.36 52.66 3dda s GLN 29 Cb 0.00 -2.96 0.08 0.00 -0.22 0.00 0.00 33.01 29.92 3dda s GLN 29 CO 0.02 0.62 0.74 0.00 -0.25 0.00 0.00 175.29 176.42 3dda s MET 30 N -2.20 0.98 0.34 2.91 0.23 -1.26 -5.12 119.30 115.18 3dda s MET 30 Ca 0.30 0.11 -0.22 0.00 -1.03 0.00 0.00 55.69 54.84 3dda s MET 30 Cb -0.13 0.46 -0.10 0.00 -1.53 0.00 0.00 34.83 33.54 3dda s MET 30 CO 0.22 -0.33 0.90 -0.65 -2.03 0.00 0.00 175.02 173.12 3dda s GLN 31 N -1.61 4.37 0.48 3.16 -1.52 -1.26 -4.99 119.66 118.28 3dda s GLN 31 Ca -0.07 1.13 -0.24 0.00 -1.95 0.00 0.00 55.36 54.24 3dda s GLN 31 Cb -0.00 -2.57 -0.08 0.00 -0.22 0.00 0.00 33.01 30.14 3dda s GLN 31 CO 0.04 0.18 1.37 -2.30 -0.25 0.00 0.00 175.29 174.33 3dda n PRO 32 N 0.10 1.99 -4.71 2.91 -0.02 -1.26 -4.93 135.00 129.08 3dda n PRO 32 Ca 0.03 0.72 -0.30 0.00 -2.02 0.00 0.00 63.50 61.92 3dda n PRO 32 Cb 0.52 -2.55 -0.13 0.00 -0.02 0.00 0.00 33.50 31.31 3dda n PRO 32 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3dda s VAL 33 N -1.23 2.49 -0.03 -1.45 -7.23 -0.40 -4.82 120.40 107.73 3dda s VAL 33 Ca 0.65 -1.34 -0.30 0.00 -1.81 0.00 0.00 61.98 59.17 3dda s VAL 33 Cb -0.45 -2.03 -0.04 0.00 0.56 0.00 0.00 36.38 34.42 3dda s VAL 33 CO 0.55 0.31 1.20 -0.75 -0.31 0.00 0.00 175.10 176.10 3dda s LYS 34 N -1.46 4.37 0.17 4.82 2.20 -1.26 -0.67 119.74 127.91 3dda s LYS 34 Ca 0.14 1.69 0.06 0.00 -0.36 0.00 0.00 55.97 57.50 3dda s LYS 34 Cb -0.10 -3.52 -0.04 0.00 -1.51 0.00 0.00 37.83 32.65 3dda s LYS 34 CO 0.04 -0.41 -0.13 0.00 -0.36 0.00 0.00 175.35 174.49 3dda s ALA 35 N 2.00 1.76 -0.08 3.13 0.00 0.77 -4.30 121.76 125.05 3dda s ALA 35 Ca 0.57 -1.56 0.01 0.00 0.00 0.00 0.00 51.96 50.98 3dda s ALA 35 Cb -0.26 -0.04 0.02 0.00 0.00 0.00 0.00 23.12 22.84 3dda s ALA 35 CO 0.23 0.02 -0.10 -0.06 0.00 0.00 0.00 175.76 175.86 3dda s PHE 36 N -2.98 1.34 -0.53 0.00 0.08 -0.20 -1.90 117.98 113.80 3dda s PHE 36 Ca 0.19 -0.54 -0.21 0.00 0.12 0.00 0.00 56.93 56.49 3dda s PHE 36 Cb -0.00 -1.05 0.05 0.00 -0.57 0.00 0.00 43.02 41.45 3dda s PHE 36 CO 0.04 -0.33 0.74 0.21 -0.10 0.00 0.00 175.22 175.78 3dda s LYS 37 N 1.03 3.19 0.15 0.44 2.20 0.32 -0.08 119.74 126.97 3dda s LYS 37 Ca -0.08 -0.70 0.24 0.00 -0.36 0.00 0.00 55.97 55.08 3dda s LYS 37 Cb -0.15 -4.09 0.39 0.00 -1.51 0.00 0.00 37.83 32.47 3dda s LYS 37 CO -0.00 -1.33 1.38 -0.84 -0.36 0.00 0.00 175.35 174.19 3dda h ILE 38 N 5.92 0.00 -2.46 5.43 3.07 -1.63 -3.47 117.51 124.36 3dda h ILE 38 Ca -0.27 -0.53 0.08 0.00 1.55 0.00 0.00 64.86 65.69 3dda h ILE 38 Cb 1.09 1.18 -0.14 0.00 -0.27 0.00 0.00 36.82 38.67 3dda h ILE 38 CO 1.01 0.00 0.42 -2.28 -1.05 0.00 0.00 178.15 176.25 3dda s HIS 39 N -3.17 -0.39 0.04 0.16 5.04 -1.15 -4.37 115.29 111.44 3dda s HIS 39 Ca 0.06 0.24 -0.36 0.00 -1.54 0.00 0.00 55.06 53.46 3dda s HIS 39 Cb 0.13 0.54 -0.15 0.00 0.04 0.00 0.00 32.58 33.14 3dda s HIS 39 CO 0.71 -0.63 1.53 -1.71 -2.34 0.00 0.00 174.74 172.30 3dda n ASN 40 N -0.28 2.41 0.00 9.88 5.15 -1.26 -0.85 115.26 130.30 3dda n ASN 40 Ca -0.11 1.08 0.00 0.00 -0.60 0.00 0.00 54.58 54.96 3dda n ASN 40 Cb 0.63 -1.28 0.00 0.00 -0.53 0.00 0.00 39.78 38.60 3dda n ASN 40 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 3dda n LYS 41 N 3.67 -0.32 -4.09 1.20 4.76 -1.26 -4.92 118.16 117.19 3dda n LYS 41 Ca 0.20 0.08 -0.26 0.00 -2.87 0.00 0.00 58.31 55.45 3dda n LYS 41 Cb 0.22 -3.50 -0.17 0.00 -1.84 0.00 0.00 35.03 29.74 3dda n LYS 41 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3dda s ILE 42 N -2.32 1.09 0.24 -0.18 1.01 -0.03 -1.16 121.20 119.85 3dda s ILE 42 Ca 0.00 -0.36 0.11 0.00 0.00 0.00 0.00 60.65 60.40 3dda s ILE 42 Cb 0.00 -1.07 -0.05 0.00 0.01 0.00 0.00 42.46 41.35 3dda s ILE 42 CO 0.00 0.37 -0.21 0.26 0.00 0.00 0.00 174.94 175.36 3dda s TRP 43 N 1.41 2.21 -0.07 3.97 0.52 -0.32 -1.69 118.94 124.97 3dda s TRP 43 Ca -0.00 -0.37 0.02 0.00 0.02 0.00 0.00 56.10 55.77 3dda s TRP 43 Cb -0.13 -1.01 0.01 0.00 -1.15 0.00 0.00 33.47 31.19 3dda s TRP 43 CO -0.05 0.60 -0.14 0.08 0.02 0.00 0.00 176.95 177.46 3dda s VAL 44 N -2.28 1.28 -0.31 4.03 1.01 0.88 -1.00 120.40 124.01 3dda s VAL 44 Ca 0.26 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.71 3dda s VAL 44 Cb -0.06 -1.16 0.08 0.00 0.00 0.00 0.00 36.38 35.25 3dda s VAL 44 CO 0.12 0.39 0.00 -0.63 0.00 0.00 0.00 175.10 174.98 3dda s ILE 45 N 0.68 2.44 -1.36 2.22 1.01 0.15 -1.04 121.20 125.30 3dda s ILE 45 Ca -0.14 -1.95 -0.09 0.00 0.00 0.00 0.00 60.65 58.48 3dda s ILE 45 Cb -0.16 -2.61 -0.07 0.00 0.01 0.00 0.00 42.46 39.63 3dda s ILE 45 CO 0.04 -0.35 2.63 -2.65 0.00 0.00 0.00 174.94 174.61 3dda n PRO 46 N 4.40 3.08 -4.06 2.79 -0.02 -1.26 -3.48 135.00 136.45 3dda n PRO 46 Ca -0.05 -1.94 -0.10 0.00 -2.02 0.00 0.00 63.50 59.40 3dda n PRO 46 Cb 0.42 -2.68 -0.11 0.00 -0.02 0.00 0.00 33.50 31.11 3dda n PRO 46 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3dda s GLU 47 N 2.67 0.53 0.26 -0.52 0.41 -1.26 -4.83 118.70 115.95 3dda s GLU 47 Ca 0.58 -0.93 -0.29 0.00 -0.41 0.00 0.00 54.97 53.92 3dda s GLU 47 Cb 0.15 0.00 -0.09 0.00 -1.78 0.00 0.00 34.13 32.41 3dda s GLU 47 CO -0.05 -0.04 1.23 1.03 -0.49 0.00 0.00 175.26 176.94 3dda s ARG 48 N -2.57 4.46 -0.88 1.61 1.81 -1.26 -0.35 118.95 121.76 3dda s ARG 48 Ca -0.04 2.01 -0.25 0.00 -1.72 0.00 0.00 55.73 55.73 3dda s ARG 48 Cb -0.02 -3.16 0.02 0.00 -0.45 0.00 0.00 34.95 31.34 3dda s ARG 48 CO -0.04 -0.08 1.52 0.34 -0.68 0.00 0.00 175.30 176.36 3dda s ASP 49 N -0.28 6.08 -0.13 0.23 2.15 -0.64 -4.66 116.67 119.42 3dda s ASP 49 Ca 0.50 -0.88 0.15 0.00 0.43 0.00 0.00 52.55 52.76 3dda s ASP 49 Cb -0.36 -2.56 0.39 0.00 -0.30 0.00 0.00 42.92 40.10 3dda s ASP 49 CO 0.43 -1.88 1.29 0.35 -0.17 0.00 0.00 175.17 175.20 3dda n THR 50 N 6.93 1.92 -0.07 1.71 -2.24 -1.26 -4.26 114.28 117.01 3dda n THR 50 Ca 0.24 -1.82 -0.10 0.00 -2.27 0.00 0.00 64.05 60.11 3dda n THR 50 Cb 0.50 -0.10 -0.06 0.00 -2.10 0.00 0.00 70.33 68.57 3dda n THR 50 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3dda n PHE 51 N -0.65 0.00 0.20 4.78 3.72 -1.26 -4.54 117.46 119.72 3dda n PHE 51 Ca 0.17 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.61 3dda n PHE 51 Cb 0.72 -0.50 0.43 0.00 -0.94 0.00 0.00 39.48 39.19 3dda n PHE 51 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 3dda h THR 52 N -0.07 1.15 -3.20 4.37 1.35 -1.93 -3.42 112.91 111.16 3dda h THR 52 Ca -0.30 -1.03 -0.56 0.00 -0.55 0.00 0.00 66.41 63.98 3dda h THR 52 Cb 1.43 1.56 -0.37 0.00 -1.73 0.00 0.00 68.15 69.05 3dda h THR 52 CO -0.07 0.29 -0.81 0.21 -0.25 0.00 0.00 175.52 174.89 3dda s ASN 53 N -6.86 2.48 0.36 5.36 3.84 -1.26 -5.00 114.94 113.85 3dda s ASN 53 Ca -0.03 -0.44 0.07 0.00 0.21 0.00 0.00 52.86 52.67 3dda s ASN 53 Cb 0.15 -0.96 0.75 0.00 -0.55 0.00 0.00 41.25 40.64 3dda s ASN 53 CO 0.70 -0.12 1.93 -0.65 -2.79 0.00 0.00 177.10 176.17 3dda h PRO 54 N 8.13 0.73 -0.03 0.43 0.11 -1.88 -1.40 132.00 138.08 3dda h PRO 54 Ca -0.31 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.76 3dda h PRO 54 Cb 1.13 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.07 3dda h PRO 54 CO 0.44 0.48 0.00 0.39 -0.21 0.00 0.00 178.00 179.10 3dda n GLU 55 N -4.50 1.20 -2.68 1.05 1.02 -1.26 -3.87 120.64 111.59 3dda n GLU 55 Ca 0.13 -0.29 -0.21 0.00 -0.02 0.00 0.00 57.16 56.77 3dda n GLU 55 Cb 0.31 -1.37 -0.00 0.00 -0.02 0.00 0.00 31.44 30.35 3dda n GLU 55 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3dda n GLU 56 N -0.54 2.52 -0.15 3.49 1.02 -0.53 -4.77 120.64 121.67 3dda n GLU 56 Ca 0.17 -4.11 0.06 0.00 -0.02 0.00 0.00 57.16 53.26 3dda n GLU 56 Cb 0.15 -1.92 0.14 0.00 -0.02 0.00 0.00 31.44 29.79 3dda n GLU 56 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dda n GLY 57 N -0.25 2.03 3.28 0.62 0.00 -1.25 -4.36 105.19 105.27 3dda n GLY 57 Ca 0.28 -0.40 -0.37 0.00 0.00 0.00 0.00 46.02 45.53 3dda n GLY 57 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3dda s ASP 58 N -1.01 5.09 0.06 1.61 2.15 -1.26 -4.93 116.67 118.38 3dda s ASP 58 Ca 0.23 -0.96 0.27 0.00 0.43 0.00 0.00 52.55 52.52 3dda s ASP 58 Cb 0.13 -1.83 0.83 0.00 -0.30 0.00 0.00 42.92 41.74 3dda s ASP 58 CO 0.17 -0.25 1.67 0.18 -0.17 0.00 0.00 175.17 176.78 3dda n LEU 59 N 4.80 0.40 -4.70 -1.34 4.77 -1.26 -4.53 117.00 115.13 3dda n LEU 59 Ca -0.14 0.35 -0.42 0.00 -0.03 0.00 0.00 56.01 55.77 3dda n LEU 59 Cb 0.46 -0.35 -0.03 0.00 -2.33 0.00 0.00 43.42 41.17 3dda n LEU 59 CO 0.30 -0.01 1.34 0.20 -1.33 0.00 0.00 177.39 177.89 3dda s ASN 60 N -3.49 6.52 0.02 -1.43 0.01 -1.26 -4.18 114.94 111.12 3dda s ASN 60 Ca 0.11 2.66 -0.30 0.00 -0.71 0.00 0.00 52.86 54.62 3dda s ASN 60 Cb 0.16 -2.58 -0.05 0.00 0.41 0.00 0.00 41.25 39.20 3dda s ASN 60 CO 0.62 -0.91 1.18 -2.16 -1.51 0.00 0.00 177.10 174.32 3dda s PRO 61 N 1.89 4.41 1.40 -0.60 0.04 -1.26 -5.04 135.00 135.84 3dda s PRO 61 Ca 0.74 1.71 -0.22 0.00 0.04 0.00 0.00 61.00 63.28 3dda s PRO 61 Cb -0.44 -3.43 0.36 0.00 0.04 0.00 0.00 34.50 31.02 3dda s PRO 61 CO 0.33 -0.31 0.94 -2.14 0.04 0.00 0.00 177.00 175.85 3dda s PRO 62 N 1.47 -2.75 0.39 0.56 0.02 -1.26 -4.87 135.00 128.56 3dda s PRO 62 Ca 0.57 0.24 -0.26 0.00 0.02 0.00 0.00 61.00 61.58 3dda s PRO 62 Cb -0.27 -1.39 -0.11 0.00 0.02 0.00 0.00 34.50 32.75 3dda s PRO 62 CO 0.27 -4.78 1.16 -0.35 -0.33 0.00 0.00 177.00 172.96 3dda n PRO 63 N -5.58 1.71 -0.13 5.54 -0.04 -1.26 -4.82 135.00 130.41 3dda n PRO 63 Ca 0.11 0.61 0.27 0.00 -0.04 0.00 0.00 63.50 64.45 3dda n PRO 63 Cb 0.59 -2.19 0.72 0.00 -0.04 0.00 0.00 33.50 32.58 3dda n PRO 63 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 3dda h GLU 64 N 2.00 0.00 -0.01 0.54 4.81 -2.00 0.55 114.58 120.47 3dda h GLU 64 Ca -0.45 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 3dda h GLU 64 Cb 1.31 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.69 3dda h GLU 64 CO 0.60 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 178.88 3dda n ALA 65 N -2.65 2.60 -1.73 2.92 0.00 -1.26 -3.26 120.51 117.13 3dda n ALA 65 Ca 0.17 -0.14 0.06 0.00 0.00 0.00 0.00 53.44 53.52 3dda n ALA 65 Cb 0.91 -1.28 0.14 0.00 0.00 0.00 0.00 19.45 19.22 3dda n ALA 65 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 3dda n LYS 66 N -0.71 1.09 -3.98 0.00 2.85 0.19 -5.04 118.16 112.56 3dda n LYS 66 Ca 0.14 -2.75 -0.36 0.00 -1.05 0.00 0.00 58.31 54.29 3dda n LYS 66 Cb 0.08 -1.18 -0.08 0.00 -0.65 0.00 0.00 35.03 33.20 3dda n LYS 66 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 3dda s GLN 67 N -2.27 3.59 1.16 -1.58 -0.21 -1.20 -4.88 119.66 114.26 3dda s GLN 67 Ca 0.34 -0.25 -0.20 0.00 0.02 0.00 0.00 55.36 55.28 3dda s GLN 67 Cb 0.33 -3.15 0.28 0.00 1.00 0.00 0.00 33.01 31.47 3dda s GLN 67 CO -0.07 0.58 1.21 0.14 -2.12 0.00 0.00 175.29 175.02 3dda s VAL 68 N -0.47 1.68 -0.01 1.09 -7.23 -1.26 -5.02 120.40 109.18 3dda s VAL 68 Ca 0.11 0.00 -0.14 0.00 -1.81 0.00 0.00 61.98 60.14 3dda s VAL 68 Cb -0.12 -2.68 -0.08 0.00 0.56 0.00 0.00 36.38 34.06 3dda s VAL 68 CO 0.02 0.00 0.71 1.55 -0.31 0.00 0.00 175.10 177.07 3dda h PRO 69 N -2.39 -0.49 -4.40 4.82 0.13 -1.97 -3.40 132.00 124.30 3dda h PRO 69 Ca -0.43 0.03 -0.73 0.00 -0.87 0.00 0.00 66.00 64.00 3dda h PRO 69 Cb 1.26 0.11 -0.22 0.00 0.13 0.00 0.00 31.00 32.28 3dda h PRO 69 CO 0.29 -0.33 0.06 0.08 -0.23 0.00 0.00 178.00 177.87 3dda s VAL 70 N -3.32 5.05 -0.09 1.56 1.01 -1.26 -4.92 120.40 118.43 3dda s VAL 70 Ca -0.07 -1.41 -0.30 0.00 0.00 0.00 0.00 61.98 60.19 3dda s VAL 70 Cb 0.01 -4.46 0.12 0.00 0.00 0.00 0.00 36.38 32.04 3dda s VAL 70 CO 0.22 -1.06 0.99 -0.94 0.00 0.00 0.00 175.10 174.31 3dda s SER 71 N 3.41 -0.31 -0.13 3.32 1.04 -1.26 -5.02 113.70 114.74 3dda s SER 71 Ca 0.11 0.11 -0.06 0.00 0.48 0.00 0.00 55.95 56.59 3dda s SER 71 Cb -0.23 0.31 0.06 0.00 0.10 0.00 0.00 66.02 66.26 3dda s SER 71 CO 0.02 -0.45 0.29 -0.47 0.98 0.00 0.00 173.24 173.60 3dda s TYR 72 N -2.40 -0.43 0.05 5.02 5.04 -1.26 -5.01 117.35 118.35 3dda s TYR 72 Ca 0.04 0.98 0.08 0.00 -2.44 0.00 0.00 57.07 55.73 3dda s TYR 72 Cb -0.01 0.07 -0.03 0.00 0.35 0.00 0.00 41.96 42.34 3dda s TYR 72 CO -0.05 -0.31 -0.22 0.71 -1.34 0.00 0.00 175.55 174.34 3dda s TYR 73 N 1.78 2.46 -0.33 4.97 2.02 -1.26 -0.92 117.35 126.06 3dda s TYR 73 Ca -0.05 -0.32 -0.02 0.00 -0.37 0.00 0.00 57.07 56.31 3dda s TYR 73 Cb -0.11 -1.42 0.19 0.00 -0.40 0.00 0.00 41.96 40.22 3dda s TYR 73 CO -0.09 0.22 0.84 0.34 -1.57 0.00 0.00 175.55 175.29 3dda s ASP 74 N -1.42 -0.94 0.57 2.29 2.15 -1.26 -5.03 116.67 113.03 3dda s ASP 74 Ca 0.14 -0.19 0.38 0.00 0.43 0.00 0.00 52.55 53.30 3dda s ASP 74 Cb -0.10 1.37 2.07 0.00 -0.30 0.00 0.00 42.92 45.96 3dda s ASP 74 CO 0.04 -0.14 2.17 0.77 -0.17 0.00 0.00 175.17 177.85 3dda h SER 75 N 6.84 0.00 0.58 -0.34 4.64 -1.91 -2.18 113.55 121.17 3dda h SER 75 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3dda h SER 75 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3dda h SER 75 CO 0.01 0.00 -0.56 0.35 -0.87 0.00 0.00 176.83 175.77 3dda n THR 76 N -2.84 0.09 -1.87 2.95 -2.24 -1.26 -4.91 114.28 104.18 3dda n THR 76 Ca -0.02 -0.07 -0.42 0.00 -2.27 0.00 0.00 64.05 61.26 3dda n THR 76 Cb 0.06 0.16 -0.02 0.00 -2.10 0.00 0.00 70.33 68.43 3dda n THR 76 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3dda s TYR 77 N -3.05 2.93 -0.99 4.78 5.04 -0.82 -2.86 117.35 122.38 3dda s TYR 77 Ca 0.10 0.73 -0.05 0.00 -2.44 0.00 0.00 57.07 55.41 3dda s TYR 77 Cb 0.16 -3.98 0.01 0.00 0.35 0.00 0.00 41.96 38.50 3dda s TYR 77 CO 0.71 -3.42 0.86 -0.11 -1.34 0.00 0.00 175.55 172.25 3dda n LEU 78 N 3.00 -3.17 -0.00 6.97 7.94 -1.26 -4.85 117.00 125.62 3dda n LEU 78 Ca 0.11 -0.42 0.04 0.00 -1.11 0.00 0.00 56.01 54.62 3dda n LEU 78 Cb 0.38 -2.42 -0.04 0.00 0.53 0.00 0.00 43.42 41.87 3dda n LEU 78 CO 0.62 0.44 -0.05 -1.54 -1.11 0.00 0.00 177.39 175.76 3dda n SER 79 N -2.06 0.52 -4.68 1.96 