#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b8s s PRO 23 N 0.00 1.73 0.35 0.00 0.02 -1.26 -4.88 135.00 130.96 3b8s s PRO 23 Ca 0.00 0.51 -0.29 0.00 0.02 0.00 0.00 61.00 61.24 3b8s s PRO 23 Cb 0.00 -1.89 -0.11 0.00 0.02 0.00 0.00 34.50 32.52 3b8s s PRO 23 CO 0.00 -1.83 1.51 0.99 -0.33 0.00 0.00 177.00 177.34 3b8s s THR 24 N -3.20 2.10 0.19 0.99 2.01 0.96 -4.51 115.64 114.18 3b8s s THR 24 Ca 0.62 0.09 -0.32 0.00 0.31 0.00 0.00 61.69 62.40 3b8s s THR 24 Cb -0.15 -3.06 -0.11 0.00 0.01 0.00 0.00 72.50 69.20 3b8s s THR 24 CO 0.54 0.02 1.62 0.00 -0.69 0.00 0.00 174.62 176.11 3b8s s ALA 25 N -0.75 3.83 0.33 7.40 0.00 -1.26 -4.78 121.76 126.52 3b8s s ALA 25 Ca 0.56 1.46 -0.28 0.00 0.00 0.00 0.00 51.96 53.70 3b8s s ALA 25 Cb -0.46 -3.65 -0.13 0.00 0.00 0.00 0.00 23.12 18.88 3b8s s ALA 25 CO 0.58 -0.84 1.18 -2.30 0.00 0.00 0.00 175.76 174.37 3b8s n PRO 26 N 3.79 1.81 -3.81 0.00 -0.02 -1.26 -4.83 135.00 130.68 3b8s n PRO 26 Ca 0.14 0.64 -0.37 0.00 -2.02 0.00 0.00 63.50 61.89 3b8s n PRO 26 Cb 0.37 -2.14 -0.13 0.00 -0.02 0.00 0.00 33.50 31.58 3b8s n PRO 26 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3b8s s SER 27 N -0.42 4.93 0.10 2.55 0.15 0.02 -4.20 113.70 116.82 3b8s s SER 27 Ca 0.57 -0.69 -0.31 0.00 0.70 0.00 0.00 55.95 56.22 3b8s s SER 27 Cb -0.61 -1.83 -0.07 0.00 -1.71 0.00 0.00 66.02 61.79 3b8s s SER 27 CO 0.61 -0.16 1.25 -0.63 1.20 0.00 0.00 173.24 175.51 3b8s s ILE 28 N 1.47 3.75 -0.85 6.45 1.01 -1.26 -1.13 121.20 130.64 3b8s s ILE 28 Ca 0.02 1.29 -0.18 0.00 0.00 0.00 0.00 60.65 61.78 3b8s s ILE 28 Cb -0.17 -3.83 0.13 0.00 0.01 0.00 0.00 42.46 38.61 3b8s s ILE 28 CO 0.01 0.12 1.00 -0.62 0.00 0.00 0.00 174.94 175.46 3b8s s ASP 29 N 0.87 6.55 0.09 3.58 -1.08 -0.12 -4.92 116.67 121.64 3b8s s ASP 29 Ca 0.59 -1.96 -0.32 0.00 -0.52 0.00 0.00 52.55 50.34 3b8s s ASP 29 Cb -0.32 -2.36 -0.14 0.00 -1.46 0.00 0.00 42.92 38.64 3b8s s ASP 29 CO 0.31 -1.03 1.60 -0.03 0.52 0.00 0.00 175.17 176.53 3b8s h MET 30 N 8.79 -0.78 -0.70 4.34 1.85 -1.93 -2.08 114.93 124.43 3b8s h MET 30 Ca 0.05 0.05 0.06 0.00 -0.61 0.00 0.00 59.70 59.25 3b8s h MET 30 Cb 1.04 0.18 -0.06 0.00 0.43 0.00 0.00 31.60 33.19 3b8s h MET 30 CO 1.06 -0.52 0.40 -0.92 -0.40 0.00 0.00 176.91 176.53 3b8s h TYR 31 N -0.81 0.74 0.00 1.39 3.20 -1.97 -1.42 116.97 118.11 3b8s h TYR 31 Ca -0.03 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.86 3b8s h TYR 31 Cb 0.72 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.77 3b8s h TYR 31 CO -0.23 0.36 0.00 0.41 -1.64 0.00 0.00 178.16 177.07 3b8s n GLY 32 N -1.29 -1.12 1.14 1.82 0.00 -1.14 -3.56 105.19 101.03 3b8s n GLY 32 Ca 0.09 -0.14 -0.05 0.00 0.00 0.00 0.00 46.02 45.92 3b8s n GLY 32 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3b8s n SER 33 N -1.24 2.83 -3.64 1.61 7.64 -0.79 -4.63 113.62 115.39 3b8s n SER 33 Ca 0.14 -3.84 -0.27 0.00 1.01 0.00 0.00 58.87 55.91 3b8s n SER 33 Cb 0.19 -0.54 0.02 0.00 -1.01 0.00 0.00 64.21 62.88 3b8s n SER 33 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 3b8s n ASN 34 N -1.03 -4.78 -2.15 6.43 5.15 -1.23 -0.95 115.26 116.70 3b8s n ASN 34 Ca 0.30 -0.61 -0.13 0.00 -0.60 0.00 0.00 54.58 53.54 3b8s n ASN 34 Cb 0.85 -3.85 -0.02 0.00 -0.53 0.00 0.00 39.78 36.23 3b8s n ASN 34 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 3b8s n ASN 35 N -2.65 -3.97 -2.71 1.20 3.02 -0.60 -1.75 115.26 107.80 3b8s n ASN 35 Ca 0.01 0.21 -0.21 0.00 -0.03 0.00 0.00 54.58 54.56 3b8s n ASN 35 Cb 0.54 -3.45 0.01 0.00 -0.61 0.00 0.00 39.78 36.27 3b8s n ASN 35 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3b8s n LEU 36 N -2.57 -2.10 -4.44 3.41 4.77 -0.12 -4.90 117.00 111.04 3b8s n LEU 36 Ca -0.15 -0.12 -0.37 0.00 -0.03 0.00 0.00 56.01 55.34 3b8s n LEU 36 Cb 0.57 -2.80 -0.12 0.00 -2.33 0.00 0.00 43.42 38.74 3b8s n LEU 36 CO 0.19 -0.01 -0.26 -1.10 -1.33 0.00 0.00 177.39 174.88 3b8s s GLN 37 N -5.37 3.55 0.20 3.23 -1.52 -0.71 -1.23 119.66 117.81 3b8s s GLN 37 Ca 0.14 -0.56 0.02 0.00 -1.95 0.00 0.00 55.36 53.02 3b8s s GLN 37 Cb -0.07 -3.41 -0.05 0.00 -0.22 0.00 0.00 33.01 29.27 3b8s s GLN 37 CO 0.18 -0.26 0.01 -0.06 -0.25 0.00 0.00 175.29 174.91 3b8s s PHE 38 N 1.61 1.36 -0.17 0.91 0.40 -0.03 -4.91 117.98 117.15 3b8s s PHE 38 Ca 0.06 -1.02 -0.17 0.00 -0.60 0.00 0.00 56.93 55.20 3b8s s PHE 38 Cb -0.16 -0.78 0.05 0.00 0.51 0.00 0.00 43.02 42.64 3b8s s PHE 38 CO 0.05 -0.18 0.47 0.45 0.70 0.00 0.00 175.22 176.71 3b8s s SER 39 N -3.23 -0.49 0.42 1.36 0.15 -1.26 -0.56 113.70 110.10 3b8s s SER 39 Ca 0.27 0.93 0.24 0.00 0.70 0.00 0.00 55.95 58.09 3b8s s SER 39 Cb 0.06 0.94 0.43 0.00 -1.71 0.00 0.00 66.02 65.75 3b8s s SER 39 CO 0.07 -0.18 1.64 0.11 1.20 0.00 0.00 173.24 176.08 3b8s h LYS 40 N 5.30 0.00 -6.13 5.44 1.57 -1.18 -3.42 116.57 118.16 3b8s h LYS 40 Ca -0.27 0.00 -0.69 0.00 -1.87 0.00 0.00 60.65 57.82 3b8s h LYS 40 Cb 1.18 0.00 -0.27 0.00 0.08 0.00 0.00 32.23 33.22 3b8s h LYS 40 CO 0.22 0.00 -0.81 -1.50 -0.57 0.00 