3.41 -1.13 -4.53 113.62 107.10 3dda n SER 79 Ca -0.05 -0.65 -0.24 0.00 -0.26 0.00 0.00 58.87 57.68 3dda n SER 79 Cb 0.56 1.02 -0.07 0.00 -0.26 0.00 0.00 64.21 65.47 3dda n SER 79 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3dda s THR 80 N -1.78 3.72 0.23 6.66 -4.23 -1.26 -5.04 115.64 113.94 3dda s THR 80 Ca 0.03 -1.65 -0.08 0.00 -1.18 0.00 0.00 61.69 58.81 3dda s THR 80 Cb 0.06 -2.95 0.19 0.00 1.34 0.00 0.00 72.50 71.14 3dda s THR 80 CO 0.32 -0.28 1.88 0.44 -0.54 0.00 0.00 174.62 176.44 3dda h ASP 81 N 2.11 0.90 -0.79 3.99 3.32 -1.99 -1.45 116.42 122.51 3dda h ASP 81 Ca -0.46 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 56.53 3dda h ASP 81 Cb 1.23 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 40.54 3dda h ASP 81 CO 0.60 0.62 0.30 -1.13 -1.72 0.00 0.00 179.24 177.91 3dda h ASN 82 N 1.05 1.11 -0.68 6.45 -1.24 -1.99 0.59 115.58 120.88 3dda h ASN 82 Ca 0.33 -0.18 -0.06 0.00 0.71 0.00 0.00 56.30 57.09 3dda h ASN 82 Cb -0.02 -0.29 -0.03 0.00 0.73 0.00 0.00 38.32 38.72 3dda h ASN 82 CO -0.11 0.99 0.19 -0.33 -1.29 0.00 0.00 177.43 176.88 3dda h GLU 83 N 1.16 1.07 -0.26 6.67 5.08 -1.86 -0.91 114.58 125.53 3dda h GLU 83 Ca 0.26 -0.24 -0.10 0.00 -1.00 0.00 0.00 59.36 58.27 3dda h GLU 83 Cb 0.24 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 3dda h GLU 83 CO -0.02 0.94 -0.28 0.87 -1.00 0.00 0.00 179.01 179.52 3dda h LYS 84 N 1.00 0.51 -0.25 2.33 1.57 -0.79 0.12 116.57 121.06 3dda h LYS 84 Ca 0.21 -0.21 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 3dda h LYS 84 Cb 0.33 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 3dda h LYS 84 CO -0.00 0.74 0.04 0.22 -0.57 0.00 0.00 179.45 179.88 3dda h ASP 85 N 0.44 0.39 -0.06 0.86 3.58 -0.54 -0.94 116.42 120.16 3dda h ASP 85 Ca 0.06 -0.26 -0.09 0.00 0.42 0.00 0.00 57.03 57.17 3dda h ASP 85 Cb 0.72 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.65 3dda h ASP 85 CO 0.06 0.55 -0.22 -1.13 -2.88 0.00 0.00 179.24 175.62 3dda h ASN 86 N 0.22 0.45 -0.12 2.28 -0.00 -0.92 -1.62 115.58 115.88 3dda h ASN 86 Ca 0.08 -0.14 -0.01 0.00 -0.00 0.00 0.00 56.30 56.23 3dda h ASN 86 Cb 0.32 -0.12 -0.00 0.00 -0.00 0.00 0.00 38.32 38.51 3dda h ASN 86 CO 0.00 0.68 0.03 0.22 -0.00 0.00 0.00 177.43 178.37 3dda h TYR 87 N 0.41 0.19 -0.42 0.67 3.20 -0.53 0.89 116.97 121.38 3dda h TYR 87 Ca 0.07 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.92 3dda h TYR 87 Cb 0.61 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.80 3dda h TYR 87 CO 0.02 0.33 0.28 1.25 -1.64 0.00 0.00 178.16 178.39 3dda h LEU 88 N 0.00 0.49 -0.86 2.82 5.85 -0.96 0.05 115.31 122.71 3dda h LEU 88 Ca 0.04 -0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.64 3dda h LEU 88 Cb 0.23 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 3dda h LEU 88 CO -0.00 0.35 -0.27 0.11 -0.34 0.00 0.00 178.44 178.29 3dda h LYS 89 N 0.57 0.54 -0.20 1.25 1.57 -1.20 -1.40 116.57 117.69 3dda h LYS 89 Ca 0.15 -0.22 -0.05 0.00 -1.87 0.00 0.00 60.65 58.67 3dda h LYS 89 Cb -0.06 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 3dda h LYS 89 CO -0.03 0.76 -0.06 0.78 -0.57 0.00 0.00 179.45 180.33 3dda h GLY 90 N 1.02 0.42 1.03 3.86 0.00 -0.38 -1.22 103.07 107.81 3dda h GLY 90 Ca 0.06 -0.36 -0.05 0.00 0.00 0.00 0.00 47.33 46.99 3dda h GLY 90 CO 0.06 0.33 0.25 -2.08 0.00 0.00 0.00 176.54 175.09 3dda h VAL 91 N 0.11 1.25 -0.52 4.60 2.07 -0.93 -1.95 116.25 120.88 3dda h VAL 91 Ca 0.05 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 66.76 3dda h VAL 91 Cb 0.52 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 3dda h VAL 91 CO 0.02 0.32 0.34 0.74 0.02 0.00 0.00 177.57 179.01 3dda h THR 92 N 0.99 1.14 -0.79 2.57 2.02 -1.17 -1.57 112.91 116.11 3dda h THR 92 Ca 0.23 -0.28 -0.02 0.00 0.77 0.00 0.00 66.41 67.11 3dda h THR 92 Cb 0.25 0.39 -0.04 0.00 -1.74 0.00 0.00 68.15 67.01 3dda h THR 92 CO -0.01 0.14 0.41 0.50 0.37 0.00 0.00 175.52 176.92 3dda h LYS 93 N 0.71 1.11 -0.26 6.66 3.64 -0.92 -1.72 116.57 125.78 3dda h LYS 93 Ca 0.19 -0.14 -0.11 0.00 -1.27 0.00 0.00 60.65 59.32 3dda h LYS 93 Cb -0.06 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.53 3dda h LYS 93 CO -0.04 0.83 -0.30 -0.07 -2.27 0.00 0.00 179.45 177.59 3dda h LEU 94 N 1.11 0.55 -0.71 5.20 3.38 -0.89 -0.11 115.31 123.84 3dda h LEU 94 Ca 0.28 -0.21 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 3dda h LEU 94 Cb 0.06 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 3dda h LEU 94 CO -0.04 0.83 0.16 -0.26 0.09 0.00 0.00 178.44 179.21 3dda h PHE 95 N 0.46 1.20 -0.64 1.13 -1.00 -0.78 -0.75 116.94 116.57 3dda h PHE 95 Ca 0.06 -0.15 -0.09 0.00 2.81 0.00 0.00 57.97 60.60 3dda h PHE 95 Cb 0.76 -0.34 -0.02 0.00 3.61 0.00 0.00 35.95 39.96 3dda h PHE 95 CO 0.03 0.98 0.05 0.93 -1.61 0.00 0.00 178.31 178.69 3dda h GLU 96 N 1.08 1.09 -0.38 1.51 4.39 -0.90 0.17 114.58 121.54 3dda h GLU 96 Ca 0.22 -0.32 -0.01 0.00 0.34 0.00 0.00 59.36 59.59 3dda h GLU 96 Cb 0.40 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.92 3dda h GLU 96 CO 0.01 1.03 0.19 -0.09 -1.16 0.00 0.00 179.01 178.99 3dda h ARG 97 N 1.00 0.55 -0.26 2.33 2.43 -0.72 0.05 114.38 119.76 3dda h ARG 97 Ca 0.19 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.26 3dda h ARG 97 Cb 0.51 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 3dda h ARG 97 CO 0.02 0.47 0.07 0.82 -1.51 0.00 0.00 179.97 179.85 3dda h ILE 98 N 0.49 1.21 0.00 1.20 2.04 -0.92 -2.87 117.51 118.65 3dda h ILE 98 Ca 0.13 -0.67 -0.02 0.00 1.00 0.00 0.00 64.86 65.31 3dda h ILE 98 Cb 0.10 1.15 -0.00 0.00 -0.74 0.00 0.00 36.82 37.33 3dda h ILE 98 CO -0.02 0.22 -0.09 0.22 0.00 0.00 0.00 178.15 178.48 3dda h TYR 99 N 0.25 0.00 0.00 1.37 3.20 -0.42 -2.52 116.97 118.85 3dda h TYR 99 Ca 0.08 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.95 3dda h TYR 99 Cb 0.26 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.53 3dda h TYR 99 CO 0.01 0.09 0.00 -1.13 -1.64 0.00 0.00 178.16 175.49 3dda n SER 100 N -3.53 0.35 -4.88 -2.11 3.41 -0.02 -4.08 113.62 102.77 3dda n SER 100 Ca -0.02 0.58 -0.30 0.00 -0.26 0.00 0.00 58.87 58.88 3dda n SER 100 Cb 0.22 -0.66 -0.05 0.00 -0.26 0.00 0.00 64.21 63.46 3dda n SER 100 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3dda s THR 101 N -3.16 5.08 0.20 6.66 -4.23 -0.95 -5.01 115.64 114.23 3dda s THR 101 Ca 0.06 -0.59 -0.10 0.00 -1.18 0.00 0.00 61.69 59.88 3dda s THR 101 Cb 0.10 -3.50 0.13 0.00 1.34 0.00 0.00 72.50 70.56 3dda s THR 101 CO 0.35 0.08 1.79 0.44 -0.54 0.00 0.00 174.62 176.73 3dda h ASP 102 N 2.93 0.92 -0.68 3.99 3.32 -1.86 -0.59 116.42 124.45 3dda h ASP 102 Ca -0.46 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 56.45 3dda h ASP 102 Cb 1.17 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 40.45 3dda h ASP 102 CO 0.71 0.79 0.41 0.25 -1.72 0.00 0.00 179.24 179.68 3dda h LEU 103 N 0.99 0.83 -0.64 1.55 5.85 -1.94 -0.42 115.31 121.52 3dda h LEU 103 Ca 0.24 -0.07 -0.09 0.00 0.84 0.00 0.00 57.88 58.81 3dda h LEU 103 Cb 0.11 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 3dda h LEU 103 CO -0.03 0.65 0.05 1.23 -0.34 0.00 0.00 178.44 180.00 3dda h GLY 104 N 0.93 1.19 1.01 3.75 0.00 -1.52 -0.64 103.07 107.79 3dda h GLY 104 Ca 0.24 -0.83 -0.04 0.00 0.00 0.00 0.00 47.33 46.70 3dda h GLY 104 CO -0.04 0.77 0.28 -0.09 0.00 0.00 0.00 176.54 177.45 3dda h ARG 105 N 1.01 1.00 -0.07 4.80 2.43 -0.71 -0.22 114.38 122.63 3dda h ARG 105 Ca 0.19 -0.18 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 3dda h ARG 105 Cb 0.51 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.89 3dda h ARG 105 CO 0.02 0.83 0.04 0.52 -1.51 0.00 0.00 179.97 179.87 3dda h MET 106 N 0.95 0.11 -0.22 0.20 2.86 -0.77 -1.08 114.93 116.98 3dda h MET 106 Ca 0.23 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.85 3dda h MET 106 Cb 0.20 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 3dda h MET 106 CO -0.02 0.18 0.15 1.25 1.06 0.00 0.00 176.91 179.53 3dda h LEU 107 N 0.00 0.26 -1.15 1.22 5.85 -0.92 -1.02 115.31 119.56 3dda h LEU 107 Ca 0.03 -0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 3dda h LEU 107 Cb 0.11 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 3dda h LEU 107 CO -0.00 0.20 -0.10 -0.07 -0.34 0.00 0.00 178.44 178.13 3dda h LEU 108 N 0.30 0.46 -0.34 2.25 3.38 -0.98 -0.28 115.31 120.09 3dda h LEU 108 Ca 0.08 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 3dda h LEU 108 Cb -0.02 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 3dda h LEU 108 CO -0.02 0.60 0.05 0.74 0.09 0.00 0.00 178.44 179.90 3dda h THR 109 N 0.45 1.24 -0.92 0.22 2.02 -0.90 -0.69 112.91 114.33 3dda h THR 109 Ca 0.09 -0.84 -0.01 0.00 0.77 0.00 0.00 66.41 66.42 3dda h THR 109 Cb 0.45 1.12 -0.04 0.00 -1.74 0.00 0.00 68.15 67.93 3dda h THR 109 CO 0.02 0.28 0.54 0.28 0.37 0.00 0.00 175.52 177.01 3dda h SER 110 N 0.41 1.11 -0.27 4.18 0.02 -0.67 -1.52 113.55 116.81 3dda h SER 110 Ca 0.10 -0.08 -0.03 0.00 -0.84 0.00 0.00 61.79 60.95 3dda h SER 110 Cb 0.36 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 3dda h SER 110 CO 0.01 0.86 0.06 0.40 -1.14 0.00 0.00 176.83 177.02 3dda h ILE 111 N 1.27 1.22 -0.32 3.27 2.04 -0.75 -0.97 117.51 123.27 3dda h ILE 111 Ca 0.33 -0.72 -0.05 0.00 1.00 0.00 0.00 64.86 65.42 3dda h ILE 111 Cb -0.03 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 3dda h ILE 111 CO -0.06 0.23 -0.02 0.58 0.00 0.00 0.00 178.15 178.88 3dda h VAL 112 N 0.27 1.20 0.00 1.67 2.07 -0.84 -1.77 116.25 118.84 3dda h VAL 112 Ca 0.08 -0.80 0.00 0.00 0.82 0.00 0.00 66.70 66.81 3dda h VAL 112 Cb 0.29 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 3dda h VAL 112 CO 0.00 0.27 0.00 0.03 0.02 0.00 0.00 177.57 177.89 3dda h ARG 113 N 0.47 0.00 -2.03 1.57 3.08 -1.10 -3.37 114.38 113.00 3dda h ARG 113 Ca 0.10 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.00 3dda h ARG 113 Cb 0.34 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.34 3dda h ARG 113 CO 0.01 0.00 -0.29 0.41 -1.07 0.00 0.00 179.97 179.03 3dda n GLY 114 N 0.98 2.84 3.67 0.04 0.00 -0.38 -4.55 105.19 107.79 3dda n GLY 114 Ca 0.04 -0.94 -0.46 0.00 0.00 0.00 0.00 46.02 44.67 3dda n GLY 114 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3dda n ILE 115 N 2.31 0.09 -1.66 -0.61 5.41 -1.26 -4.74 119.36 118.90 3dda n ILE 115 Ca 0.33 -0.02 -0.45 0.00 1.00 0.00 0.00 62.75 63.61 3dda n ILE 115 Cb 0.81 -1.64 -0.03 0.00 -0.71 0.00 0.00 39.64 38.07 3dda n ILE 115 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 3dda n PRO 116 N 3.97 2.01 -1.71 0.38 -0.02 -1.26 -4.88 135.00 133.49 3dda n PRO 116 Ca 0.18 0.72 -0.39 0.00 -2.02 0.00 0.00 63.50 61.98 3dda n PRO 116 Cb 0.30 -2.40 0.03 0.00 -0.02 0.00 0.00 33.50 31.41 3dda n PRO 116 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3dda n PHE 117 N 2.35 1.99 -2.67 6.00 7.35 -0.00 -4.89 117.46 127.58 3dda n PHE 117 Ca 0.13 0.45 -0.43 0.00 -0.76 0.00 0.00 57.45 56.85 3dda n PHE 117 Cb 0.30 -2.33 0.00 0.00 0.35 0.00 0.00 39.48 37.80 3dda n PHE 117 CO 0.00 0.00 0.00 0.91 -0.76 0.00 0.00 176.76 176.91 3dda n TRP 118 N -0.90 4.57 -1.72 -5.13 7.02 -1.26 -4.58 117.44 115.44 3dda n TRP 118 Ca 0.10 -3.09 -0.13 0.00 -1.02 0.00 0.00 57.50 53.36 3dda n TRP 118 Cb 0.43 -2.35 0.12 0.00 -2.42 0.00 0.00 31.31 27.09 3dda n TRP 118 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3dda n GLY 119 N 4.42 5.68 0.31 6.99 0.00 -1.06 -3.82 105.19 117.71 3dda n GLY 119 Ca 0.43 -1.94 0.13 0.00 0.00 0.00 0.00 46.02 44.63 3dda n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dda n GLY 120 N -0.94 -0.45 3.76 -0.02 0.00 -0.27 -4.92 105.19 102.35 3dda n GLY 120 Ca 0.37 -0.45 -0.40 0.00 0.00 0.00 0.00 46.02 45.55 3dda n GLY 120 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3dda s SER 121 N -2.45 7.57 0.00 1.61 0.15 -1.26 -4.92 113.70 114.40 3dda s SER 121 Ca 0.25 1.87 0.25 0.00 0.70 0.00 0.00 55.95 59.01 3dda s SER 121 Cb 0.19 -2.58 0.35 0.00 -1.71 0.00 0.00 66.02 62.27 3dda s SER 121 CO 0.51 0.16 1.35 1.07 1.20 0.00 0.00 173.24 177.53 3dda n THR 122 N 1.44 0.00 -3.97 6.45 5.66 -1.26 -4.80 114.28 117.80 3dda n THR 122 Ca -0.03 -0.45 -0.34 0.00 -3.05 0.00 0.00 64.05 60.18 3dda n THR 122 Cb 0.48 1.31 -0.15 0.00 -1.55 0.00 0.00 70.33 70.42 3dda n THR 122 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 3dda s ILE 123 N -2.00 2.87 0.54 1.09 1.01 -1.26 -5.01 121.20 118.44 3dda s ILE 123 Ca 0.30 -0.88 0.25 0.00 0.00 0.00 0.00 60.65 60.32 3dda s ILE 123 Cb 0.20 -2.38 0.38 0.00 0.01 0.00 0.00 42.46 40.67 3dda s ILE 123 CO 0.31 0.31 2.02 0.44 0.00 0.00 0.00 174.94 178.01 3dda h ASP 124 N 8.02 0.00 0.16 3.58 3.32 -1.92 -1.24 116.42 128.33 3dda h ASP 124 Ca -0.37 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.68 3dda h ASP 124 Cb 1.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.68 3dda h ASP 124 CO 0.59 0.00 -0.01 0.35 -1.72 0.00 0.00 179.24 178.45 3dda n THR 125 N -4.25 0.00 -4.76 0.35 -2.24 -1.25 -2.53 114.28 99.60 3dda n THR 125 Ca 0.07 -0.02 -0.24 0.00 -2.27 0.00 0.00 64.05 61.59 3dda n THR 125 Cb 0.51 -0.39 -0.15 0.00 -2.10 0.00 0.00 70.33 68.20 3dda n THR 125 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3dda s GLU 126 N -2.17 1.39 -0.23 -0.78 2.02 -0.47 -0.34 118.70 118.12 3dda s GLU 126 Ca 0.41 -0.57 -0.09 0.00 0.02 0.00 0.00 54.97 54.74 3dda s GLU 126 Cb 0.21 -1.31 -0.04 0.00 0.10 0.00 0.00 34.13 33.09 3dda s GLU 126 CO 0.40 0.32 0.12 -1.17 0.02 0.00 0.00 175.26 174.95 3dda s LEU 127 N -0.27 3.89 0.03 1.80 2.96 -0.11 -4.68 118.68 122.29 3dda s LEU 127 Ca 0.04 0.02 0.02 0.00 -0.22 0.00 0.00 54.13 53.99 3dda s LEU 127 Cb -0.07 -2.04 -0.02 0.00 0.50 0.00 0.00 46.19 44.56 3dda s LEU 127 CO -0.00 0.05 -0.08 -0.75 -1.32 0.00 0.00 176.35 174.25 3dda s LYS 128 N 1.13 0.54 0.71 1.98 2.20 -1.25 -1.12 119.74 123.93 3dda s LYS 128 Ca 0.06 -0.59 -0.11 0.00 -0.36 0.00 0.00 55.97 54.98 3dda s LYS 128 Cb -0.14 -0.41 0.02 0.00 -1.51 0.00 0.00 37.83 35.79 3dda s LYS 128 CO 0.04 0.09 1.07 0.54 -0.36 0.00 0.00 175.35 176.73 3dda s VAL 129 N -0.94 3.86 -0.30 4.02 0.11 -1.26 -1.12 120.40 124.77 3dda s VAL 129 Ca -0.05 0.60 -0.09 0.00 -2.93 0.00 0.00 61.98 59.52 3dda s VAL 129 Cb -0.07 -3.31 -0.00 0.00 -1.53 0.00 0.00 36.38 31.47 3dda s VAL 129 CO 0.00 -0.79 0.13 -0.63 -3.33 0.00 0.00 175.10 170.48 3dda s ILE 130 N -3.03 4.39 0.50 7.04 1.01 -1.26 -4.11 121.20 125.73 3dda s ILE 130 Ca 0.59 -0.50 0.28 0.00 0.00 0.00 0.00 60.65 61.02 3dda s ILE 130 Cb -0.15 -3.24 0.47 0.00 0.01 0.00 0.00 42.46 39.56 3dda s ILE 130 CO 0.55 0.08 1.85 -2.24 0.00 0.00 0.00 174.94 175.18 3dda h ASP 131 N 8.31 0.14 0.01 3.58 3.04 -1.97 -0.91 116.42 128.62 3dda h ASP 131 Ca -0.32 0.02 0.00 0.00 -3.24 0.00 0.00 57.03 53.49 3dda h ASP 131 Cb 1.14 -0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.43 3dda h ASP 131 CO 0.61 0.04 0.00 0.35 -2.04 0.00 0.00 179.24 178.20 3dda n THR 132 N -4.35 0.01 -1.05 1.15 -2.24 -1.26 -2.22 114.28 104.32 3dda n THR 132 Ca 0.21 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.98 3dda n THR 132 Cb 0.97 -0.63 0.31 0.00 -2.10 0.00 0.00 70.33 68.87 3dda n THR 132 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3dda n ASN 133 N -1.01 4.63 -4.27 3.42 3.02 -0.34 -4.66 115.26 116.04 3dda n ASN 133 Ca 0.18 -3.20 -0.17 0.00 -0.03 0.00 0.00 54.58 51.36 3dda n ASN 133 Cb 0.08 -0.70 -0.10 0.00 -0.61 0.00 0.00 39.78 38.46 3dda n ASN 133 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3dda s ILE 135 N -3.71 1.22 -0.32 0.00 -4.36 -0.26 -4.38 121.20 109.39 3dda s ILE 135 Ca 0.37 -1.85 -0.10 0.00 -0.26 0.00 0.00 60.65 58.81 3dda s ILE 135 Cb 0.07 -1.64 -0.01 0.00 1.25 0.00 0.00 42.46 42.13 3dda s ILE 135 CO 0.14 -0.57 0.17 0.20 0.24 0.00 0.00 174.94 175.12 3dda s ASN 136 N -2.76 5.66 -0.20 4.36 0.01 -0.39 -1.13 114.94 120.48 3dda s ASN 136 Ca 0.12 -0.49 -0.11 0.00 -0.71 0.00 0.00 52.86 51.67 3dda s ASN 136 Cb -0.02 -2.03 -0.05 0.00 0.41 0.00 0.00 41.25 39.56 3dda s ASN 136 CO 0.02 -0.20 0.17 -0.69 -1.51 0.00 0.00 177.10 174.89 3dda s VAL 137 N 1.64 5.37 -0.17 1.60 1.01 -0.05 -1.44 120.40 128.37 3dda s VAL 137 Ca 0.05 0.27 -0.29 0.00 0.00 0.00 0.00 61.98 62.00 3dda s VAL 137 Cb -0.17 -3.51 -0.01 0.00 0.00 0.00 0.00 36.38 32.69 3dda s VAL 137 CO 0.07 0.40 1.15 -0.63 0.00 0.00 0.00 175.10 176.09 3dda s ILE 138 N 0.58 4.47 0.72 2.22 1.01 -0.50 -1.32 121.20 128.39 3dda s ILE 138 Ca 0.10 1.78 -0.08 0.00 0.00 0.00 0.00 60.65 62.44 3dda s ILE 138 Cb -0.12 -4.15 0.06 0.00 0.01 0.00 0.00 42.46 38.26 3dda s ILE 138 CO 0.01 -0.12 1.05 -1.10 0.00 0.00 0.00 174.94 174.78 3dda s GLN 139 N 3.06 2.22 0.56 2.79 -0.21 0.11 -4.49 119.66 123.70 3dda s GLN 139 Ca 0.50 -0.11 0.27 0.00 0.02 0.00 0.00 55.36 56.04 3dda s GLN 139 Cb -0.19 -2.11 1.48 0.00 1.00 0.00 0.00 33.01 33.18 3dda s GLN 139 CO 0.13 -1.28 2.01 -1.35 -2.12 0.00 0.00 175.29 172.67 3dda h PRO 140 N -0.69 0.00 -0.16 2.91 0.11 -1.86 0.34 132.00 132.65 3dda h PRO 140 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3dda h PRO 140 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 3dda h PRO 140 CO 0.62 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.01 3dda n ASP 141 N -4.09 1.40 0.00 -2.05 5.75 -1.26 -4.91 116.55 111.39 3dda n ASP 141 Ca 0.07 -1.71 0.00 0.00 -0.01 0.00 0.00 54.79 53.14 3dda n ASP 141 Cb 0.53 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.52 3dda n ASP 141 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3dda n GLY 142 N 1.05 1.67 3.89 6.12 0.00 0.11 -5.04 105.19 113.00 3dda n GLY 142 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 3dda n GLY 142 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dda s SER 143 N -3.14 6.03 -0.08 1.61 1.04 -1.26 -4.70 113.70 113.20 3dda s SER 143 Ca 0.00 1.06 -0.06 0.00 0.48 0.00 0.00 55.95 57.43 3dda s SER 143 Cb 0.00 -2.17 -0.04 0.00 0.10 0.00 0.00 66.02 63.91 3dda s SER 143 CO 0.00 -0.85 0.16 -0.31 0.98 0.00 0.00 173.24 173.22 3dda s TYR 144 N -3.00 3.58 -0.03 5.02 2.02 -1.26 0.08 117.35 123.77 3dda s TYR 144 Ca 0.52 0.48 0.03 0.00 -0.37 0.00 0.00 57.07 57.74 3dda s TYR 144 Cb -0.11 -1.91 -0.00 0.00 -0.40 0.00 0.00 41.96 39.54 3dda s TYR 144 CO 0.49 0.70 -0.12 -0.98 -1.57 0.00 0.00 175.55 174.07 3dda s ARG 145 N -1.36 1.19 -0.11 -0.62 1.70 -0.43 -4.92 118.95 114.40 3dda s ARG 145 Ca 0.20 -0.43 -0.28 0.00 -0.47 0.00 0.00 55.73 54.75 3dda s ARG 145 Cb -0.12 -1.10 -0.02 0.00 -0.57 0.00 0.00 34.95 33.14 3dda s ARG 145 CO 0.09 0.19 0.92 0.45 -1.08 0.00 0.00 175.30 175.88 3dda s SER 146 N 0.01 7.15 -0.09 -2.89 0.15 -1.26 -0.87 113.70 115.90 3dda s SER 146 Ca -0.01 1.40 0.02 0.00 0.70 0.00 0.00 55.95 58.07 3dda s SER 146 Cb -0.08 -2.51 0.01 0.00 -1.71 0.00 0.00 66.02 61.73 3dda s SER 146 CO 0.01 -0.37 -0.17 -0.70 1.20 0.00 0.00 173.24 173.21 3dda s GLU 147 N 1.79 2.30 0.37 5.44 2.12 -0.29 -4.96 118.70 125.47 3dda s GLU 147 Ca 0.45 -0.61 -0.25 0.00 0.36 0.00 0.00 54.97 54.92 3dda s GLU 147 Cb -0.18 -1.86 -0.09 0.00 0.26 0.00 0.00 34.13 32.25 3dda s GLU 147 CO 0.18 0.03 1.04 -1.21 -0.54 0.00 0.00 175.26 174.75 3dda s GLU 148 N 0.72 4.31 0.13 4.30 2.02 -1.26 -1.11 118.70 127.81 3dda s GLU 148 Ca -0.12 1.53 -0.13 0.00 0.02 0.00 0.00 54.97 56.27 3dda s GLU 148 Cb -0.16 -2.69 0.02 0.00 0.10 0.00 0.00 34.13 31.40 3dda s GLU 148 CO 0.03 -0.02 0.34 -0.48 0.02 0.00 0.00 175.26 175.15 3dda s LEU 149 N -2.35 0.74 -0.16 1.80 2.34 -1.06 -4.84 118.68 115.16 3dda s LEU 149 Ca 0.54 -0.53 0.08 0.00 0.06 0.00 0.00 54.13 54.28 3dda s LEU 149 Cb -0.23 1.54 -0.16 0.00 -0.56 0.00 0.00 46.19 46.78 3dda s LEU 149 CO 0.29 -0.85 -0.03 0.59 -1.06 0.00 0.00 176.35 175.29 3dda n ASN 150 N -0.19 1.89 -3.86 1.48 4.13 -0.31 -4.55 115.26 113.85 3dda n ASN 150 Ca -0.13 -0.04 -0.12 0.00 1.68 0.00 0.00 54.58 55.97 3dda n ASN 150 Cb 0.63 0.41 -0.12 0.00 -1.54 0.00 0.00 39.78 39.16 3dda n ASN 150 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 3dda s LEU 151 N -5.45 1.69 -0.05 3.41 2.96 -0.80 -1.39 118.68 119.04 3dda s LEU 151 Ca -0.14 0.07 0.01 0.00 -0.22 0.00 0.00 54.13 53.86 3dda s LEU 151 Cb 0.05 0.35 0.02 0.00 0.50 0.00 0.00 46.19 47.11 3dda s LEU 151 CO 0.53 -0.10 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.71 3dda s VAL 152 N -0.28 0.65 -0.24 1.68 1.01 0.47 -1.18 120.40 122.52 3dda s VAL 152 Ca -0.03 -0.19 -0.08 0.00 0.00 0.00 0.00 61.98 61.68 3dda s VAL 152 Cb -0.02 -0.65 -0.04 0.00 0.00 0.00 0.00 36.38 35.67 3dda s VAL 152 CO 0.00 0.25 0.09 -0.63 0.00 0.00 0.00 175.10 174.82 3dda s ILE 153 N 0.90 4.65 0.15 2.22 -1.09 -0.17 -0.31 121.20 127.55 3dda s ILE 153 Ca -0.11 -0.06 0.05 0.00 -2.23 0.00 0.00 60.65 58.29 3dda s ILE 153 Cb -0.15 -3.17 -0.04 0.00 -1.58 0.00 0.00 42.46 37.53 3dda s ILE 153 CO 0.01 0.35 -0.11 -0.51 -1.23 0.00 0.00 174.94 173.45 3dda s ILE 154 N 1.32 1.24 0.80 2.92 2.07 -0.31 -0.67 121.20 128.56 3dda s ILE 154 Ca 0.05 -2.02 -0.11 0.00 -1.41 0.00 0.00 60.65 57.17 3dda s ILE 154 Cb -0.15 -1.80 0.07 0.00 0.13 0.00 0.00 42.46 40.71 3dda s ILE 154 CO 0.05 -0.68 1.10 -0.83 -1.91 0.00 0.00 174.94 172.66 3dda s GLY 155 N -3.06 1.67 0.89 1.50 0.00 0.52 -1.01 107.32 107.83 3dda s GLY 155 Ca 0.16 0.25 -0.11 0.00 0.00 0.00 0.00 44.72 45.02 3dda s GLY 155 CO 0.01 0.62 1.10 2.56 0.00 0.00 0.00 173.10 177.39 3dda s PRO 156 N -4.89 1.28 0.00 2.90 0.04 -1.26 -1.62 135.00 131.45 3dda s PRO 156 Ca 0.62 1.06 0.00 0.00 0.04 0.00 0.00 61.00 62.72 3dda s PRO 156 Cb -0.18 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.57 3dda s PRO 156 CO 0.56 -2.29 0.00 0.45 0.04 0.00 0.00 177.00 175.76 3dda n SER 157 N -3.95 0.00 0.01 6.66 2.88 -1.26 -2.09 113.62 115.87 3dda n SER 157 Ca 0.08 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.52 3dda n SER 157 Cb 0.54 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.96 3dda n SER 157 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3dda h ALA 158 N -1.83 -0.23 -1.51 -1.46 0.00 -1.85 -3.34 119.26 109.04 3dda h ALA 158 Ca 0.00 0.03 -0.55 0.00 0.00 0.00 0.00 54.91 54.39 3dda h ALA 158 Cb 0.00 0.45 -0.08 0.00 0.00 0.00 0.00 17.79 18.16 3dda h ALA 158 CO 0.00 -0.71 1.00 0.34 0.00 0.00 0.00 179.25 179.88 3dda s ASP 159 N -4.97 6.35 0.42 0.00 -1.08 -1.26 -4.46 116.67 111.68 3dda s ASP 159 Ca -0.15 -0.08 0.12 0.00 -0.52 0.00 0.00 52.55 51.92 3dda s ASP 159 Cb 0.10 -2.55 0.98 0.00 -1.46 0.00 0.00 42.92 39.99 3dda s ASP 159 CO 0.67 -1.59 1.98 0.40 0.52 0.00 0.00 175.17 177.15 3dda h ILE 160 N 6.12 0.93 -0.27 4.11 2.04 -1.15 -2.67 117.51 126.61 3dda h ILE 160 Ca -0.26 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.44 3dda h ILE 160 Cb 1.05 0.42 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 3dda h ILE 160 CO 1.22 0.08 0.00 2.30 0.00 0.00 0.00 178.15 181.75 3dda n ILE 161 N -4.47 0.35 -2.82 -0.67 -5.35 -1.26 -4.62 119.36 100.52 3dda n ILE 161 Ca 0.09 -0.48 -0.44 0.00 -0.27 0.00 0.00 62.75 61.65 3dda n ILE 161 Cb 0.32 0.48 0.00 0.00 -1.74 0.00 0.00 39.64 38.70 3dda n ILE 161 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3dda n GLN 162 N 0.66 3.43 -2.81 6.28 1.13 -1.01 -4.99 117.38 120.07 3dda n GLN 162 Ca 0.16 -3.79 -0.39 0.00 -1.94 0.00 0.00 57.00 51.05 3dda n GLN 162 Cb 0.39 -3.01 -0.06 0.00 0.11 0.00 0.00 30.24 27.67 3dda n GLN 162 CO 0.00 0.00 0.00 -0.06 -1.44 0.00 0.00 177.06 175.56 3dda s PHE 163 N 1.24 3.85 -0.19 1.08 0.08 -1.26 -4.82 117.98 117.97 3dda s PHE 163 Ca 0.42 1.80 -0.36 0.00 0.12 0.00 0.00 56.93 58.91 3dda s PHE 163 Cb -0.00 -2.91 0.15 0.00 -0.57 0.00 0.00 43.02 39.69 3dda s PHE 163 CO 0.00 0.37 1.39 -1.83 -0.10 0.00 0.00 175.22 175.06 3dda s GLU 164 N -1.54 0.06 -0.11 0.44 -1.05 -0.99 -4.97 118.70 110.54 3dda s GLU 164 Ca 0.44 -0.03 -0.21 0.00 -0.15 0.00 0.00 54.97 55.02 3dda s GLU 164 Cb -0.22 0.02 -0.04 0.00 -0.44 0.00 0.00 34.13 33.45 3dda s GLU 164 CO 0.28 -0.03 0.58 0.00 0.95 0.00 0.00 175.26 177.04 3dda s LYS 166 N 0.84 1.59 -0.00 0.00 -0.14 0.11 -4.94 119.74 117.20 3dda s LYS 166 Ca 0.31 -1.00 -0.19 0.00 -1.36 0.00 0.00 55.97 53.72 3dda s LYS 166 Cb -0.16 -1.72 0.04 0.00 -1.68 0.00 0.00 37.83 34.30 3dda s LYS 166 CO 0.13 0.44 0.42 -1.54 -0.76 0.00 0.00 175.35 174.05 3dda s SER 167 N -1.16 -0.32 0.11 2.83 1.04 -1.26 0.21 113.70 115.14 3dda s SER 167 Ca 0.09 0.18 -0.30 0.00 0.48 0.00 0.00 55.95 56.40 3dda s SER 167 Cb -0.09 0.40 -0.06 0.00 0.10 0.00 0.00 66.02 66.36 3dda s SER 167 CO 0.02 -0.56 1.03 -0.36 0.98 0.00 0.00 173.24 174.36 3dda s PHE 168 N -1.70 3.68 0.85 5.02 0.08 -1.26 -5.04 117.98 119.61 3dda s PHE 168 Ca -0.10 1.67 -0.07 0.00 0.12 0.00 0.00 56.93 58.54 3dda s PHE 168 Cb -0.03 -3.17 0.18 0.00 -0.57 0.00 0.00 43.02 39.43 3dda s PHE 168 CO 0.03 -0.25 1.16 0.20 -0.10 0.00 0.00 175.22 176.27 3dda s GLY 169 N 0.24 1.78 0.24 4.36 0.00 -1.26 -4.93 107.32 107.75 3dda s GLY 169 Ca 0.50 -1.67 0.11 0.00 0.00 0.00 0.00 44.72 43.66 3dda s GLY 169 CO 0.31 -0.95 -0.19 -1.58 0.00 0.00 0.00 173.10 170.68 3dda s HIS 170 N -3.50 2.35 0.27 1.90 2.46 -1.23 -5.03 115.29 112.49 3dda s HIS 170 Ca 0.72 -0.32 -0.02 0.00 0.47 0.00 0.00 55.06 55.91 3dda s HIS 170 Cb -0.03 -1.08 0.35 0.00 -0.13 0.00 0.00 32.58 31.69 3dda s HIS 170 CO 0.49 0.62 1.78 0.93 -2.47 0.00 0.00 174.74 176.09 3dda h GLU 171 N 2.62 0.80 0.00 2.88 4.39 -2.05 -3.36 114.58 119.86 3dda h GLU 171 Ca -0.43 -0.20 -0.01 0.00 0.34 0.00 0.00 59.36 59.06 3dda h GLU 171 Cb 1.24 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 29.78 3dda h GLU 171 CO 0.55 0.78 -1.07 0.28 -1.16 0.00 0.00 179.01 178.40 3dda n VAL 172 N -4.23 0.04 -3.73 3.13 0.31 -1.26 -5.06 118.33 107.54 3dda n VAL 172 Ca 0.03 -0.04 -0.37 0.00 -0.01 0.00 0.00 64.34 63.95 3dda n VAL 172 Cb 0.28 -0.36 -0.06 0.00 -0.91 0.00 0.00 33.84 32.79 3dda n VAL 172 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3dda s LEU 173 N -3.66 4.41 -1.12 7.52 1.43 -1.26 -5.02 118.68 120.99 3dda s LEU 173 Ca -0.01 0.66 -0.08 0.00 -1.03 0.00 0.00 54.13 53.67 3dda s LEU 173 Cb 0.01 -2.37 0.28 0.00 0.03 0.00 0.00 46.19 44.14 3dda s LEU 173 CO 0.05 0.35 1.16 0.59 0.23 0.00 0.00 176.35 178.73 3dda n ASN 174 N 1.74 5.63 -0.26 2.29 5.03 -1.26 -3.54 115.26 124.88 3dda n ASN 174 Ca -0.16 -3.08 0.22 0.00 0.87 0.00 0.00 54.58 52.43 3dda n ASN 174 Cb 0.54 -1.37 0.56 0.00 -1.02 0.00 0.00 39.78 38.48 3dda n ASN 174 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 3dda h LEU 175 N 6.53 0.34 -0.32 3.41 3.38 -1.93 -0.36 115.31 126.36 3dda h LEU 175 Ca 0.18 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.20 3dda h LEU 175 Cb 0.84 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.58 3dda h LEU 175 CO 1.06 0.11 -0.10 0.35 0.09 0.00 0.00 178.44 179.94 3dda n THR 176 N -4.49 0.00 -0.68 0.22 -2.24 -1.26 -0.12 114.28 105.71 3dda n THR 176 Ca 0.21 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 3dda n THR 176 Cb 0.82 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.04 3dda n THR 176 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3dda n ARG 177 N -0.80 1.14 -0.10 -0.78 1.74 -0.28 -1.29 116.66 116.28 3dda n ARG 177 Ca 0.15 -0.95 0.08 0.00 -0.77 0.00 0.00 57.85 56.37 3dda n ARG 177 Cb 0.28 -0.71 0.13 0.00 -1.02 0.00 0.00 32.46 31.14 3dda n ARG 177 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 3dda n ASN 178 N -0.22 2.45 0.00 0.55 6.94 -0.39 -4.81 115.26 119.78 3dda n ASN 178 Ca 0.00 -2.90 0.00 0.00 -0.02 0.00 0.00 54.58 51.66 3dda n ASN 178 Cb 0.42 -0.37 0.00 0.00 -2.36 0.00 0.00 39.78 37.47 3dda n ASN 178 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3dda n GLY 179 N -1.18 2.95 0.18 4.83 0.00 0.10 -4.76 105.19 107.32 3dda n GLY 179 Ca 0.14 