0.00 179.45 176.78 3b8s s ILE 41 N -3.22 2.68 -0.24 1.86 2.07 -1.26 -0.51 121.20 122.58 3b8s s ILE 41 Ca 0.07 -0.85 -0.04 0.00 -1.41 0.00 0.00 60.65 58.42 3b8s s ILE 41 Cb 0.06 -2.03 0.00 0.00 0.13 0.00 0.00 42.46 40.62 3b8s s ILE 41 CO 0.66 0.57 -0.02 -0.70 -1.91 0.00 0.00 174.94 173.55 3b8s s GLU 42 N -0.41 3.22 -0.10 3.50 2.12 0.62 -4.95 118.70 122.71 3b8s s GLU 42 Ca 0.04 -0.73 0.00 0.00 0.36 0.00 0.00 54.97 54.64 3b8s s GLU 42 Cb -0.12 -3.10 0.02 0.00 0.26 0.00 0.00 34.13 31.19 3b8s s GLU 42 CO 0.02 -0.29 -0.09 -0.51 -0.54 0.00 0.00 175.26 173.85 3b8s s LEU 43 N 1.46 1.34 0.24 2.70 1.43 -1.26 -1.17 118.68 123.42 3b8s s LEU 43 Ca 0.04 -0.32 -0.31 0.00 -1.03 0.00 0.00 54.13 52.52 3b8s s LEU 43 Cb -0.15 -0.86 -0.11 0.00 0.03 0.00 0.00 46.19 45.09 3b8s s LEU 43 CO -0.02 -0.07 1.62 0.00 0.23 0.00 0.00 176.35 178.11 3b8s s ALA 44 N 1.42 3.81 -0.05 4.21 0.00 -0.65 -4.93 121.76 125.57 3b8s s ALA 44 Ca -0.00 1.53 0.07 0.00 0.00 0.00 0.00 51.96 53.55 3b8s s ALA 44 Cb -0.13 -3.65 -0.10 0.00 0.00 0.00 0.00 23.12 19.24 3b8s s ALA 44 CO -0.05 -0.91 0.06 -1.33 0.00 0.00 0.00 175.76 173.53 3b8s n MET 45 N 3.08 2.13 0.00 0.00 2.81 -1.26 -4.77 117.12 119.11 3b8s n MET 45 Ca 0.12 -0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.98 3b8s n MET 45 Cb 0.37 -1.18 0.00 0.00 -0.71 0.00 0.00 33.22 31.70 3b8s n MET 45 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 3b8s n GLU 46 N -2.13 2.11 -4.38 0.03 1.02 -1.26 -4.95 120.64 111.08 3b8s n GLU 46 Ca -0.09 -1.26 -0.19 0.00 -0.02 0.00 0.00 57.16 55.60 3b8s n GLU 46 Cb 0.59 -0.97 -0.10 0.00 -0.02 0.00 0.00 31.44 30.94 3b8s n GLU 46 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3b8s s THR 47 N -0.76 0.74 -0.09 2.62 -4.23 -1.26 -5.15 115.64 107.50 3b8s s THR 47 Ca 0.00 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.49 3b8s s THR 47 Cb 0.00 -2.64 0.03 0.00 1.34 0.00 0.00 72.50 71.23 3b8s s THR 47 CO 0.00 0.00 0.01 -0.89 -0.54 0.00 0.00 174.62 173.20 3b8s s THR 48 N -3.53 0.39 0.00 3.99 2.01 -1.26 -5.00 115.64 112.24 3b8s s THR 48 Ca 0.36 0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.40 3b8s s THR 48 Cb 0.07 -0.59 0.00 0.00 0.01 0.00 0.00 72.50 71.99 3b8s s THR 48 CO 0.15 0.20 0.00 -1.54 -0.69 0.00 0.00 174.62 172.74 3b8s n SER 49 N 5.14 0.00 -4.75 3.53 3.41 -1.26 -5.05 113.62 114.63 3b8s n SER 49 Ca -0.07 -0.03 -0.38 0.00 -0.26 0.00 0.00 58.87 58.12 3b8s n SER 49 Cb 0.50 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.48 