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 3dda n GLY 179 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3dda h TYR 180 N 0.00 -0.35 0.00 1.61 -1.99 -1.78 -3.36 116.97 111.10 3dda h TYR 180 Ca 0.00 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.72 3dda h TYR 180 Cb 0.00 0.12 0.00 0.00 2.00 0.00 0.00 36.73 38.85 3dda h TYR 180 CO 0.00 -0.02 0.00 0.41 -0.00 0.00 0.00 178.16 178.55 3dda n GLY 181 N -0.34 -0.38 3.29 3.88 0.00 0.82 -0.82 105.19 111.64 3dda n GLY 181 Ca -0.09 -1.64 -0.11 0.00 0.00 0.00 0.00 46.02 44.18 3dda n GLY 181 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dda s SER 182 N -2.09 -0.17 0.20 1.61 1.04 -1.22 -4.20 113.70 108.87 3dda s SER 182 Ca 0.00 -0.27 -0.32 0.00 0.48 0.00 0.00 55.95 55.83 3dda s SER 182 Cb 0.00 0.42 -0.12 0.00 0.10 0.00 0.00 66.02 66.41 3dda s SER 182 CO 0.00 -0.74 1.69 0.41 0.98 0.00 0.00 173.24 175.58 3dda n THR 183 N 0.13 0.00 -3.91 2.02 -1.04 -1.26 -4.50 114.28 105.72 3dda n THR 183 Ca -0.17 -0.00 -0.35 0.00 -2.04 0.00 0.00 64.05 61.49 3dda n THR 183 Cb 0.62 -1.89 -0.09 0.00 -1.82 0.00 0.00 70.33 67.15 3dda n THR 183 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 3dda s GLN 184 N 1.12 4.01 -0.35 -2.82 -1.52 -0.49 -4.43 119.66 115.18 3dda s GLN 184 Ca 0.76 -0.29 -0.07 0.00 -1.95 0.00 0.00 55.36 53.81 3dda s GLN 184 Cb -0.54 -3.28 0.04 0.00 -0.22 0.00 0.00 33.01 29.01 3dda s GLN 184 CO 0.33 0.32 0.13 0.71 -0.25 0.00 0.00 175.29 176.53 3dda s TYR 185 N 0.27 3.27 -0.36 0.91 2.02 0.13 -0.40 117.35 123.20 3dda s TYR 185 Ca 0.05 -1.40 -0.17 0.00 -0.37 0.00 0.00 57.07 55.19 3dda s TYR 185 Cb -0.12 -2.38 -0.00 0.00 -0.40 0.00 0.00 41.96 39.06 3dda s TYR 185 CO -0.00 -0.74 0.43 0.42 -1.57 0.00 0.00 175.55 174.09 3dda s ILE 186 N 1.42 5.10 -0.19 2.71 1.01 0.58 0.08 121.20 131.90 3dda s ILE 186 Ca -0.01 0.10 -0.29 0.00 0.00 0.00 0.00 60.65 60.45 3dda s ILE 186 Cb -0.20 -3.90 -0.00 0.00 0.01 0.00 0.00 42.46 38.36 3dda s ILE 186 CO 0.03 -0.18 1.17 -0.13 0.00 0.00 0.00 174.94 175.83 3dda s ARG 187 N 2.17 4.25 0.01 2.79 0.52 -0.02 -1.16 118.95 127.50 3dda s ARG 187 Ca 0.14 1.54 -0.27 0.00 -0.52 0.00 0.00 55.73 56.62 3dda s ARG 187 Cb -0.16 -3.71 0.06 0.00 0.52 0.00 0.00 34.95 31.66 3dda s ARG 187 CO 0.13 -0.67 0.62 0.12 0.02 0.00 0.00 175.30 175.51 3dda s PHE 188 N 3.36 -0.57 -0.02 -0.53 5.36 -0.18 -2.36 117.98 123.05 3dda s PHE 188 Ca 0.50 0.82 0.00 0.00 -0.96 0.00 0.00 56.93 57.29 3dda s PHE 188 Cb -0.19 0.41 0.02 0.00 -0.34 0.00 0.00 43.02 42.92 3dda s PHE 188 CO 0.11 -0.65 0.01 0.45 -1.46 0.00 0.00 175.22 173.69 3dda s SER 189 N -1.62 0.16 0.00 6.13 0.15 -1.26 -4.10 113.70 113.16 3dda s SER 189 Ca -0.08 0.01 0.25 0.00 0.70 0.00 0.00 55.95 56.83 3dda s SER 189 Cb -0.01 -0.09 0.73 0.00 -1.71 0.00 0.00 66.02 64.94 3dda s SER 189 CO 0.03 -0.09 1.56 -0.81 1.20 0.00 0.00 173.24 175.13 3dda n PRO 190 N 3.91 1.91 -0.02 5.44 -0.04 -1.26 -4.17 135.00 140.76 3dda n PRO 190 Ca -0.24 -1.33 0.13 0.00 -0.04 0.00 0.00 63.50 62.01 3dda n PRO 190 Cb 0.52 -1.46 0.42 0.00 -0.04 0.00 0.00 33.50 32.94 3dda n PRO 190 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3dda n ASP 191 N 0.59 1.86 -3.94 3.54 8.00 -1.26 -4.60 116.55 120.73 3dda n ASP 191 Ca 0.17 -1.64 -0.09 0.00 0.71 0.00 0.00 54.79 53.95 3dda n ASP 191 Cb 0.42 -0.03 -0.09 0.00 -0.02 0.00 0.00 41.12 41.40 3dda n ASP 191 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3dda s PHE 192 N -1.94 0.24 0.34 1.24 0.08 -1.26 -1.77 117.98 114.92 3dda s PHE 192 Ca 0.35 -0.61 -0.03 0.00 0.12 0.00 0.00 56.93 56.76 3dda s PHE 192 Cb 0.20 -0.16 0.00 0.00 -0.57 0.00 0.00 43.02 42.49 3dda s PHE 192 CO 0.32 -0.41 0.49 -0.08 -0.10 0.00 0.00 175.22 175.43 3dda s THR 193 N -3.12 0.00 0.08 0.64 -1.32 -0.46 -4.89 115.64 106.57 3dda s THR 193 Ca -0.01 -1.57 0.08 0.00 -1.21 0.00 0.00 61.69 58.98 3dda s THR 193 Cb 0.02 -2.64 -0.03 0.00 -1.51 0.00 0.00 72.50 68.34 3dda s THR 193 CO -0.07 0.00 -0.22 -0.36 -2.21 0.00 0.00 174.62 171.76 3dda s PHE 194 N -3.05 1.89 0.30 9.09 0.08 -1.26 -0.71 117.98 124.32 3dda s PHE 194 Ca 0.30 -0.40 -0.06 0.00 0.12 0.00 0.00 56.93 56.89 3dda s PHE 194 Cb -0.01 -1.08 -0.06 0.00 -0.57 0.00 0.00 43.02 41.31 3dda s PHE 194 CO 0.20 0.17 0.58 0.20 -0.10 0.00 0.00 175.22 176.27 3dda s GLY 195 N -1.57 1.92 0.21 4.36 0.00 -0.13 -0.76 107.32 111.35 3dda s GLY 195 Ca 0.08 -0.47 -0.07 0.00 0.00 0.00 0.00 44.72 44.26 3dda s GLY 195 CO 0.03 -0.35 0.29 -0.11 0.00 0.00 0.00 173.10 172.96 3dda s PHE 196 N -2.09 0.72 -0.06 1.90 -0.12 0.33 -3.61 117.98 115.04 3dda s PHE 196 Ca 0.45 -1.02 0.01 0.00 -0.05 0.00 0.00 56.93 56.32 3dda s PHE 196 Cb -0.11 -0.18 -0.03 0.00 -0.63 0.00 0.00 43.02 42.07 3dda s PHE 196 CO 0.29 -0.79 -0.05 -1.21 -0.05 0.00 0.00 175.22 173.41 3dda s GLU 197 N -4.07 2.78 0.45 1.99 0.41 -1.26 -2.14 118.70 116.86 3dda s GLU 197 Ca 0.29 -0.54 0.21 0.00 -0.41 0.00 0.00 54.97 54.51 3dda s GLU 197 Cb 0.03 -2.63 1.08 0.00 -1.78 0.00 0.00 34.13 30.84 3dda s GLU 197 CO 0.09 0.66 1.94 1.05 -0.49 0.00 0.00 175.26 178.52 3dda h GLU 198 N 5.10 0.00 -5.44 1.61 9.09 -1.97 -3.41 114.58 119.56 3dda h GLU 198 Ca -0.49 0.00 -0.60 0.00 0.05 0.00 0.00 59.36 58.32 3dda h GLU 198 Cb 1.18 0.00 -0.11 0.00 -1.65 0.00 0.00 28.75 28.17 3dda h GLU 198 CO 0.53 0.23 -0.25 -1.12 0.05 0.00 0.00 179.01 178.45 3dda s SER 199 N -6.50 6.43 0.22 3.06 0.01 -1.26 -4.99 113.70 110.68 3dda s SER 199 Ca -0.02 0.51 -0.07 0.00 1.31 0.00 0.00 55.95 57.67 3dda s SER 199 Cb 0.13 -2.21 0.30 0.00 0.21 0.00 0.00 66.02 64.45 3dda s SER 199 CO 0.65 -0.01 1.81 0.25 0.41 0.00 0.00 173.24 176.35 3dda h LEU 200 N 7.30 0.61 -2.12 2.44 5.85 -1.99 0.10 115.31 127.50 3dda h LEU 200 Ca -0.38 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.37 3dda h LEU 200 Cb 1.16 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.11 3dda h LEU 200 CO 0.73 0.38 -0.04 -0.33 -0.34 0.00 0.00 178.44 178.83 3dda h GLU 201 N 0.75 0.00 0.06 1.25 5.08 -1.96 -1.39 114.58 118.37 3dda h GLU 201 Ca 0.34 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.42 3dda h GLU 201 Cb 0.24 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 3dda h GLU 201 CO -0.20 0.04 -1.53 0.28 -1.00 0.00 0.00 179.01 176.60 3dda h VAL 202 N 0.00 0.84 -0.22 3.13 2.07 -1.61 -3.31 116.25 117.15 3dda h VAL 202 Ca -0.00 -2.27 -0.02 0.00 0.82 0.00 0.00 66.70 65.23 3dda h VAL 202 Cb 0.29 2.41 -0.01 0.00 -1.52 0.00 0.00 31.29 32.45 3dda h VAL 202 CO 0.01 0.58 0.05 -0.78 0.02 0.00 0.00 177.57 177.45 3dda h ASP 203 N -0.52 0.27 -0.49 0.57 3.58 -0.62 -1.83 116.42 117.38 3dda h ASP 203 Ca -0.37 -0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.06 3dda h ASP 203 Cb 1.63 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 42.61 3dda h ASP 203 CO -0.06 0.29 0.00 0.35 -2.88 0.00 0.00 179.24 176.93 3dda n THR 204 N -4.41 0.98 -4.62 2.25 -2.24 -0.54 -1.97 114.28 103.72 3dda n THR 204 Ca 0.00 -0.75 -0.33 0.00 -2.27 0.00 0.00 64.05 60.70 3dda n THR 204 Cb 0.15 0.18 -0.14 0.00 -2.10 0.00 0.00 70.33 68.41 3dda n THR 204 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3dda s ASN 205 N -0.89 4.09 0.10 3.42 3.84 -0.69 -4.76 114.94 120.05 3dda s ASN 205 Ca 0.35 -0.33 0.20 0.00 0.21 0.00 0.00 52.86 53.30 3dda s ASN 205 Cb 0.20 -1.64 0.84 0.00 -0.55 0.00 0.00 41.25 40.10 3dda s ASN 205 CO 0.20 0.14 1.63 -0.81 -2.79 0.00 0.00 177.10 175.48 3dda n PRO 206 N 3.70 0.09 0.00 0.43 -0.04 -1.26 -3.39 135.00 134.52 3dda n PRO 206 Ca -0.18 0.27 0.08 0.00 -0.04 0.00 0.00 63.50 63.63 3dda n PRO 206 Cb 0.52 -1.65 0.03 0.00 -0.04 0.00 0.00 33.50 32.37 3dda n PRO 206 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3dda n LEU 207 N -1.80 1.94 -4.34 1.53 4.77 -1.26 -1.98 117.00 115.85 3dda n LEU 207 Ca 0.04 -0.86 -0.29 0.00 -0.03 0.00 0.00 56.01 54.87 3dda n LEU 207 Cb 0.24 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.19 3dda n LEU 207 CO 0.19 0.36 -0.56 -0.76 -1.33 0.00 0.00 177.39 175.29 3dda s LEU 208 N -1.77 2.23 0.00 2.23 1.43 -1.22 -4.69 118.68 116.89 3dda s LEU 208 Ca 0.16 -0.64 0.00 0.00 -1.03 0.00 0.00 54.13 52.61 3dda s LEU 208 Cb 0.13 -1.19 0.00 0.00 0.03 0.00 0.00 46.19 45.17 3dda s LEU 208 CO 0.32 0.20 0.00 0.61 0.23 0.00 0.00 176.35 177.71 3dda n GLY 209 N 1.44 -1.17 0.35 -3.19 0.00 -1.26 -4.77 105.19 96.59 3dda n GLY 209 Ca -0.18 -1.39 0.06 0.00 0.00 0.00 0.00 46.02 44.52 3dda n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dda n ALA 210 N -0.18 2.88 -0.54 4.61 0.00 -1.26 -4.71 120.51 121.32 3dda n ALA 210 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 52.93 3dda n ALA 210 Cb 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 19.45 19.00 3dda n ALA 210 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dda n GLY 211 N 0.96 0.74 0.26 0.00 0.00 -1.26 -4.42 105.19 101.47 3dda n GLY 211 Ca 0.06 -0.60 -0.08 0.00 0.00 0.00 0.00 46.02 45.40 3dda n GLY 211 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3dda h LYS 212 N 0.00 0.89 -5.88 1.61 3.64 -1.91 -3.41 116.57 111.51 3dda h LYS 212 Ca 0.00 -0.20 -0.65 0.00 -1.27 0.00 0.00 60.65 58.53 3dda h LYS 212 Cb 0.36 -0.12 -0.07 0.00 -0.41 0.00 0.00 32.23 31.99 3dda h LYS 212 CO 0.00 0.82 -0.53 -0.06 -2.27 0.00 0.00 179.45 177.41 3dda s PHE 213 N -5.36 3.44 -0.17 1.91 0.08 -0.91 -0.97 117.98 116.00 3dda s PHE 213 Ca -0.13 0.30 -0.08 0.00 0.12 0.00 0.00 56.93 57.15 3dda s PHE 213 Cb 0.12 -1.79 -0.04 0.00 -0.57 0.00 0.00 43.02 40.74 3dda s PHE 213 CO 0.81 0.61 0.10 0.00 -0.10 0.00 0.00 175.22 176.64 3dda s ALA 214 N -1.25 3.61 0.28 5.36 0.00 0.47 -0.51 121.76 129.71 3dda s ALA 214 Ca 0.25 -0.70 -0.29 0.00 0.00 0.00 0.00 51.96 51.21 3dda s ALA 214 Cb -0.12 -1.99 -0.10 0.00 0.00 0.00 0.00 23.12 20.91 3dda s ALA 214 CO 0.16 0.31 1.33 0.99 0.00 0.00 0.00 175.76 178.55 3dda s THR 215 N -0.06 2.84 -0.14 0.00 2.01 0.06 -4.83 115.64 115.52 3dda s THR 215 Ca 0.08 0.77 -0.29 0.00 0.31 0.00 0.00 61.69 62.56 3dda s THR 215 Cb -0.12 -3.49 -0.02 0.00 0.01 0.00 0.00 72.50 68.88 3dda s THR 215 CO 0.00 0.16 1.23 -0.62 -0.69 0.00 0.00 174.62 174.70 3dda s ASP 216 N -0.13 6.98 0.64 3.53 -1.08 -1.26 -4.58 116.67 120.78 3dda s ASP 216 Ca 0.53 1.71 0.34 0.00 -0.52 0.00 0.00 52.55 54.61 3dda s ASP 216 Cb -0.39 -2.54 1.88 0.00 -1.46 0.00 0.00 42.92 40.40 3dda s ASP 216 CO 0.47 -0.71 2.05 1.55 0.52 0.00 0.00 175.17 179.06 3dda h PRO 217 N 7.95 0.00 -0.25 4.34 0.13 -1.92 -0.01 132.00 142.24 3dda h PRO 217 Ca -0.28 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.75 3dda h PRO 217 Cb 1.12 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 3dda h PRO 217 CO 0.94 0.00 -0.27 0.00 -0.23 0.00 0.00 178.00 178.45 3dda h ALA 218 N 1.59 1.07 -0.30 -0.56 0.00 -1.93 -0.38 119.26 118.76 3dda h ALA 218 Ca 0.00 -0.36 -0.13 0.00 0.00 0.00 0.00 54.91 54.42 3dda h ALA 218 Cb 0.40 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 3dda h ALA 218 CO 0.00 0.57 -0.34 0.28 0.00 0.00 0.00 179.25 179.76 3dda h VAL 219 N 0.44 1.30 -0.55 0.00 2.07 -1.39 -0.68 116.25 117.44 3dda h VAL 219 Ca 0.06 -1.52 -0.01 0.00 0.82 0.00 0.00 66.70 66.05 3dda h VAL 219 Cb 0.70 1.58 -0.03 0.00 -1.52 0.00 0.00 31.29 32.02 3dda h VAL 219 CO 0.05 0.49 0.30 0.74 0.02 0.00 0.00 177.57 179.17 3dda h THR 220 N 0.51 1.18 -0.47 2.57 2.02 -1.37 -0.14 112.91 117.22 3dda h THR 220 Ca 0.04 -0.46 -0.09 0.00 0.77 0.00 0.00 66.41 66.67 3dda h THR 220 Cb 0.92 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.81 3dda h THR 220 CO 0.08 0.19 -0.08 0.25 0.37 0.00 0.00 175.52 176.34 3dda h LEU 221 N 0.73 0.88 -1.01 2.58 5.85 -1.04 -2.81 115.31 120.49 3dda h LEU 221 Ca 0.19 -0.35 0.06 0.00 0.84 0.00 0.00 57.88 58.63 3dda h LEU 221 Cb 0.04 -0.24 -0.07 0.00 0.37 0.00 0.00 40.66 40.77 3dda h LEU 221 CO -0.03 1.02 0.65 0.00 -0.34 0.00 0.00 178.44 179.74 3dda h ALA 222 N 0.89 1.39 -0.24 1.25 0.00 -0.69 0.08 119.26 121.93 3dda h ALA 222 Ca 0.12 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.04 3dda h ALA 222 Cb 0.61 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3dda h ALA 222 CO 0.04 0.47 0.02 1.25 0.00 0.00 0.00 179.25 181.03 3dda h HIS 223 N 1.20 0.03 -0.30 0.00 -0.00 -0.79 0.50 115.15 115.80 3dda h HIS 223 Ca 0.43 0.02 -0.09 0.00 -0.00 0.00 0.00 60.37 60.72 3dda h HIS 223 Cb 0.13 0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 27.55 3dda h HIS 223 CO -0.00 -0.01 -0.22 0.93 -0.00 0.00 0.00 177.93 178.63 3dda h GLU 224 N 0.10 0.56 -0.04 5.26 4.39 -1.10 -2.33 114.58 121.42 3dda h GLU 224 Ca 0.11 -0.20 -0.06 0.00 0.34 0.00 0.00 59.36 59.55 3dda h GLU 224 Cb 0.13 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 3dda h GLU 224 CO -0.17 0.74 -0.24 -0.07 -1.16 0.00 0.00 179.01 178.10 3dda h LEU 225 N 0.49 0.07 -0.27 1.33 3.38 -0.29 0.72 115.31 120.74 3dda h LEU 225 Ca 0.08 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 3dda h LEU 225 Cb 0.65 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 3dda h LEU 225 CO 0.05 0.32 -0.05 0.40 0.09 0.00 0.00 178.44 179.25 3dda h ILE 226 N 0.06 1.28 -0.52 1.22 1.08 -0.41 -0.13 117.51 120.09 3dda h ILE 226 Ca 0.01 -1.04 0.00 0.00 -0.39 0.00 0.00 64.86 63.44 3dda h ILE 226 Cb 0.47 1.41 -0.03 0.00 -3.07 0.00 0.00 36.82 35.60 3dda h ILE 226 CO 0.03 0.33 0.33 0.45 -0.69 0.00 0.00 178.15 178.60 3dda h HIS 227 N 0.27 0.67 -0.99 1.37 3.86 -0.94 -2.00 115.15 117.39 3dda h HIS 227 Ca 0.07 0.01 0.07 0.00 -1.16 0.00 0.00 60.37 59.35 3dda h HIS 227 Cb 0.50 -0.22 -0.07 0.00 1.06 0.00 0.00 27.41 28.68 3dda h HIS 227 CO 0.05 0.45 0.64 0.00 0.86 0.00 0.00 177.93 179.92 3dda h ALA 228 N 1.17 1.38 -0.45 2.45 0.00 -0.64 -0.08 119.26 123.09 3dda h ALA 228 Ca 0.19 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3dda h ALA 228 Cb -0.05 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 3dda h ALA 228 CO -0.04 0.42 0.24 0.78 0.00 0.00 0.00 179.25 180.65 3dda h GLY 229 N 1.15 0.67 0.98 0.00 0.00 -0.44 0.25 103.07 105.69 3dda h GLY 229 Ca 0.43 -0.31 -0.00 0.00 0.00 0.00 0.00 47.33 47.45 3dda h GLY 229 CO -0.18 0.30 0.22 0.45 0.00 0.00 0.00 176.54 177.33 3dda h HIS 230 N 0.59 0.49 -0.22 5.60 3.86 -0.59 -2.34 115.15 122.54 3dda h HIS 230 Ca 0.16 -0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.26 3dda h HIS 230 Cb 0.06 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.36 3dda h HIS 230 CO -0.02 0.35 -0.32 0.00 0.86 0.00 0.00 177.93 178.80 3dda h ARG 231 N 0.48 0.44 0.00 2.45 3.08 -0.75 0.09 114.38 120.18 3dda h ARG 231 Ca 0.13 -0.19 -0.08 0.00 0.07 0.00 0.00 59.98 59.91 3dda h ARG 231 Cb 0.01 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 3dda h ARG 231 CO -0.02 0.71 -0.40 -0.07 -1.07 0.00 0.00 179.97 179.11 3dda h LEU 232 N 0.38 0.00 -2.12 3.04 3.38 -0.32 -2.33 115.31 117.34 3dda h LEU 232 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3dda h LEU 232 Cb 0.