3b8s n SER 49 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3b8s s GLY 50 N -0.03 2.87 0.20 5.00 0.00 -1.13 -4.17 107.32 110.06 3b8s s GLY 50 Ca 0.00 1.27 -0.14 0.00 0.00 0.00 0.00 44.72 45.84 3b8s s GLY 50 CO 0.00 1.77 1.64 -1.82 0.00 0.00 0.00 173.10 174.70 3b8s h TYR 51 N 1.52 -0.25 0.00 1.90 3.20 -1.21 -0.17 116.97 121.95 3b8s h TYR 51 Ca -0.51 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.41 3b8s h TYR 51 Cb 1.29 0.20 -0.00 0.00 1.54 0.00 0.00 36.73 39.76 3b8s h TYR 51 CO 0.47 -0.23 -0.03 -0.91 -1.64 0.00 0.00 178.16 175.82 3b8s h ASN 52 N 0.02 0.00 0.67 -2.11 2.35 -1.84 0.76 115.58 115.43 3b8s h ASN 52 Ca 0.27 0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 55.77 3b8s h ASN 52 Cb 0.42 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.79 3b8s h ASN 52 CO -0.56 0.03 -1.16 -0.78 -1.65 0.00 0.00 177.43 173.30 3b8s h ASP 53 N 0.00 0.35 0.57 5.81 3.58 -1.49 -3.37 116.42 121.86 3b8s h ASP 53 Ca -0.00 -0.36 -0.28 0.00 0.42 0.00 0.00 57.03 56.81 3b8s h ASP 53 Cb 0.53 -0.11 -0.03 0.00 1.72 0.00 0.00 39.33 41.43 3b8s h ASP 53 CO 0.00 1.27 -1.54 0.24 -2.88 0.00 0.00 179.24 176.33 3b8s h MET 54 N 0.07 0.07 -4.96 0.28 2.86 -0.47 -3.46 114.93 109.32 3b8s h MET 54 Ca -0.10 -0.13 -0.67 0.00 -2.06 0.00 0.00 59.70 56.74 3b8s h MET 54 Cb 1.89 0.05 -0.32 0.00 0.06 0.00 0.00 31.60 33.28 3b8s h MET 54 CO 0.18 0.79 -0.77 0.08 1.06 0.00 0.00 176.91 178.26 3b8s s VAL 55 N -2.62 2.82 -0.21 -2.22 1.01 0.20 -1.64 120.40 117.74 3b8s s VAL 55 Ca -0.06 -0.87 -0.01 0.00 0.00 0.00 0.00 61.98 61.04 3b8s s VAL 55 Cb 0.08 -2.35 0.06 0.00 0.00 0.00 0.00 36.38 34.17 3b8s s VAL 55 CO 0.83 0.33 -0.01 -0.54 0.00 0.00 0.00 175.10 175.70 3b8s s LYS 56 N 1.36 1.12 -0.16 2.72 1.02 -0.32 -4.64 119.74 120.85 3b8s s LYS 56 Ca 0.03 -0.68 -0.07 0.00 0.02 0.00 0.00 55.97 55.27 3b8s s LYS 56 Cb -0.15 -2.31 -0.04 0.00 -0.52 0.00 0.00 37.83 34.81 3b8s s LYS 56 CO -0.06 -0.61 0.07 -0.47 -0.92 0.00 0.00 175.35 173.36 3b8s s TYR 57 N 1.64 3.30 -0.06 3.18 5.04 -1.26 -0.27 117.35 128.91 3b8s s TYR 57 Ca -0.03 0.17 0.04 0.00 -2.44 0.00 0.00 57.07 54.82 3b8s s TYR 57 Cb -0.18 -2.01 -0.02 0.00 0.35 0.00 0.00 41.96 40.10 3b8s s TYR 57 CO -0.07 0.30 -0.20 -1.01 -1.34 0.00 0.00 175.55 173.23 3b8s s HIS 58 N -0.05 2.57 0.41 4.97 3.76 0.34 -5.01 115.29 122.28 3b8s s HIS 58 Ca 0.07 -0.50 0.25 0.00 -0.15 0.00 0.00 55.06 54.72 3b8s s HIS 58 Cb -0.12 -1.64 1.37 0.00 1.11 0.00 0.00 32.58 33.30 3b8s s HIS 