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 3dda h LEU 232 CO 0.06 0.40 0.00 -1.22 0.09 0.00 0.00 178.44 177.77 3dda n TYR 233 N -3.84 0.55 -3.12 1.13 4.01 -0.90 -3.84 117.16 111.16 3dda n TYR 233 Ca -0.01 -0.27 -0.23 0.00 -0.16 0.00 0.00 57.90 57.23 3dda n TYR 233 Cb 0.46 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.53 3dda n TYR 233 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3dda n GLY 234 N 1.45 -0.52 0.18 2.72 0.00 -0.71 -4.16 105.19 104.14 3dda n GLY 234 Ca 0.19 0.14 0.09 0.00 0.00 0.00 0.00 46.02 46.44 3dda n GLY 234 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3dda n ILE 235 N -4.53 1.78 -2.12 -0.61 -5.35 -0.06 -0.72 119.36 107.74 3dda n ILE 235 Ca -0.09 -2.22 -0.39 0.00 -0.27 0.00 0.00 62.75 59.78 3dda n ILE 235 Cb 0.61 -0.18 -0.01 0.00 -1.74 0.00 0.00 39.64 38.33 3dda n ILE 235 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3dda s ALA 236 N -2.70 3.17 -0.04 -1.28 0.00 -0.41 -4.93 121.76 115.58 3dda s ALA 236 Ca 0.31 1.14 -0.26 0.00 0.00 0.00 0.00 51.96 53.14 3dda s ALA 236 Cb 0.27 -3.45 -0.04 0.00 0.00 0.00 0.00 23.12 19.91 3dda s ALA 236 CO 0.01 -0.76 0.80 0.42 0.00 0.00 0.00 175.76 176.24 3dda s ILE 237 N -1.33 4.97 -0.11 0.00 1.01 -1.26 -4.57 121.20 119.90 3dda s ILE 237 Ca 0.58 1.68 -0.40 0.00 0.00 0.00 0.00 60.65 62.51 3dda s ILE 237 Cb -0.35 -4.14 -0.18 0.00 0.01 0.00 0.00 42.46 37.80 3dda s ILE 237 CO 0.45 0.22 1.43 -3.20 0.00 0.00 0.00 174.94 173.84 3dda n ASN 238 N 3.77 1.41 0.09 3.58 2.85 -1.26 -4.59 115.26 121.11 3dda n ASN 238 Ca 0.01 1.13 0.06 0.00 -0.11 0.00 0.00 54.58 55.67 3dda n ASN 238 Cb 0.51 -1.07 0.31 0.00 1.24 0.00 0.00 39.78 40.77 3dda n ASN 238 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 3dda n PRO 239 N 3.26 0.07 0.17 1.20 -0.04 -1.26 -1.04 135.00 137.37 3dda n PRO 239 Ca 0.23 0.57 0.13 0.00 -0.04 0.00 0.00 63.50 64.38 3dda n PRO 239 Cb 0.11 -1.76 0.37 0.00 -0.04 0.00 0.00 33.50 32.18 3dda n PRO 239 CO 0.00 0.00 0.00 -2.95 -0.04 0.00 0.00 175.50 172.51 3dda h ASN 240 N 0.00 0.00 -3.44 3.54 -0.00 -2.02 -3.41 115.58 110.25 3dda h ASN 240 Ca 0.00 0.00 -0.62 0.00 -0.00 0.00 0.00 56.30 55.68 3dda h ASN 240 Cb 0.04 0.00 -0.12 0.00 -0.00 0.00 0.00 38.32 38.24 3dda h ASN 240 CO 0.00 0.00 0.49 -0.13 -0.00 0.00 0.00 177.43 177.79 3dda s ARG 241 N -3.25 3.39 0.19 4.14 1.81 -0.21 -5.00 118.95 120.03 3dda s ARG 241 Ca 0.07 -0.13 0.04 0.00 -1.72 0.00 0.00 55.73 53.99 3dda s ARG 241 Cb 0.09 -3.99 -0.05 0.00 -0.45 0.00 0.00 34.95 30.55 3dda s ARG 241 CO 0.59 -1.31 -0.05 0.14 -0.68 0.00 0.00 175.30 173.99 3dda s VAL 242 N 3.66 1.13 -0.36 3.52 -7.23 -1.26 -1.59 120.40 118.26 3dda s VAL 242 Ca 0.31 -2.05 -0.13 0.00 -1.81 0.00 0.00 61.98 58.30 3dda s VAL 242 Cb -0.12 -2.12 -0.00 0.00 0.56 0.00 0.00 36.38 34.70 3dda s VAL 242 CO 0.22 -0.52 0.25 0.12 -0.31 0.00 0.00 175.10 174.86 3dda s PHE 243 N -3.36 3.23 -1.16 2.82 5.36 0.86 -4.87 117.98 120.86 3dda s PHE 243 Ca 0.23 -0.37 -0.21 0.00 -0.96 0.00 0.00 56.93 55.63 3dda s PHE 243 Cb 0.04 -2.50 0.06 0.00 -0.34 0.00 0.00 43.02 40.27 3dda s PHE 243 CO 0.05 -0.44 1.61 0.15 -1.46 0.00 0.00 175.22 175.13 3dda s LYS 244 N 1.70 3.75 -0.48 10.12 1.02 -1.26 -1.85 119.74 132.74 3dda s LYS 244 Ca 0.06 -1.55 -0.45 0.00 0.02 0.00 0.00 55.97 54.05 3dda s LYS 244 Cb -0.18 -5.44 -0.19 0.00 -0.52 0.00 0.00 37.83 31.50 3dda s LYS 244 CO 0.10 -2.29 1.54 0.28 -0.92 0.00 0.00 175.35 174.07 3dda n VAL 245 N 6.68 0.00 -2.11 3.17 0.31 -1.20 -4.86 118.33 120.31 3dda n VAL 245 Ca 0.41 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.79 3dda n VAL 245 Cb 0.48 -0.48 0.07 0.00 -0.91 0.00 0.00 33.84 33.00 3dda n VAL 245 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 3dda n ASN 246 N 3.89 1.11 -0.03 4.52 6.94 -1.26 -4.28 115.26 126.14 3dda n ASN 246 Ca 0.30 -2.53 0.00 0.00 -0.02 0.00 0.00 54.58 52.33 3dda n ASN 246 Cb -0.06 -0.35 0.01 0.00 -2.36 0.00 0.00 39.78 37.02 3dda n ASN 246 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 3dda n THR 247 N -0.10 0.99 -3.46 5.53 -2.24 -1.26 -4.93 114.28 108.82 3dda n THR 247 Ca 0.09 -1.00 -0.12 0.00 -2.27 0.00 0.00 64.05 60.75 3dda n THR 247 Cb 0.94 0.50 -0.10 0.00 -2.10 0.00 0.00 70.33 69.57 3dda n THR 247 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3dda s ASN 248 N -0.99 0.55 0.44 3.42 3.84 -1.26 -5.04 114.94 115.90 3dda s ASN 248 Ca 0.01 0.21 0.17 0.00 0.21 0.00 0.00 52.86 53.46 3dda s ASN 248 Cb 0.01 0.86 1.10 0.00 -0.55 0.00 0.00 41.25 42.67 3dda s ASN 248 CO 0.01 -0.29 1.93 0.00 -2.79 0.00 0.00 177.10 175.96 3dda h ALA 249 N 8.23 2.17 -0.11 1.71 0.00 -1.95 -0.75 119.26 128.56 3dda h ALA 249 Ca -0.18 -0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.53 3dda h ALA 249 Cb 1.14 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3dda h ALA 249 CO 0.24 -0.37 -0.75 1.88 0.00 0.00 0.00 179.25 180.26 3dda h TYR 250 N 0.35 0.76 -0.55 0.00 0.05 -1.96 -1.00 116.97 114.62 3dda h TYR 250 Ca 0.35 -0.33 -0.07 0.00 0.05 0.00 0.00 58.73 58.72 3dda h TYR 250 Cb 0.87 -0.12 -0.02 0.00 1.01 0.00 0.00 36.73 38.47 3dda h TYR 250 CO -0.00 1.12 0.06 1.88 -1.05 0.00 0.00 178.16 180.17 3dda h TYR 251 N 0.38 0.99 -0.37 4.88 -1.99 -1.64 -3.01 116.97 116.23 3dda h TYR 251 Ca -0.04 -0.15 -0.01 0.00 2.00 0.00 0.00 58.73 60.53 3dda h TYR 251 Cb 1.34 -0.27 -0.02 0.00 2.00 0.00 0.00 36.73 39.79 3dda h TYR 251 CO 0.06 0.89 0.17 0.93 -0.00 0.00 0.00 178.16 180.21 3dda h GLU 252 N 0.81 0.53 0.00 4.88 5.08 -1.02 0.14 114.58 125.01 3dda h GLU 252 Ca 0.16 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3dda h GLU 252 Cb 0.45 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.60 3dda h GLU 252 CO 0.02 0.48 0.00 0.00 -1.00 0.00 0.00 179.01 178.51 3dda h MET 253 N 0.45 0.00 -0.01 2.33 -0.00 -1.15 -0.85 114.93 115.69 3dda h MET 253 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.83 3dda h MET 253 Cb 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.73 3dda h MET 253 CO -0.01 0.00 -0.21 0.43 -0.00 0.00 0.00 176.91 177.11 3dda n SER 254 N -2.42 1.78 -2.50 -0.10 7.64 -0.85 -4.98 113.62 112.19 3dda n SER 254 Ca 0.00 -1.39 -0.21 0.00 1.01 0.00 0.00 58.87 58.28 3dda n SER 254 Cb 0.16 0.32 -0.00 0.00 -1.01 0.00 0.00 64.21 63.68 3dda n SER 254 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dda n GLY 255 N 1.03 -0.50 3.70 0.23 0.00 0.35 -4.92 105.19 105.07 3dda n GLY 255 Ca 0.07 0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 3dda n GLY 255 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dda s LEU 256 N -6.15 4.36 -0.16 0.99 1.43 -0.31 -4.98 118.68 113.86 3dda s LEU 256 Ca 0.05 2.49 -0.01 0.00 -1.03 0.00 0.00 54.13 55.64 3dda s LEU 256 Cb -0.02 -3.57 -0.01 0.00 0.03 0.00 0.00 46.19 42.62 3dda s LEU 256 CO 0.07 -0.85 -0.12 -1.61 0.23 0.00 0.00 176.35 174.06 3dda s GLU 257 N 2.21 3.30 -0.17 1.70 2.02 -1.26 -3.27 118.70 123.23 3dda s GLU 257 Ca 0.72 -0.70 -0.04 0.00 0.02 0.00 0.00 54.97 54.97 3dda s GLU 257 Cb -0.40 -2.71 -0.03 0.00 0.10 0.00 0.00 34.13 31.09 3dda s GLU 257 CO 0.32 0.02 -0.02 0.08 0.02 0.00 0.00 175.26 175.68 3dda s VAL 258 N 0.83 3.95 0.55 2.63 1.01 -0.77 -4.90 120.40 123.70 3dda s VAL 258 Ca -0.04 -0.33 -0.21 0.00 0.00 0.00 0.00 61.98 61.40 3dda s VAL 258 Cb -0.15 -2.75 -0.05 0.00 0.00 0.00 0.00 36.38 33.43 3dda s VAL 258 CO 0.00 0.47 1.29 -0.94 0.00 0.00 0.00 175.10 175.93 3dda s SER 259 N 0.53 5.33 0.45 3.32 1.04 -1.26 -0.10 113.70 123.01 3dda s SER 259 Ca -0.02 2.61 0.15 0.00 0.48 0.00 0.00 55.95 59.17 3dda s SER 259 Cb -0.14 -2.62 1.02 0.00 0.10 0.00 0.00 66.02 64.38 3dda s SER 259 CO 0.02 -1.52 1.99 -0.26 0.98 0.00 0.00 173.24 174.46 3dda h PHE 260 N 1.36 0.00 -0.92 5.02 0.04 -1.61 -2.09 116.94 118.73 3dda h PHE 260 Ca -0.51 0.00 0.03 0.00 2.80 0.00 0.00 57.97 60.29 3dda h PHE 260 Cb 1.30 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 39.39 3dda h PHE 260 CO 0.47 0.19 0.61 1.49 -0.60 0.00 0.00 178.31 180.47 3dda h GLU 261 N 0.00 1.16 -0.20 1.51 4.57 -1.81 0.82 114.58 120.64 3dda h GLU 261 Ca -0.00 -0.07 -0.14 0.00 -1.18 0.00 0.00 59.36 57.97 3dda h GLU 261 Cb 0.34 -0.26 0.00 0.00 -0.16 0.00 0.00 28.75 28.67 3dda h GLU 261 CO 0.02 0.77 -0.42 0.93 -1.18 0.00 0.00 179.01 179.13 3dda h GLU 262 N 1.20 0.63 -0.74 1.92 4.39 -1.75 -2.06 114.58 118.17 3dda h GLU 262 Ca 0.36 -0.42 -0.03 0.00 0.34 0.00 0.00 59.36 59.60 3dda h GLU 262 Cb -0.05 0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.63 3dda h GLU 262 CO -0.10 1.04 0.33 -0.07 -1.16 0.00 0.00 179.01 179.05 3dda h LEU 263 N 0.32 0.99 -0.35 1.33 3.38 -1.15 -0.54 115.31 119.28 3dda h LEU 263 Ca 0.00 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 3dda h LEU 263 Cb 1.03 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.51 3dda h LEU 263 CO 0.09 0.86 0.19 -0.09 0.09 0.00 0.00 178.44 179.58 3dda h ARG 264 N 1.04 0.48 -0.60 1.13 2.43 -0.86 -1.43 114.38 116.58 3dda h ARG 264 Ca 0.25 -0.06 -0.06 0.00 -0.81 0.00 0.00 59.98 59.30 3dda h ARG 264 Cb 0.16 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.59 3dda h ARG 264 CO -0.03 0.41 0.14 1.15 -1.51 0.00 0.00 179.97 180.13 3dda h THR 265 N 0.43 1.24 -0.24 0.20 2.02 -0.99 -2.75 112.91 112.83 3dda h THR 265 Ca 0.12 -0.88 -0.10 0.00 0.77 0.00 0.00 66.41 66.31 3dda h THR 265 Cb 0.06 0.63 -0.00 0.00 -1.74 0.00 0.00 68.15 67.10 3dda h THR 265 CO -0.02 0.33 -0.26 0.15 0.37 0.00 0.00 175.52 176.10 3dda h PHE 266 N 0.90 0.73 0.00 3.16 3.57 -0.97 -0.62 116.94 123.71 3dda h PHE 266 Ca 0.19 -0.22 0.00 0.00 3.53 0.00 0.00 57.97 61.47 3dda h PHE 266 Cb 0.33 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 38.92 3dda h PHE 266 CO 0.02 0.93 0.00 0.41 -2.23 0.00 0.00 178.31 177.45 3dda n GLY 267 N 0.19 -0.26 7.00 2.40 0.00 -0.55 -1.01 105.19 112.95 3dda n GLY 267 Ca -0.05 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.78 3dda n GLY 267 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dda n GLY 268 N 0.00 1.91 0.23 -0.02 0.00 -1.26 -1.91 105.19 104.14 3dda n GLY 268 Ca 0.00 -0.40 0.10 0.00 0.00 0.00 0.00 46.02 45.71 3dda n GLY 268 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3dda h HIS 269 N 0.00 0.00 -0.95 1.61 3.86 -1.95 -2.99 115.15 114.73 3dda h HIS 269 Ca 0.00 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.24 3dda h HIS 269 Cb 0.00 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 28.42 3dda h HIS 269 CO 0.00 0.21 0.63 -0.44 0.86 0.00 0.00 177.93 179.18 3dda h ASP 270 N 0.00 1.04 0.36 2.45 5.19 -1.69 -1.84 116.42 121.94 3dda h ASP 270 Ca -0.00 -0.01 -0.00 0.00 -0.62 0.00 0.00 57.03 56.39 3dda h ASP 270 Cb 0.52 -0.24 -0.00 0.00 0.18 0.00 0.00 39.33 39.79 3dda h ASP 270 CO 0.03 0.72 -0.01 0.00 -3.12 0.00 0.00 179.24 176.85 3dda h ALA 271 N 1.44 1.05 0.00 3.45 0.00 -1.34 -2.07 119.26 121.80 3dda h ALA 271 Ca 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.27 3dda h ALA 271 Cb -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3dda h ALA 271 CO -0.11 0.02 0.00 1.63 0.00 0.00 0.00 179.25 180.79 3dda n LYS 272 N -3.18 0.11 0.00 0.00 5.02 -0.69 -2.48 118.16 116.95 3dda n LYS 272 Ca -0.02 0.11 0.12 0.00 -2.02 0.00 0.00 58.31 56.50 3dda n LYS 272 Cb 0.16 -1.50 0.53 0.00 -0.02 0.00 0.00 35.03 34.21 3dda n LYS 272 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3dda n PHE 273 N -1.42 0.00 -3.29 2.13 3.72 -0.78 -4.33 117.46 113.49 3dda n PHE 273 Ca 0.07 0.00 -0.44 0.00 -0.05 0.00 0.00 57.45 57.03 3dda n PHE 273 Cb 0.22 -0.45 -0.07 0.00 -0.94 0.00 0.00 39.48 38.24 3dda n PHE 273 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3dda s ILE 274 N -2.90 5.07 0.90 4.37 1.01 -1.03 -5.02 121.20 123.60 3dda s ILE 274 Ca 0.14 -0.76 -0.10 0.00 0.00 0.00 0.00 60.65 59.93 3dda s ILE 274 Cb 0.16 -4.19 0.13 0.00 0.01 0.00 0.00 42.46 38.57 3dda s ILE 274 CO 0.42 -0.66 1.13 1.51 0.00 0.00 0.00 174.94 177.34 3dda s ASP 275 N 2.57 3.15 0.30 3.58 1.47 -1.26 -4.68 116.67 121.79 3dda s ASP 275 Ca 0.09 2.09 0.03 0.00 1.18 0.00 0.00 52.55 55.95 3dda s ASP 275 Cb -0.21 -2.55 0.61 0.00 -0.34 0.00 0.00 42.92 40.43 3dda s ASP 275 CO 0.09 -2.94 1.85 0.28 0.68 0.00 0.00 175.17 175.13 3dda h SER 276 N -1.76 0.87 0.18 2.11 0.02 -1.97 0.65 113.55 113.65 3dda h SER 276 Ca -0.44 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.55 3dda h SER 276 Cb 1.26 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 63.67 3dda h SER 276 CO 0.44 0.46 -0.10 0.25 -1.14 0.00 0.00 176.83 176.74 3dda h LEU 277 N 0.93 -0.23 -0.78 5.07 5.85 -1.99 -0.31 115.31 123.84 3dda h LEU 277 Ca 0.48 0.01 -0.09 0.00 0.84 0.00 0.00 57.88 59.13 3dda h LEU 277 Cb 0.52 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 3dda h LEU 277 CO -0.25 -0.16 -0.01 1.56 -0.34 0.00 0.00 178.44 179.24 3dda h GLN 278 N -0.26 0.91 -0.51 