58 CO 0.01 -0.07 2.05 0.93 -0.85 0.00 0.00 174.74 176.81 3b8s h GLU 59 N 5.89 0.00 -4.55 1.40 4.39 -1.97 -3.42 114.58 116.32 3b8s h GLU 59 Ca -0.36 0.00 -0.45 0.00 0.34 0.00 0.00 59.36 58.89 3b8s h GLU 59 Cb 1.17 0.00 -0.32 0.00 -0.10 0.00 0.00 28.75 29.50 3b8s h GLU 59 CO 0.49 0.14 -0.79 -0.51 -1.16 0.00 0.00 179.01 177.18 3b8s s LEU 60 N -7.46 1.71 0.22 1.33 1.43 -1.26 -4.44 118.68 110.22 3b8s s LEU 60 Ca -0.03 -0.21 -0.30 0.00 -1.03 0.00 0.00 54.13 52.57 3b8s s LEU 60 Cb 0.13 -0.60 -0.08 0.00 0.03 0.00 0.00 46.19 45.67 3b8s s LEU 60 CO 0.60 0.05 1.03 0.00 0.23 0.00 0.00 176.35 178.26 3b8s s ALA 61 N 0.35 3.35 -0.27 4.21 0.00 0.11 -4.82 121.76 124.68 3b8s s ALA 61 Ca -0.06 0.74 -0.25 0.00 0.00 0.00 0.00 51.96 52.39 3b8s s ALA 61 Cb -0.11 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.73 3b8s s ALA 61 CO 0.01 -0.03 0.88 0.15 0.00 0.00 0.00 175.76 176.77 3b8s s LYS 62 N -0.91 4.11 -0.15 0.00 1.02 -1.26 -1.46 119.74 121.09 3b8s s LYS 62 Ca 0.45 0.91 -0.05 0.00 0.02 0.00 0.00 55.97 57.29 3b8s s LYS 62 Cb -0.28 -3.68 -0.04 0.00 -0.52 0.00 0.00 37.83 33.31 3b8s s LYS 62 CO 0.35 -0.64 0.03 0.42 -0.92 0.00 0.00 175.35 174.59 3b8s s ILE 63 N 3.05 4.53 -0.26 2.17 -1.09 0.90 -4.81 121.20 125.69 3b8s s ILE 63 Ca 0.37 -0.14 -0.03 0.00 -2.23 0.00 0.00 60.65 58.62 3b8s s ILE 63 Cb -0.14 -2.99 0.09 0.00 -1.58 0.00 0.00 42.46 37.83 3b8s s ILE 63 CO 0.10 0.51 0.10 -0.75 -1.23 0.00 0.00 174.94 173.67 3b8s s LYS 64 N -0.03 0.35 -0.18 2.79 2.20 -1.26 -1.42 119.74 122.18 3b8s s LYS 64 Ca 0.05 -0.54 -0.00 0.00 -0.36 0.00 0.00 55.97 55.12 3b8s s LYS 64 Cb -0.12 -1.61 0.01 0.00 -1.51 0.00 0.00 37.83 34.59 3b8s s LYS 64 CO 0.01 -0.89 -0.15 0.08 -0.36 0.00 0.00 175.35 174.05 3b8s s VAL 65 N 1.97 2.51 0.03 4.02 1.01 -0.12 -4.71 120.40 125.10 3b8s s VAL 65 Ca 0.06 -0.80 -0.15 0.00 0.00 0.00 0.00 61.98 61.09 3b8s s VAL 65 Cb -0.16 -2.08 -0.06 0.00 0.00 0.00 0.00 36.38 34.08 3b8s s VAL 65 CO -0.25 0.51 0.45 -0.54 0.00 0.00 0.00 175.10 175.27 3b8s s LYS 66 N 1.21 3.97 0.08 2.72 1.02 -1.26 0.09 119.74 127.57 3b8s s LYS 66 Ca 0.02 0.48 -0.02 0.00 0.02 0.00 0.00 55.97 56.47 3b8s s LYS 66 Cb -0.14 -3.20 -0.03 0.00 -0.52 0.00 0.00 37.83 33.94 3b8s s LYS 66 CO -0.07 0.66 0.03 -0.59 -0.92 0.00 0.00 175.35 174.46 3b8s s PHE 67 N -1.12 0.55 0.08 3.18 -0.12 0.03 -0.95 117.98 119.63 3b8s s PHE 67 Ca 0.26 -1.04 0.02 0.00 -0.05 0.00 0.00 56.93 56.12 3b8s s PHE 67 Cb -0.17 -0.36 -0.03 0.00 -0.63 0.00 0.00 43.02 