1.25 4.20 -1.78 -1.41 115.11 117.51 3dda h GLN 278 Ca -0.02 -0.27 -0.00 0.00 0.06 0.00 0.00 58.65 58.42 3dda h GLN 278 Cb 0.21 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.87 3dda h GLN 278 CO 0.03 0.91 0.31 1.49 -0.67 0.00 0.00 178.83 180.90 3dda h GLU 279 N 0.84 0.69 -0.36 1.46 4.81 -0.64 -1.15 114.58 120.23 3dda h GLU 279 Ca 0.15 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.22 3dda h GLU 279 Cb 0.51 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 3dda h GLU 279 CO 0.03 0.50 -0.19 -0.91 -0.73 0.00 0.00 179.01 177.70 3dda h ASN 280 N 0.69 0.67 -0.14 1.04 2.35 -0.85 -1.85 115.58 117.48 3dda h ASN 280 Ca 0.18 -0.22 0.01 0.00 -0.55 0.00 0.00 56.30 55.73 3dda h ASN 280 Cb -0.02 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.16 3dda h ASN 280 CO -0.04 0.86 0.05 -0.08 -1.65 0.00 0.00 177.43 176.58 3dda h GLU 281 N 0.60 0.12 -0.46 0.81 4.81 -0.65 -1.25 114.58 118.55 3dda h GLU 281 Ca 0.09 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.24 3dda h GLU 281 Cb 0.66 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.99 3dda h GLU 281 CO 0.05 0.08 0.00 0.74 -0.73 0.00 0.00 179.01 179.15 3dda h PHE 282 N 0.13 0.89 -0.53 0.92 0.04 -1.10 -0.87 116.94 116.41 3dda h PHE 282 Ca 0.06 -0.15 0.03 0.00 2.80 0.00 0.00 57.97 60.71 3dda h PHE 282 Cb 0.03 -0.23 -0.04 0.00 2.20 0.00 0.00 35.95 37.91 3dda h PHE 282 CO -0.10 0.85 0.30 -0.09 -0.60 0.00 0.00 178.31 178.67 3dda h ARG 283 N 0.67 0.57 -0.30 1.51 2.43 -1.13 -0.79 114.38 117.35 3dda h ARG 283 Ca 0.13 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.25 3dda h ARG 283 Cb 0.50 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 3dda h ARG 283 CO 0.02 0.38 0.10 1.25 -1.51 0.00 0.00 179.97 180.21 3dda h LEU 284 N 0.59 0.42 -0.37 3.80 5.85 -1.09 -1.17 115.31 123.34 3dda h LEU 284 Ca 0.22 -0.19 0.06 0.00 0.84 0.00 0.00 57.88 58.81 3dda h LEU 284 Cb 0.07 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 40.93 3dda h LEU 284 CO -0.12 0.50 0.03 0.22 -0.34 0.00 0.00 178.44 178.73 3dda h TYR 285 N 0.32 0.03 0.00 1.25 3.20 -0.68 -0.62 116.97 120.47 3dda h TYR 285 Ca 0.10 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.89 3dda h TYR 285 Cb 0.22 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 3dda h TYR 285 CO 0.00 -0.04 -0.50 1.88 -1.64 0.00 0.00 178.16 177.86 3dda h TYR 286 N 0.14 0.00 -0.65 -3.82 0.05 -1.09 -2.57 116.97 109.03 3dda h TYR 286 Ca 0.18 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.92 3dda h TYR 286 Cb 0.24 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.95 3dda h TYR 286 CO -0.23 0.50 0.26 -0.92 -1.05 0.00 0.00 178.16 176.71 3dda h TYR 287 N 0.00 0.99 -0.32 4.88 3.20 -0.51 -1.41 116.97 123.81 3dda h TYR 287 Ca -0.00 -0.08 -0.05 0.00 3.14 0.00 0.00 58.73 61.74 3dda h TYR 287 Cb 1.14 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 39.10 3dda h TYR 287 CO 0.00 0.78 -0.01 -0.91 -1.64 0.00 0.00 178.16 176.38 3dda h ASN 288 N 0.92 0.46 -0.34 -2.11 2.35 -0.88 -1.63 115.58 114.34 3dda h ASN 288 Ca 0.22 -0.09 -0.14 0.00 -0.55 0.00 0.00 56.30 55.74 3dda h ASN 288 Cb 0.21 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.45 3dda h ASN 288 CO -0.02 0.54 -0.32 0.11 -1.65 0.00 0.00 177.43 176.09 3dda h LYS 289 N 0.47 0.87 -0.32 0.81 1.79 -0.99 -1.48 116.57 117.73 3dda h LYS 289 Ca 0.10 -0.42 -0.07 0.00 -2.18 0.00 0.00 60.65 58.08 3dda h LYS 289 Cb 0.33 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.95 3dda h LYS 289 CO 0.01 1.06 -0.10 0.74 -1.08 0.00 0.00 179.45 180.09 3dda h PHE 290 N 0.73 0.57 -0.50 -1.35 -1.00 -0.81 -2.02 116.94 112.56 3dda h PHE 290 Ca 0.08 -0.08 -0.10 0.00 2.81 0.00 0.00 57.97 60.68 3dda h PHE 290 Cb 0.89 -0.15 -0.02 0.00 3.61 0.00 0.00 35.95 40.27 3dda h PHE 290 CO 0.05 0.62 -0.08 0.87 -1.61 0.00 0.00 178.31 178.16 3dda h LYS 291 N 0.50 0.90 -0.56 1.51 1.57 -0.94 -1.52 116.57 118.02 3dda h LYS 291 Ca 0.09 -0.30 -0.04 0.00 -1.87 0.00 0.00 60.65 58.54 3dda h LYS 291 Cb 0.47 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.68 3dda h LYS 291 CO 0.03 0.94 0.20 -0.44 -0.57 0.00 0.00 179.45 179.60 3dda h ASP 292 N 0.81 0.75 -0.45 0.86 3.32 -0.72 -1.50 116.42 119.49 3dda h ASP 292 Ca 0.14 -0.11 -0.10 0.00 0.02 0.00 0.00 57.03 56.99 3dda h ASP 292 Cb 0.59 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.93 3dda h ASP 292 CO 0.04 0.70 -0.10 0.40 -1.72 0.00 0.00 179.24 178.56 3dda h ILE 293 N 0.81 1.27 -0.72 0.35 2.04 -0.89 -0.73 117.51 119.64 3dda h ILE 293 Ca 0.19 -1.21 -0.01 0.00 1.00 0.00 0.00 64.86 64.82 3dda h ILE 293 Cb 0.20 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 3dda h ILE 293 CO -0.01 0.41 0.39 0.00 0.00 0.00 0.00 178.15 178.94 3dda h ALA 294 N 0.87 0.92 -0.49 1.87 0.00 -0.88 -0.14 119.26 121.42 3dda h ALA 294 Ca 0.12 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3dda h ALA 294 Cb 0.64 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3dda h ALA 294 CO 0.04 0.44 0.14 1.03 0.00 0.00 0.00 179.25 180.90 3dda h SER 295 N 0.99 0.72 -0.70 0.00 0.87 -1.10 -1.43 113.55 112.90 3dda h SER 295 Ca 0.25 -0.22 -0.02 0.00 -1.23 0.00 0.00 61.79 60.58 3dda h SER 295 Cb 0.04 -0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 61.78 3dda h SER 295 CO -0.04 0.75 0.37 0.74 -0.53 0.00 0.00 176.83 178.12 3dda h THR 296 N 0.66 1.22 -0.69 2.23 2.02 -0.70 -2.19 112.91 115.46 3dda h THR 296 Ca 0.16 -0.56 -0.04 0.00 0.77 0.00 0.00 66.41 66.73 3dda h THR 296 Cb 0.29 0.32 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 3dda h THR 296 CO -0.00 0.24 0.26 -0.07 0.37 0.00 0.00 175.52 176.32 3dda h LEU 297 N 0.96 0.97 -1.50 2.58 3.38 -0.78 -2.66 115.31 118.26 3dda h LEU 297 Ca 0.24 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 3dda h LEU 297 Cb 0.06 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3dda h LEU 297 CO -0.04 0.89 -0.13 0.78 0.09 0.00 0.00 178.44 180.03 3dda h ASN 298 N 0.99 0.15 1.05 -0.43 2.35 -0.86 -2.34 115.58 116.49 3dda h ASN 298 Ca 0.23 -0.03 -0.10 0.00 -0.55 0.00 0.00 56.30 55.85 3dda h ASN 298 Cb 0.24 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 3dda h ASN 298 CO -0.02 0.30 -0.49 0.11 -1.65 0.00 0.00 177.43 175.69 3dda h LYS 299 N 0.15 0.00 -6.36 0.81 1.57 -1.08 -3.44 116.57 108.23 3dda h LYS 299 Ca 0.03 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.27 3dda h LYS 299 Cb 0.33 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 3dda h LYS 299 CO 0.02 0.49 0.87 0.00 -0.57 0.00 0.00 179.45 180.26 3dda s ALA 300 N -3.32 3.60 -0.07 3.86 0.00 -0.88 -3.90 121.76 121.05 3dda s ALA 300 Ca 0.01 0.89 0.02 0.00 0.00 0.00 0.00 51.96 52.88 3dda s ALA 300 Cb 0.10 -3.62 -0.03 0.00 0.00 0.00 0.00 23.12 19.57 3dda s ALA 300 CO 0.72 -0.98 0.08 1.63 0.00 0.00 0.00 175.76 177.21 3dda n LYS 301 N 5.59 3.70 -3.98 0.00 4.76 0.53 -4.94 118.16 123.83 3dda n LYS 301 Ca 0.14 -0.01 -0.09 0.00 -2.87 0.00 0.00 58.31 55.48 3dda n LYS 301 Cb 0.43 -0.79 -0.11 0.00 -1.84 0.00 0.00 35.03 32.72 3dda n LYS 301 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 3dda s SER 302 N -1.65 0.25 0.07 4.39 1.04 -0.60 -5.04 113.70 112.16 3dda s SER 302 Ca 0.00 -0.52 0.02 0.00 0.48 0.00 0.00 55.95 55.93 3dda s SER 302 Cb 0.02 0.11 -0.04 0.00 0.10 0.00 0.00 66.02 66.21 3dda s SER 302 CO 0.10 -0.33 0.10 -0.51 0.98 0.00 0.00 173.24 173.58 3dda s ILE 303 N -1.64 4.69 -0.18 -1.02 2.07 -1.26 -0.94 121.20 122.92 3dda s ILE 303 Ca -0.14 -0.66 -0.09 0.00 -1.41 0.00 0.00 60.65 58.35 3dda s ILE 303 Cb -0.09 -3.25 -0.05 0.00 0.13 0.00 0.00 42.46 39.21 3dda s ILE 303 CO -0.02 0.16 0.11 -0.69 -1.91 0.00 0.00 174.94 172.59 3dda s VAL 304 N -1.38 5.21 0.00 4.00 1.01 -0.28 -4.87 120.40 124.09 3dda s VAL 304 Ca 0.29 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.39 3dda s VAL 304 Cb -0.12 -3.35 0.00 0.00 0.00 0.00 0.00 36.38 32.91 3dda s VAL 304 CO 0.22 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.41 3dda n GLY 305 N 3.24 0.86 0.09 4.51 0.00 -1.26 -4.77 105.19 107.85 3dda n GLY 305 Ca -0.17 -2.08 0.06 0.00 0.00 0.00 0.00 46.02 43.83 3dda n GLY 305 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3dda n THR 306 N 0.76 1.37 0.06 2.61 -2.24 -1.26 -4.77 114.28 110.81 3dda n THR 306 Ca 0.00 -1.59 -0.21 0.00 -2.27 0.00 0.00 64.05 59.99 3dda n THR 306 Cb 0.00 0.10 -0.13 0.00 -2.10 0.00 0.00 70.33 68.20 3dda n THR 306 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 3dda h THR 307 N 0.83 1.35 -4.08 4.28 1.35 -2.01 -3.48 112.91 111.16 3dda h THR 307 Ca 0.00 -2.36 -0.13 0.00 -0.55 0.00 0.00 66.41 63.37 3dda h THR 307 Cb 0.90 2.73 -0.13 0.00 -1.73 0.00 0.00 68.15 69.92 3dda h THR 307 CO 0.00 0.71 -0.44 0.00 -0.25 0.00 0.00 175.52 175.53 3dda s ALA 308 N -2.97 0.30 0.47 6.62 0.00 -1.26 -5.16 121.76 119.76 3dda s ALA 308 Ca -0.11 -1.08 -0.07 0.00 0.00 0.00 0.00 51.96 50.70 3dda s ALA 308 Cb 0.04 0.84 -0.04 0.00 0.00 0.00 0.00 23.12 23.96 3dda s ALA 308 CO 0.89 -0.58 0.79 -1.54 0.00 0.00 0.00 175.76 175.32 3dda s SER 309 N -2.99 6.31 0.20 0.00 1.04 -1.26 -4.95 113.70 112.05 3dda s SER 309 Ca 0.19 0.99 -0.09 0.00 0.48 0.00 0.00 55.95 57.52 3dda s SER 309 Cb 0.05 -2.27 0.13 0.00 0.10 0.00 0.00 66.02 64.02 3dda s SER 309 CO 0.00 -0.56 1.75 0.25 0.98 0.00 0.00 173.24 175.67 3dda h LEU 310 N 0.41 1.03 -1.22 2.42 5.85 -1.96 -1.40 115.31 120.45 3dda h LEU 310 Ca -0.47 -0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.01 3dda h LEU 310 Cb 1.20 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.94 3dda h LEU 310 CO 0.62 0.94 -0.00 0.06 -0.34 0.00 0.00 178.44 179.72 3dda h GLN 311 N 1.06 0.53 -0.05 1.25 -0.00 -1.99 0.54 115.11 116.46 3dda h GLN 311 Ca 0.24 -0.11 -0.02 0.00 -0.00 0.00 0.00 58.65 58.76 3dda h GLN 311 Cb 0.25 -0.08 -0.00 0.00 -0.00 0.00 0.00 27.48 27.65 3dda h GLN 311 CO -0.01 0.56 -0.05 -0.92 -0.00 0.00 0.00 178.83 178.40 3dda h TYR 312 N 0.51 0.14 -0.29 0.06 3.20 -1.83 -2.32 116.97 116.45 3dda h TYR 312 Ca 0.11 -0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.89 3dda h TYR 312 Cb 0.33 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.56 3dda h TYR 312 CO 0.01 0.58 -0.04 0.52 -1.64 0.00 0.00 178.16 177.60 3dda h MET 313 N -0.34 0.45 -0.29 1.82 2.86 -1.01 0.46 114.93 118.87 3dda h MET 313 Ca 0.01 -0.10 -0.10 0.00 -2.06 0.00 0.00 59.70 57.45 3dda h MET 313 Cb 0.56 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 3dda h MET 313 CO 0.01 0.51 -0.26 0.87 1.06 0.00 0.00 176.91 179.10 3dda h LYS 314 N 0.43 0.57 -0.27 1.72 1.57 -0.88 -2.08 116.57 117.62 3dda h LYS 314 Ca 0.09 -0.23 -0.15 0.00 -1.87 0.00 0.00 60.65 58.50 3dda h LYS 314 Cb 0.34 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 3dda h LYS 314 CO 0.01 0.78 -0.43 -0.97 -0.57 0.00 0.00 179.45 178.28 3dda h ASN 315 N 0.50 0.72 -0.52 0.86 -0.73 -0.77 -0.03 115.58 115.61 3dda h ASN 315 Ca 0.07 -0.34 0.03 0.00 1.87 0.00 0.00 56.30 57.94 3dda h ASN 315 Cb 0.71 -0.20 -0.04 0.00 0.27 0.00 0.00 38.32 39.05 3dda h ASN 315 CO 0.05 1.05 0.29 0.58 -0.37 0.00 0.00 177.43 179.04 3dda h VAL 316 N 0.55 1.01 0.00 2.57 2.07 -0.53 -0.59 116.25 121.32 3dda h VAL 316 Ca 0.04 -0.20 -0.09 0.00 0.82 0.00 0.00 66.70 67.28 3dda h VAL 316 Cb 0.96 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 3dda h VAL 316 CO 0.09 0.11 -0.41 -0.26 0.02 0.00 0.00 177.57 177.11 3dda h PHE 317 N 0.58 0.00 -0.44 1.57 0.04 -1.25 -0.80 116.94 116.64 3dda h PHE 317 Ca 0.22 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.92 3dda h PHE 317 Cb 0.07 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.21 3dda h PHE 317 CO -0.08 0.41 0.00 -0.22 -0.60 0.00 0.00 178.31 177.83 3dda h LYS 318 N 0.00 0.77 -0.28 1.51 3.64 -0.45 -1.83 116.57 119.94 3dda h LYS 318 Ca -0.00 -0.24 -0.18 0.00 -1.27 0.00 0.00 60.65 58.95 3dda h LYS 318 Cb 1.27 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 33.02 3dda h LYS 318 CO 0.05 0.84 -0.55 0.93 -2.27 0.00 0.00 179.45 178.45 3dda h GLU 319 N 0.61 0.84 0.14 1.90 5.08 -1.03 0.23 114.58 122.35 3dda h GLU 319 Ca 0.12 -0.53 -0.01 0.00 -1.00 0.00 0.00 59.36 57.94 3dda h GLU 319 Cb 0.49 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.80 3dda h GLU 319 CO 0.02 1.17 -0.07 -0.22 -1.00 0.00 0.00 179.01 178.91 3dda h LYS 320 N 0.64 -0.18 -0.11 2.33 3.64 -1.03 -3.10 116.57 118.77 3dda h LYS 320 Ca 0.01 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 3dda h LYS 320 Cb 1.15 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 3dda h LYS 320 CO 0.12 -0.05 0.00 0.66 -2.27 0.00 0.00 179.45 177.91 3dda n TYR 321 N -5.13 0.13 -3.81 1.91 4.01 -0.70 -4.95 117.16 108.61 3dda n TYR 321 Ca -0.08 -0.06 -0.25 0.00 -0.16 0.00 0.00 57.90 57.35 3dda n TYR 321 Cb 0.13 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.18 3dda n TYR 321 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 3dda n LEU 322 N 0.55 -2.78 -4.82 7.72 4.77 0.63 -4.86 117.00 118.22 3dda n LEU 322 Ca 0.17 -0.85 -0.31 0.00 -0.03 0.00 0.00 56.01 54.99 3dda n LEU 322 Cb 0.41 -2.55 0.05 0.00 -2.33 0.00 0.00 43.42 39.01 3dda n LEU 322 CO 0.15 0.42 0.71 -0.76 -1.33 0.00 0.00 177.39 176.58 3dda s LEU 323 N -6.89 3.14 -0.05 2.23 1.43 -0.16 -4.74 118.68 113.63 3dda s LEU 323 Ca 0.18 1.63 -0.04 0.00 -1.03 0.00 0.00 54.13 54.87 3dda s LEU 323 Cb -0.09 -4.50 -0.04 0.00 0.03 0.00 0.00 46.19 41.59 3dda s LEU 323 CO 0.83 -1.46 0.16 -0.44 0.23 0.00 0.00 176.35 175.68 3dda s SER 324 N -3.75 6.37 -0.11 2.29 0.01 -0.07 -4.90 113.70 113.54 3dda s SER 324 Ca 0.58 0.40 0.02 0.00 1.31 0.00 0.00 55.95 58.26 3dda s SER 324 Cb -0.14 -2.03 0.01 0.00 0.21 0.00 0.00 66.02 64.07 3dda s SER 324 CO 0.55 0.32 -0.18 -0.70 0.41 0.00 0.00 173.24 173.64 3dda s GLU 325 N -1.57 2.51 0.00 12.44 2.12 -1.26 -1.47 118.70 131.47 3dda s GLU 325 Ca 0.22 -0.67 0.00 0.00 0.36 0.00 0.00 54.97 54.88 3dda s GLU 325 Cb -0.12 -2.06 0.00 0.00 0.26 0.00 0.00 34.13 32.21 3dda s GLU 325 CO 0.13 -0.01 0.00 -0.40 -0.54 0.00 0.00 175.26 174.44 3dda n ASP 326 N 4.05 0.00 0.16 -1.70 5.68 -0.80 -4.93 116.55 119.01 3dda n ASP 326 Ca -0.20 -0.92 -0.15 0.00 -0.50 0.00 0.00 54.79 53.03 3dda n ASP 326 Cb 0.52 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.42 3dda n ASP 326 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 3dda h THR 327 N -0.27 0.21 0.00 2.12 1.35 -2.01 -1.33 112.91 112.99 3dda h THR 327 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 3dda h THR 327 Cb 0.00 0.21 0.00 0.00 -1.73 0.00 0.00 68.15 66.63 3dda h THR 327 CO 0.00 0.00 0.00 -1.20 -0.25 0.00 0.00 175.52 174.07 3dda n SER 328 N -5.46 0.00 0.00 5.36 7.64 -1.26 -4.76 113.62 115.14 3dda n SER 328 Ca -0.08 0.35 0.00 0.00 1.01 0.00 0.00 58.87 60.15 3dda n SER 328 Cb 0.37 -0.37 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 3dda n SER 328 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dda n GLY 329 N -1.14 0.49 3.80 0.23 0.00 -0.50 -5.03 105.19 103.03 3dda n GLY 329 Ca 0.01 -0.84 -0.38 0.00 0.00 0.00 0.00 46.02 44.81 3dda n GLY 329 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dda s LYS 330 N -1.54 4.35 0.16 1.61 2.20 -1.26 -4.80 119.74 120.46 3dda s LYS 330 Ca 0.00 0.93 -0.05 0.00 -0.36 0.00 0.00 55.97 56.49 3dda s LYS 330 Cb 0.00 -3.15 -0.06 0.00 -1.51 0.00 0.00 37.83 33.11 3dda s LYS 330 CO 0.00 0.55 0.39 -0.06 -0.36 0.00 0.00 175.35 175.87 3dda s PHE 331 N -1.24 3.47 0.11 4.03 0.08 -1.26 -1.91 117.98 121.27 3dda s PHE 331 Ca 0.35 0.58 -0.12 0.00 0.12 0.00 0.00 56.93 57.86 3dda s PHE 331 Cb -0.20 -2.02 0.02 0.00 -0.57 0.00 0.00 43.02 40.24 3dda s PHE 331 CO 0.22 0.41 0.30 -1.54 -0.10 0.00 0.00 175.22 174.52 3dda s SER 332 N -2.47 -0.06 -0.26 1.36 1.04 -0.54 -4.77 113.70 108.00 3dda s SER 332 Ca 0.42 -0.51 -0.09 0.00 0.48 0.00 0.00 55.95 56.25 3dda s SER 332 Cb -0.12 0.42 -0.04 0.00 0.10 0.00 0.00 66.02 66.38 3dda s SER 332 CO 0.25 -0.81 0.11 -0.69 0.98 0.00 0.00 173.24 173.08 3dda s VAL 333 N -3.84 4.69 -0.17 5.02 1.01 -1.26 -0.90 120.40 124.95 3dda s VAL 333 Ca 0.05 -0.04 -0.23 0.00 0.00 0.00 0.00 61.98 61.75 3dda s VAL 333 Cb 0.03 -3.20 -0.02 0.00 0.00 0.00 0.00 36.38 33.19 3dda s VAL 333 CO -0.10 0.31 0.74 -0.62 0.00 0.00 0.00 175.10 175.43 3dda s ASP 334 N 1.61 6.85 0.23 3.32 2.15 -1.26 -4.96 116.67 124.61 3dda s ASP 334 Ca 0.06 1.04 -0.07 0.00 0.43 0.00 0.00 52.55 54.02 3dda s ASP 334 Cb -0.15 -2.41 0.37 0.00 -0.30 0.00 0.00 42.92 40.43 3dda s ASP 334 CO 0.06 -0.32 1.74 0.50 -0.17 0.00 0.00 175.17 176.98 3dda h LYS 335 N 7.33 0.42 -0.32 4.34 3.11 -1.99 0.80 116.57 130.27 3dda h LYS 335 Ca -0.31 -0.03 -0.01 0.00 -2.81 0.00 0.00 60.65 57.49 3dda h LYS 335 Cb 1.14 -0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 32.26 3dda h LYS 335 CO 0.80 0.28 0.17 -0.07 -2.81 0.00 0.00 179.45 177.82 3dda h LEU 336 N 0.43 0.40 -0.63 5.20 3.38 -1.99 -0.57 115.31 121.53 3dda h LEU 336 Ca 0.36 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 58.15 3dda h LEU 336 Cb 0.50 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 3dda h LEU 336 CO -0.36 0.39 0.08 0.11 0.09 0.00 0.00 178.44 178.75 3dda h LYS 337 N 0.38 1.06 0.17 1.13 1.57 -1.77 -1.87 116.57 117.24 3dda h LYS 337 Ca 0.11 -0.30 -0.01 0.00 -1.87 0.00 0.00 60.65 58.58 3dda h LYS 337 Cb 0.08 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.27 3dda h LYS 337 CO -0.02 1.00 -0.08 0.35 -0.57 0.00 0.00 179.45 180.13 3dda h PHE 338 N 0.97 -0.21 -0.95 -1.35 3.57 -0.69 -1.75 116.94 116.54 3dda h PHE 338 Ca 0.19 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.80 3dda h PHE 338 Cb 0.47 0.07 -0.08 0.00 2.79 0.00 0.00 35.95 39.19 3dda h PHE 338 CO 0.03 0.00 0.59 -0.44 -2.23 0.00 0.00 178.31 176.26 3dda h ASP 339 N -0.39 0.86 -0.33 0.41 3.32 -1.03 0.17 116.42 119.43 3dda h ASP 339 Ca -0.02 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.04 3dda h ASP 339 Cb 0.30 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 3dda h ASP 339 CO 0.04 0.47 0.07 0.50 -1.72 0.00 0.00 179.24 178.60 3dda h LYS 340 N 0.94 0.54 -0.23 3.56 3.64 -1.15 0.01 116.57 123.88 3dda h LYS 340 Ca 0.47 -0.13 -0.09 0.00 -1.27 0.00 0.00 60.65 59.62 3dda h LYS 340 Cb 0.44 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.19 3dda h LYS 340 CO -0.26 0.60 -0.21 1.25 -2.27 0.00 0.00 179.45 178.57 3dda h LEU 341 N 0.39 0.58 -0.58 5.20 5.85 -0.79 -1.09 115.31 124.86 3dda h LEU 341 Ca 0.10 -0.47 0.03 0.00 0.84 0.00 0.00 57.88 58.39 3dda h LEU 341 Cb 0.31 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 3dda h LEU 341 CO 0.00 0.92 0.34 0.22 -0.34 0.00 0.00 178.44 179.59 3dda h TYR 342 N 0.24 0.63 -0.52 1.25 3.20 -0.64 -1.01 116.97 120.12 3dda h TYR 342 Ca 0.04 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.84 3dda h TYR 342 Cb 0.75 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.80 3dda h TYR 342 CO 0.08 0.34 -0.03 -0.22 -1.64 0.00 0.00 178.16 176.69 3dda h LYS 343 N 0.66 0.91 0.12 1.82 3.11 -0.92 -1.39 116.57 120.89 3dda h LYS 343 Ca 0.24 -0.28 -0.00 0.00 -2.81 0.00 0.00 60.65 57.79 3dda h LYS 343 Cb 0.06 -0.09 -0.00 0.00 -1.00 0.00 0.00 32.23 31.21 3dda h LYS 343 CO -0.12 0.93 -0.07 1.98 -2.81 0.00 0.00 179.45 179.36 3dda h MET 344 N 0.84 -0.17 0.00 1.90 4.05 -0.51 0.30 114.93 121.34 3dda h MET 344 Ca 0.15 0.01 -0.06 0.00 -0.28 0.00 0.00 59.70 59.52 3dda h MET 344 Cb 0.54 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.37 3dda h MET 344 CO 0.03 -0.12 -0.30 -0.07 0.23 0.00 0.00 176.91 176.69 3dda h LEU 345 N -0.18 0.00 0.00 3.39 3.38 -1.07 -2.33 115.31 118.50 3dda h LEU 345 Ca -0.01 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.79 3dda h LEU 345 Cb 0.15 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 3dda h LEU 345 CO 0.02 0.30 -1.87 0.35 0.09 0.00 0.00 178.44 177.33 3dda n THR 346 N -3.88 0.63 -0.04 0.22 -2.24 -0.54 -4.48 114.28 103.95 3dda n THR 346 Ca -0.02 -0.51 -0.04 0.00 -2.27 0.00 0.00 64.05 61.22 3dda n THR 346 Cb 0.38 -0.35 -0.06 0.00 -2.10 0.00 0.00 70.33 68.20 3dda n THR 346 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3dda n GLU 347 N -2.35 2.77 -0.00 -0.78 1.02 0.10 -4.73 120.64 116.67 3dda n GLU 347 Ca -0.16 -0.00 -0.19 0.00 -0.02 0.00 0.00 57.16 56.79 3dda n GLU 347 Cb 0.76 -1.18 -0.14 0.00 -0.02 0.00 0.00 31.44 30.86 3dda n GLU 347 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3dda h ILE 348 N 0.00 1.38 -2.10 -3.67 1.08 -1.18 -3.41 117.51 109.61 3dda h ILE 348 Ca -0.19 -2.43 -0.63 0.00 -0.39 0.00 0.00 64.86 61.22 3dda h ILE 348 Cb 1.43 3.01 -0.13 0.00 -3.07 0.00 0.00 36.82 38.06 3dda h ILE 348 CO 0.01 0.65 0.98 -0.31 -0.69 0.00 0.00 178.15 178.79 3dda s TYR 349 N -2.39 2.72 0.04 1.37 2.02 -0.90 -4.81 117.35 115.40 3dda s TYR 349 Ca -0.18 -0.84 -0.01 0.00 -0.37 0.00 0.00 57.07 55.68 3dda s TYR 349 Cb 0.02 -4.45 -0.03 0.00 -0.40 0.00 0.00 41.96 37.09 3dda s TYR 349 CO 0.76 -1.74 -0.03 0.95 -1.57 0.00 0.00 175.55 173.93 3dda s THR 350 N 4.11 0.18 0.16 -0.71 -4.23 -1.26 -4.71 115.64 109.18 3dda s THR 350 Ca 0.34 -1.49 -0.16 0.00 -1.18 0.00 0.00 61.69 59.21 3dda s THR 350 Cb -0.07 -1.08 0.03 0.00 1.34 0.00 0.00 72.50 72.72 3dda s THR 350 CO -0.01 -0.82 1.79 -0.08 -0.54 0.00 0.00 174.62 174.96 3dda h GLU 351 N 3.66 0.45 -1.01 3.99 4.81 -0.91 -1.80 114.58 123.77 3dda h GLU 351 Ca -0.33 -0.03 0.07 0.00 -0.13 0.00 0.00 59.36 58.94 3dda h GLU 351 Cb 1.16 -0.10 -0.07 0.00 0.63 0.00 0.00 28.75 30.38 3dda h GLU 351 CO 0.57 0.30 0.65 0.22 -0.73 0.00 0.00 179.01 180.02 3dda h ASP 352 N 0.46 1.04 -0.05 1.04 3.58 -1.33 -1.18 116.42 119.98 3dda h ASP 352 Ca 0.17 0.01 -0.12 0.00 0.42 0.00 0.00 57.03 57.50 3dda h ASP 352 Cb 0.03 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 40.86 3dda h ASP 352 CO -0.09 0.66 -0.37 0.78 -2.88 0.00 0.00 179.24 177.34 3dda h ASN 353 N 1.17 0.58 -0.30 2.28 2.35 -1.69 -2.91 115.58 117.07 3dda h ASN 353 Ca 0.44 -0.24 -0.06 0.00 -0.55 0.00 0.00 56.30 55.88 3dda h ASN 353 Cb 0.18 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.37 3dda h ASN 353 CO -0.18 0.89 -0.01 -0.26 -1.65 0.00 0.00 177.43 176.23 3dda h PHE 354 N 0.46 0.68 -0.97 1.19 0.04 -0.42 -2.19 116.94 115.73 3dda h PHE 354 Ca 0.05 -0.08 0.05 0.00 2.80 0.00 0.00 57.97 60.79 3dda h PHE 354 Cb 0.85 -0.19 -0.06 0.00 2.20 0.00 0.00 35.95 38.75 3dda h PHE 354 CO 0.03 0.65 0.63 0.28 -0.60 0.00 0.00 178.31 179.30 3dda h VAL 355 N 0.61 1.12 -0.68 -0.55 2.07 -1.11 -0.24 116.25 117.47 3dda h VAL 355 Ca 0.12 -0.40 -0.04 0.00 0.82 0.00 0.00 66.70 67.20 3dda h VAL 355 Cb 0.40 -0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 29.98 3dda h VAL 355 CO 0.02 0.21 0.24 0.11 0.02 0.00 0.00 177.57 178.17 3dda h LYS 356 N 1.17 1.02 -0.05 1.57 1.57 -1.29 -0.81 116.57 119.74 3dda h LYS 356 Ca 0.40 -0.19 -0.22 0.00 -1.87 0.00 0.00 60.65 58.78 3dda h LYS 356 Cb 0.09 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.24 3dda h LYS 356 CO -0.15 0.85 -0.87 0.74 -0.57 0.00 0.00 179.45 179.45 3dda h PHE 357 N 0.99 0.70 0.00 -1.35 -1.00 -0.99 -3.22 116.94 112.07 3dda h PHE 357 Ca 0.23 -0.35 0.00 0.00 2.81 0.00 0.00 57.97 60.66 3dda h PHE 357 Cb 0.23 -0.09 0.00 0.00 3.61 0.00 0.00 35.95 39.70 3dda h PHE 357 CO 0.02 1.15 -0.02 0.74 -1.61 0.00 0.00 178.31 178.59 3dda h PHE 358 N 0.31 0.00 -5.83 -0.55 0.04 -0.93 -3.48 116.94 106.50 3dda h PHE 358 Ca -0.07 0.00 -0.37 0.00 2.80 0.00 0.00 57.97 60.34 3dda h PHE 358 Cb 1.48 0.00 0.12 0.00 2.20 0.00 0.00 35.95 39.76 3dda h PHE 358 CO 0.06 0.00 -0.79 1.63 -0.60 0.00 0.00 178.31 178.61 3dda n LYS 359 N -2.49 -5.93 -4.55 1.51 5.02 -0.32 -5.00 118.16 106.39 3dda n LYS 359 Ca 0.05 0.76 -0.26 0.00 -2.02 0.00 0.00 58.31 56.84 3dda n LYS 359 Cb 0.46 -5.59 -0.11 0.00 -0.02 0.00 0.00 35.03 29.78 3dda n LYS 359 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3dda s VAL 360 N -3.49 2.08 0.18 -0.18 -7.23 -1.20 -4.99 120.40 105.57 3dda s VAL 360 Ca 0.00 -2.14 -0.13 0.00 -1.81 0.00 0.00 61.98 57.90 3dda s VAL 360 Cb -0.00 -2.72 -0.07 0.00 0.56 0.00 0.00 36.38 34.14 3dda s VAL 360 CO 0.76 -0.15 0.57 -0.22 -0.31 0.00 0.00 175.10 175.75 3dda s LEU 361 N -3.61 4.27 0.21 1.32 2.96 -1.26 -4.88 118.68 117.70 3dda s LEU 361 Ca 0.33 1.06 -0.20 0.00 -0.22 0.00 0.00 54.13 55.10 3dda s LEU 361 Cb 0.05 -3.45 0.04 0.00 0.50 0.00 0.00 46.19 43.32 3dda s LEU 361 CO 0.16 0.03 0.60 0.21 -1.32 0.00 0.00 176.35 176.04 3dda s ASN 362 N -1.93 -0.34 0.52 3.68 3.84 -1.26 -4.64 114.94 114.82 3dda s ASN 362 Ca 0.42 -0.40 -0.22 0.00 0.21 0.00 0.00 52.86 52.87 3dda s ASN 362 Cb -0.14 0.63 -0.06 0.00 -0.55 0.00 0.00 41.25 41.13 3dda s ASN 362 CO 0.20 -1.13 1.22 -2.11 -2.79 0.00 0.00 177.10 172.49 3dda n ARG 363 N -0.39 1.52 0.05 0.43 1.85 -1.26 -4.89 116.66 113.97 3dda n ARG 363 Ca -0.10 0.56 0.12 0.00 -1.00 0.00 0.00 57.85 57.43 3dda n ARG 363 Cb 0.62 -2.39 0.20 0.00 -1.05 0.00 0.00 32.46 29.84 3dda n ARG 363 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 3dda n LYS 364 N -0.69 0.23 -3.65 2.89 4.76 -1.26 -4.92 118.16 115.52 3dda n LYS 364 Ca 0.10 0.07 -0.12 0.00 -2.87 0.00 0.00 58.31 55.49 3dda n LYS 364 Cb 0.44 -1.64 -0.06 0.00 -1.84 0.00 0.00 35.03 31.93 3dda n LYS 364 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 3dda s THR 365 N -3.13 0.06 -0.44 -0.18 -1.32 -1.26 -4.87 115.64 104.50 3dda s THR 365 Ca 0.07 -0.52 0.23 0.00 -1.21 0.00 0.00 61.69 60.26 3dda s THR 365 Cb 0.14 -1.05 0.33 0.00 -1.51 0.00 0.00 72.50 70.41 3dda s THR 365 CO 0.71 -0.29 1.60 0.22 -2.21 0.00 0.00 174.62 174.66 3dda h TYR 366 N 2.72 0.00 -0.71 9.09 3.20 -1.96 -3.37 116.97 125.95 3dda h TYR 366 Ca -0.32 0.00 -0.72 0.00 3.14 0.00 0.00 58.73 60.83 3dda h TYR 366 Cb 1.23 0.00 -0.07 0.00 1.54 0.00 0.00 36.73 39.43 3dda h TYR 366 CO 0.37 0.00 2.95 1.28 -1.64 0.00 0.00 178.16 181.12 3dda n LEU 367 N -3.08 8.20 0.00 2.82 4.77 -1.26 -4.86 117.00 123.59 3dda n LEU 367 Ca 0.04 -4.66 0.00 0.00 -0.03 0.00 0.00 56.01 51.36 3dda n LEU 367 Cb 0.53 -1.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.17 3dda n LEU 367 CO 0.34 2.00 0.00 -0.46 -1.33 0.00 0.00 177.39 177.94 3dda n ASN 368 N 2.67 1.14 -4.08 -1.43 6.94 -1.26 -4.81 115.26 114.44 3dda n ASN 368 Ca 0.67 -0.51 -0.24 0.00 -0.02 0.00 0.00 54.58 54.47 3dda n ASN 368 Cb 0.25 0.00 -0.16 0.00 -2.36 0.00 0.00 39.78 37.51 3dda n ASN 368 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 3dda s PHE 369 N -0.66 1.46 0.59 -2.53 0.08 -0.83 -4.97 117.98 111.12 3dda s PHE 369 Ca 0.00 -0.44 -0.19 0.00 0.12 0.00 0.00 56.93 56.42 3dda s PHE 369 Cb 0.00 -1.01 -0.03 0.00 -0.57 0.00 0.00 43.02 41.40 3dda s PHE 369 CO 0.00 -0.17 1.25 -0.51 -0.10 0.00 0.00 175.22 175.68 3dda s ASP 370 N 0.21 5.10 -0.11 1.36 1.01 -1.26 -4.87 116.67 118.11 3dda s ASP 370 Ca -0.06 2.49 -0.03 0.00 0.71 0.00 0.00 52.55 55.67 3dda s ASP 370 Cb -0.12 -2.61 -0.06 0.00 1.01 0.00 0.00 42.92 41.15 3dda s ASP 370 CO 0.02 -1.66 -0.12 0.29 0.21 0.00 0.00 175.17 173.91 3dda n LYS 371 N -1.54 0.25 -3.59 8.23 4.76 -1.24 -4.23 118.16 120.79 3dda n LYS 371 Ca 0.13 0.08 -0.06 0.00 -2.87 0.00 0.00 58.31 55.60 3dda n LYS 371 Cb 0.49 -1.03 -0.02 0.00 -1.84 0.00 0.00 35.03 32.63 3dda n LYS 371 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3dda s ALA 372 N -2.21 -1.78 -0.07 7.82 0.00 -1.26 -0.22 121.76 124.05 3dda s ALA 372 Ca -0.15 0.71 0.05 0.00 0.00 0.00 0.00 51.96 52.58 3dda s ALA 372 Cb 0.05 0.48 -0.01 0.00 0.00 0.00 0.00 23.12 23.65 3dda s ALA 372 CO 0.21 -0.82 -0.25 0.54 0.00 0.00 0.00 175.76 175.45 3dda s VAL 373 N -3.15 2.05 0.12 0.00 0.11 -0.80 -0.96 120.40 117.77 3dda s VAL 373 Ca 0.08 -1.05 0.10 0.00 -2.93 0.00 0.00 61.98 58.17 3dda s VAL 373 Cb -0.01 -1.75 -0.04 0.00 -1.53 0.00 0.00 36.38 33.05 3dda s VAL 373 CO -0.05 0.57 -0.22 -0.36 -3.33 0.00 0.00 175.10 171.70 3dda s PHE 374 N -0.01 2.43 -0.01 1.54 0.08 0.12 -0.87 117.98 121.25 3dda s PHE 374 Ca -0.08 -0.32 -0.16 0.00 0.12 0.00 0.00 56.93 56.48 3dda s PHE 374 Cb -0.15 -1.31 -0.06 0.00 -0.57 0.00 0.00 43.02 40.93 3dda s PHE 374 CO 0.05 0.35 0.45 0.21 -0.10 0.00 0.00 175.22 176.18 3dda s LYS 375 N -2.04 4.05 0.23 0.44 2.47 0.11 -1.36 119.74 123.65 3dda s LYS 375 Ca 0.16 0.47 0.00 0.00 -1.56 0.00 0.00 55.97 55.04 3dda s LYS 375 Cb -0.10 -3.27 -0.04 0.00 -1.46 0.00 0.00 37.83 32.96 3dda s LYS 375 CO 0.08 0.58 0.17 0.96 0.16 0.00 0.00 175.35 177.30 3dda s ILE 376 N -0.75 0.00 -0.30 5.43 -4.36 -0.73 -2.37 121.20 118.12 3dda s ILE 376 Ca 0.25 -1.98 -0.00 0.00 -0.26 0.00 0.00 60.65 58.65 3dda s ILE 376 Cb -0.17 -2.49 0.13 0.00 1.25 0.00 0.00 42.46 41.18 3dda s ILE 376 CO 0.14 0.00 0.28 0.21 0.24 0.00 0.00 174.94 175.81 3dda s ASN 377 N -3.20 1.89 0.00 4.36 2.47 -1.26 -4.59 114.94 114.61 3dda s ASN 377 Ca 0.39 -1.01 0.28 0.00 0.42 0.00 0.00 52.86 52.94 3dda s ASN 377 Cb 0.06 0.37 1.02 0.00 -1.45 0.00 0.00 41.25 41.24 3dda s ASN 377 CO 0.15 -0.37 1.73 2.30 -3.72 0.00 0.00 177.10 177.18 3dda n ILE 378 N 5.09 0.00 -0.10 -5.21 -5.35 -1.26 -4.35 119.36 108.19 3dda n ILE 378 Ca -0.00 -0.26 -0.11 0.00 -0.27 0.00 0.00 62.75 62.10 3dda n ILE 378 Cb 0.45 0.53 -0.04 0.00 -1.74 0.00 0.00 39.64 38.85 3dda n ILE 378 CO 0.00 0.00 0.00 0.58 -1.76 0.00 0.00 176.55 175.37 3dda h VAL 379 N 2.44 1.28 -3.18 7.28 2.07 -1.91 -3.39 116.25 120.84 3dda h VAL 379 Ca 0.00 -1.08 -0.53 0.00 0.82 0.00 0.00 66.70 65.92 3dda h VAL 379 Cb 0.52 1.39 0.04 0.00 -1.52 0.00 0.00 31.29 31.72 3dda h VAL 379 CO 0.00 0.34 0.76 -2.84 0.02 0.00 0.00 177.57 175.85 3dda s PRO 380 N -4.80 4.29 0.60 1.57 0.02 -1.26 -4.88 135.00 130.54 3dda s PRO 380 Ca -0.13 2.22 0.38 0.00 0.02 0.00 0.00 61.00 63.48 3dda s PRO 380 Cb 0.08 -3.17 1.86 0.00 0.02 0.00 0.00 34.50 33.30 3dda s PRO 380 CO 0.77 -0.43 2.17 0.87 -0.33 0.00 0.00 177.00 180.05 3dda h LYS 381 N 5.86 0.00 0.00 5.54 1.57 -1.84 -0.23 116.57 127.47 3dda h LYS 381 Ca -0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 3dda h LYS 381 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 3dda h LYS 381 CO 0.82 0.01 0.00 1.33 -0.57 0.00 0.00 179.45 181.05 3dda n VAL 382 N -3.15 0.37 -0.08 0.50 0.24 -1.26 -3.68 118.33 111.27 3dda n VAL 382 Ca -0.01 0.09 -0.11 0.00 -2.04 0.00 0.00 64.34 62.27 3dda n VAL 382 Cb 0.19 -0.70 -0.07 0.00 -1.47 0.00 0.00 33.84 31.79 3dda n VAL 382 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3dda n ASN 383 N -1.44 2.75 -3.64 -1.34 3.02 -0.16 -5.06 115.26 109.39 3dda n ASN 383 Ca 0.07 -0.08 -0.14 0.00 -0.03 0.00 0.00 54.58 54.39 3dda n ASN 383 Cb 0.25 -0.25 -0.07 0.00 -0.61 0.00 0.00 39.78 39.09 3dda n ASN 383 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3dda s TYR 384 N -2.32 -0.69 0.16 3.10 5.04 -0.84 -4.50 117.35 117.30 3dda s TYR 384 Ca -0.22 1.61 0.05 0.00 -2.44 0.00 0.00 57.07 56.08 3dda s TYR 384 Cb 0.06 0.26 -0.05 0.00 0.35 0.00 0.00 41.96 42.58 3dda s TYR 384 CO 0.37 -0.38 -0.11 0.95 -1.34 0.00 0.00 175.55 175.04 3dda s THR 385 N 0.08 1.30 0.26 4.34 -4.23 -0.57 -4.18 115.64 112.63 3dda s THR 385 Ca -0.02 -2.10 -0.01 0.00 -1.18 0.00 0.00 61.69 58.38 3dda s THR 385 Cb -0.04 -1.92 0.25 0.00 1.34 0.00 0.00 72.50 72.13 3dda s THR 385 CO 0.02 -0.69 1.81 0.40 -0.54 0.00 0.00 174.62 175.62 3dda h ILE 386 N 2.71 0.87 0.00 2.99 2.04 -1.89 0.91 117.51 125.14 3dda h ILE 386 Ca -0.37 -0.28 -0.21 0.00 1.00 0.00 0.00 64.86 64.99 3dda h ILE 386 Cb 1.20 -0.03 -0.04 0.00 -0.74 0.00 0.00 36.82 37.22 3dda h ILE 386 CO 0.63 0.15 -1.45 1.88 0.00 0.00 0.00 178.15 179.36 3dda h TYR 387 N 0.82 0.00 -0.00 1.37 0.05 -1.94 -3.40 116.97 113.87 3dda h TYR 387 Ca 0.45 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.23 3dda h TYR 387 Cb 0.49 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.23 3dda h TYR 387 CO -0.05 0.76 -0.04 -0.25 -1.05 0.00 0.00 178.16 177.53 3dda n ASP 388 N -2.99 0.60 0.00 3.88 8.00 -1.18 -5.09 116.55 119.76 3dda n ASP 388 Ca -0.11 -0.80 0.00 0.00 0.71 0.00 0.00 54.79 54.59 3dda n ASP 388 Cb 0.92 0.52 0.00 0.00 -0.02 0.00 0.00 41.12 42.54 3dda n ASP 388 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dda n GLY 389 N 0.58 3.09 0.18 0.44 0.00 0.31 -1.68 105.19 108.10 3dda n GLY 389 Ca 0.01 -0.25 0.08 0.00 0.00 0.00 0.00 46.02 45.86 3dda n GLY 389 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3dda h PHE 390 N 0.00 0.00 -0.67 1.61 0.04 -1.86 -1.53 116.94 114.53 3dda h PHE 390 Ca 0.00 0.00 -0.72 0.00 2.80 0.00 0.00 57.97 60.05 3dda h PHE 390 Cb 0.00 0.00 -0.08 0.00 2.20 0.00 0.00 35.95 38.07 3dda h PHE 390 CO 0.00 0.20 2.78 0.09 -0.60 0.00 0.00 178.31 180.78 3dda n ASN 391 N -3.10 5.97 -4.68 2.17 3.02 -0.68 -4.30 115.26 113.67 3dda n ASN 391 Ca 0.02 -2.93 -0.46 0.00 -0.03 0.00 0.00 54.58 51.18 3dda n ASN 391 Cb 0.62 -1.53 -0.04 0.00 -0.61 0.00 0.00 39.78 38.22 3dda n ASN 391 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3dda n LEU 392 N 4.07 3.47 -4.74 3.41 4.77 -1.26 -4.40 117.00 122.32 3dda n LEU 392 Ca 0.55 1.00 -0.36 0.00 -0.03 0.00 0.00 56.01 57.17 3dda n LEU 392 Cb 0.32 -1.42 0.05 0.00 -2.33 0.00 0.00 43.42 40.04 3dda n LEU 392 CO 0.83 -0.08 0.86 0.00 -1.33 0.00 0.00 177.39 177.67 3dda s ARG 393 N 2.96 2.77 -1.48 3.23 1.70 -1.26 -2.35 118.95 124.53 3dda s ARG 393 Ca 0.87 1.91 -0.07 0.00 -0.47 0.00 0.00 55.73 57.97 3dda s ARG 393 Cb -0.64 -1.89 0.02 0.00 -0.57 0.00 0.00 34.95 31.86 3dda s ARG 393 CO 0.45 -1.39 0.82 0.09 -1.08 0.00 0.00 175.30 174.19 3dda n ASN 394 N -1.77 -5.99 -3.81 -2.89 3.02 -1.26 -4.91 115.26 97.64 3dda n ASN 394 Ca 0.14 -0.41 -0.12 0.00 -0.03 0.00 0.00 54.58 54.16 3dda n ASN 394 Cb 0.49 -4.80 -0.07 0.00 -0.61 0.00 0.00 39.78 34.80 3dda n ASN 394 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3dda s THR 395 N -3.22 0.00 -1.05 3.41 -4.23 -1.21 -5.02 115.64 104.32 3dda s THR 395 Ca 0.43 -1.67 0.11 0.00 -1.18 0.00 0.00 61.69 59.38 3dda s THR 395 Cb -0.20 -2.43 0.11 0.00 1.34 0.00 0.00 72.50 71.32 3dda s THR 395 CO 0.53 0.00 1.36 -0.46 -0.54 0.00 0.00 174.62 175.51 3dda n ASN 396 N -0.70 0.00 -0.26 3.99 6.94 -1.26 -2.19 115.26 121.77 3dda n ASN 396 Ca 0.01 0.46 0.12 0.00 -0.02 0.00 0.00 54.58 55.15 3dda n ASN 396 Cb 0.63 -0.48 0.23 0.00 -2.36 0.00 0.00 39.78 37.81 3dda n ASN 396 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 3dda n LEU 397 N -1.48 1.22 -0.16 -4.53 4.77 -1.26 -4.41 117.00 111.15 3dda n LEU 397 Ca 0.03 -0.37 -0.10 0.00 -0.03 0.00 0.00 56.01 55.54 3dda n LEU 397 Cb 0.13 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 3dda n LEU 397 CO 0.10 0.24 0.84 0.00 -1.33 0.00 0.00 177.39 177.24 3dda h ALA 398 N 3.61 0.63 -2.32 -1.18 0.00 -1.04 -2.86 119.26 116.09 3dda h ALA 398 Ca 0.00 -0.24 -0.49 0.00 0.00 0.00 0.00 54.91 54.17 3dda h ALA 398 Cb 0.57 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3dda h ALA 398 CO 0.00 0.38 -0.21 0.00 0.00 0.00 0.00 179.25 179.42 3dda s ALA 399 N -5.14 3.71 -1.03 0.00 0.00 -1.26 -4.45 121.76 113.59 3dda s ALA 399 Ca -0.13 -0.84 -0.01 0.00 0.00 0.00 0.00 51.96 50.99 3dda s ALA 399 Cb 0.11 -2.12 0.00 0.00 0.00 0.00 0.00 23.12 21.12 3dda s ALA 399 CO 0.80 0.12 0.04 0.09 0.00 0.00 0.00 175.76 176.81 3dda n ASN 400 N -1.41 -3.81 -2.72 0.00 5.03 -1.26 -1.03 115.26 110.05 3dda n ASN 400 Ca -0.04 0.17 -0.19 0.00 0.87 0.00 0.00 54.58 55.38 3dda n ASN 400 Cb 0.55 -3.23 0.00 0.00 -1.02 0.00 0.00 39.78 36.08 3dda n ASN 400 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 3dda n PHE 401 N -3.40 -1.50 0.19 3.10 3.72 -1.26 -4.84 117.46 113.46 3dda n PHE 401 Ca -0.13 0.21 0.14 0.00 -0.05 0.00 0.00 57.45 57.61 3dda n PHE 401 Cb 0.60 -3.59 0.72 0.00 -0.94 0.00 0.00 39.48 36.27 3dda n PHE 401 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 3dda h ASN 402 N -0.51 0.00 0.21 4.37 2.35 -1.14 -0.48 115.58 120.38 3dda h ASN 402 Ca -0.43 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.24 3dda h ASN 402 Cb 1.31 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.67 3dda h ASN 402 CO 0.50 0.00 -0.31 1.23 -1.65 0.00 0.00 177.43 177.20 3dda h GLY 403 N 0.00 0.18 1.18 2.83 0.00 -1.69 -2.27 103.07 103.30 3dda h GLY 403 Ca 0.08 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.27 3dda h GLY 403 CO -0.00 0.13 -0.33 -1.06 0.00 0.00 0.00 176.54 175.28 3dda n GLN 404 N -4.13 0.11 -2.41 4.80 6.02 -0.23 -4.73 117.38 116.81 3dda n GLN 404 Ca -0.01 -0.05 -0.42 0.00 -0.01 0.00 0.00 57.00 56.51 3dda n GLN 404 Cb 0.39 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.13 3dda n GLN 404 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 3dda s ASN 405 N -2.92 6.15 0.26 1.08 3.84 -0.85 -0.40 114.94 122.08 3dda s ASN 405 Ca 0.14 0.26 0.21 0.00 0.21 0.00 0.00 52.86 53.68 3dda s ASN 405 Cb 0.18 -2.55 0.99 0.00 -0.55 0.00 0.00 41.25 39.32 3dda s ASN 405 CO 0.63 -1.70 1.65 0.35 -2.79 0.00 0.00 177.10 175.24 3dda n THR 406 N 6.84 0.96 0.01 -5.21 -2.24 -0.15 -0.28 114.28 114.21 3dda n THR 406 Ca 0.12 0.41 -0.22 0.00 -2.27 0.00 0.00 64.05 62.10 3dda n THR 406 Cb 0.49 -1.36 -0.14 0.00 -2.10 0.00 0.00 70.33 67.22 3dda n THR 406 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3dda h GLU 407 N 0.00 0.26 -0.02 -0.78 5.08 -1.90 -3.03 114.58 114.19 3dda h GLU 407 Ca 0.00 -0.44 -0.04 0.00 -1.00 0.00 0.00 59.36 57.88 3dda h GLU 407 Cb 0.22 0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.64 3dda h GLU 407 CO 0.00 1.21 -0.14 0.82 -1.00 0.00 0.00 179.01 179.90 3dda h ILE 408 N -0.23 1.53 -1.73 3.13 2.04 -1.77 -3.29 117.51 117.19 3dda h ILE 408 Ca -0.32 -1.76 -0.72 0.00 1.00 0.00 0.00 64.86 63.06 3dda h ILE 408 Cb 1.82 2.64 -0.26 0.00 -0.74 0.00 0.00 36.82 40.27 3dda h ILE 408 CO 0.07 0.47 0.96 -3.20 0.00 0.00 0.00 178.15 176.46 3dda n ASN 409 N -4.61 7.44 0.19 1.72 5.15 0.61 -4.74 115.26 121.02 3dda n ASN 409 Ca -0.09 -3.76 0.14 0.00 -0.60 0.00 0.00 54.58 50.27 3dda n ASN 409 Cb 0.43 -1.07 0.73 0.00 -0.53 0.00 0.00 39.78 39.34 3dda n ASN 409 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 3dda h ASN 410 N 2.82 0.00 0.45 1.20 -1.07 -1.60 -2.17 115.58 115.21 3dda h ASN 410 Ca 0.55 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.92 3dda h ASN 410 Cb 0.22 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.47 3dda h ASN 410 CO 1.40 0.00 0.00 0.24 0.07 0.00 0.00 177.43 179.14 3dda h MET 411 N 0.00 0.00 -0.16 4.14 2.86 -1.87 -2.52 114.93 117.38 3dda h MET 411 Ca 0.08 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 3dda h MET 411 Cb 0.36 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.02 3dda h MET 411 CO -0.00 0.00 0.00 0.09 1.06 0.00 0.00 176.91 178.06 3dda n ASN 412 N -2.65 2.96 -3.87 1.22 4.13 -0.82 -4.94 115.26 111.30 3dda n ASN 412 Ca -0.00 -1.94 -0.13 0.00 1.68 0.00 0.00 54.58 54.18 3dda n ASN 412 Cb 0.16 -0.09 -0.14 0.00 -1.54 0.00 0.00 39.78 38.16 3dda n ASN 412 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 3dda s PHE 413 N -1.81 0.11 -0.20 3.10 0.08 -0.95 -4.50 117.98 113.80 3dda s PHE 413 Ca 0.33 0.00 -0.00 0.00 0.12 0.00 0.00 56.93 57.38 3dda s PHE 413 Cb 0.21 -0.11 0.05 0.00 -0.57 0.00 0.00 43.02 42.60 3dda s PHE 413 CO 0.31 -0.02 -0.05 0.99 -0.10 0.00 0.00 175.22 176.35 3dda s THR 414 N 0.19 1.24 -0.03 0.64 2.01 -1.00 -4.92 115.64 113.77 3dda s THR 414 Ca -0.02 -0.89 -0.30 0.00 0.31 0.00 0.00 61.69 60.80 3dda s THR 414 Cb -0.03 -1.49 -0.05 0.00 0.01 0.00 0.00 72.50 70.94 3dda s THR 414 CO -0.01 -0.00 1.38 -0.75 -0.69 0.00 0.00 174.62 174.55 3dda s LYS 415 N 1.55 4.28 -0.15 4.92 2.20 -1.26 -0.71 119.74 130.56 3dda s LYS 415 Ca -0.02 1.90 0.18 0.00 -0.36 0.00 0.00 55.97 57.67 3dda s LYS 415 Cb -0.17 -3.63 -0.26 0.00 -1.51 0.00 0.00 37.83 32.26 3dda s LYS 415 CO -0.07 -0.60 0.21 1.28 -0.36 0.00 0.00 175.35 175.81 3dda n LEU 416 N 5.65 0.11 -3.63 5.43 4.77 -0.05 -4.95 117.00 124.33 3dda n LEU 416 Ca 0.13 0.05 -0.12 0.00 -0.03 0.00 0.00 56.01 56.05 3dda n LEU 416 Cb 0.44 0.38 -0.07 0.00 -2.33 0.00 0.00 43.42 41.84 3dda n LEU 416 CO 0.58 0.40 0.46 -0.75 -1.33 0.00 0.00 177.39 176.75 3dda s LYS 417 N -2.66 0.76 -0.13 3.23 2.20 -1.20 -5.01 119.74 116.92 3dda s LYS 417 Ca -0.09 0.98 -0.08 0.00 -0.36 0.00 0.00 55.97 56.42 3dda s LYS 417 Cb 0.07 0.33 -0.04 0.00 -1.51 0.00 0.00 37.83 36.68 3dda s LYS 417 CO 0.84 -0.10 0.15 -0.80 -0.36 0.00 0.00 175.35 175.08 3dda s ASN 418 N 0.60 6.37 -0.09 1.43 0.01 -1.26 -1.91 114.94 120.09 3dda s ASN 418 Ca -0.02 0.44 0.15 0.00 -0.71 0.00 0.00 52.86 52.72 3dda s ASN 418 Cb -0.05 -2.09 -0.22 0.00 0.41 0.00 0.00 41.25 39.30 3dda s ASN 418 CO -0.04 0.34 0.20 0.49 -1.51 0.00 0.00 177.10 176.58 3dda n PHE 419 N 2.37 0.00 -1.70 2.20 3.72 0.70 -4.93 117.46 119.81 3dda n PHE 419 Ca -0.19 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.78 3dda n PHE 419 Cb 0.54 -0.57 -0.03 0.00 -0.94 0.00 0.00 39.48 38.48 3dda n PHE 419 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 3dda n THR 420 N -2.33 0.33 -0.19 4.37 -1.04 -1.22 -2.01 114.28 112.20 3dda n THR 420 Ca -0.14 -0.08 0.00 0.00 -2.04 0.00 0.00 64.05 61.78 3dda n THR 420 Cb 0.72 -1.80 0.00 0.00 -1.82 0.00 0.00 70.33 67.44 3dda n THR 420 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3dda n GLY 421 N 3.21 1.57 0.07 3.41 0.00 -0.84 -4.87 105.19 107.73 3dda n GLY 421 Ca 0.14 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.28 3dda n GLY 421 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dda n LEU 422 N 0.00 0.66 0.00 0.99 4.77 -0.85 -5.07 117.00 117.50 3dda n LEU 422 Ca 0.00 0.16 0.03 0.00 -0.03 0.00 0.00 56.01 56.18 3dda n LEU 422 Cb 0.00 -0.09 0.21 0.00 -2.33 0.00 0.00 43.42 41.21 3dda n LEU 422 CO 0.00 -0.07 0.44 0.49 -1.33 0.00 0.00 177.39 176.92