41.83 3b8s s PHE 67 CO 0.15 -0.45 -0.08 0.54 -0.05 0.00 0.00 175.22 175.33 3b8s s ASN 68 N -2.95 1.12 -0.40 1.98 4.22 -0.28 -1.06 114.94 117.57 3b8s s ASN 68 Ca 0.11 -0.77 0.07 0.00 -2.14 0.00 0.00 52.86 50.13 3b8s s ASN 68 Cb 0.07 0.05 0.22 0.00 1.28 0.00 0.00 41.25 42.87 3b8s s ASN 68 CO -0.07 -0.30 0.47 0.00 -2.04 0.00 0.00 177.10 175.15 3b8s n GLN 69 N 0.73 0.58 0.23 3.55 6.02 0.18 -0.80 117.38 127.85 3b8s n GLN 69 Ca -0.17 -3.23 0.15 0.00 -0.01 0.00 0.00 57.00 53.73 3b8s n GLN 69 Cb 0.57 -1.38 0.49 0.00 1.02 0.00 0.00 30.24 30.95 3b8s n GLN 69 CO 0.00 0.00 0.00 -1.49 -1.01 0.00 0.00 177.06 174.56 3b8s h TRP 70 N 4.53 0.00 -4.06 1.08 6.55 -1.94 -3.42 115.95 118.68 3b8s h TRP 70 Ca 0.14 0.00 -0.69 0.00 0.95 0.00 0.00 58.89 59.29 3b8s h TRP 70 Cb 0.89 0.00 -0.24 0.00 -0.86 0.00 0.00 29.16 28.95 3b8s h TRP 70 CO 0.34 0.00 -0.87 -1.12 -1.05 0.00 0.00 178.44 175.74 3b8s s SER 71 N -5.57 3.23 0.52 -3.49 0.01 -1.26 -5.07 113.70 102.06 3b8s s SER 71 Ca 0.04 -0.69 0.00 0.00 1.31 0.00 0.00 55.95 56.61 3b8s s SER 71 Cb 0.08 -0.24 0.00 0.00 0.21 0.00 0.00 66.02 66.07 3b8s s SER 71 CO 0.57 0.21 0.00 0.61 0.41 0.00 0.00 173.24 175.03 3b8s n GLY 72 N 1.25 0.20 3.76 3.44 0.00 -1.26 -4.67 105.19 107.92 3b8s n GLY 72 Ca -0.18 -0.90 -0.38 0.00 0.00 0.00 0.00 46.02 44.56 3b8s n GLY 72 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3b8s s THR 73 N 0.00 5.06 -0.08 2.61 2.01 -1.26 -4.92 115.64 119.05 3b8s s THR 73 Ca 0.00 1.00 0.15 0.00 0.31 0.00 0.00 61.69 63.14 3b8s s THR 73 Cb 0.00 -3.82 -0.17 0.00 0.01 0.00 0.00 72.50 68.52 3b8s s THR 73 CO 0.00 0.42 0.78 0.77 -0.69 0.00 0.00 174.62 175.90 3b8s h SER 74 N 5.85 0.00 -2.67 3.53 4.64 -1.87 0.27 113.55 123.31 3b8s h SER 74 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3b8s h SER 74 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3b8s h SER 74 CO 0.70 0.77 0.00 0.61 -0.87 0.00 0.00 176.83 178.04 3b8s n GLY 75 N 1.46 -1.80 0.35 -0.77 0.00 -1.26 -4.70 105.19 98.46 3b8s n GLY 75 Ca -0.12 -1.79 -0.22 0.00 0.00 0.00 0.00 46.02 43.89 3b8s n GLY 75 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3b8s n ASP 76 N 0.22 1.51 -4.20 1.61 8.00 0.56 -4.73 116.55 119.52 3b8s n ASP 76 Ca 0.00 0.23 -0.14 0.00 0.71 0.00 0.00 54.79 55.59 3b8s n ASP 76 Cb 0.00 -0.59 -0.10 0.00 -0.02 0.00 0.00 41.12 40.41 3b8s n ASP 76 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3b8s s THR 77 N -2.38 1.00 0.19 -3.53 -4.23 -0.82 -1.22 115.64 104.65 3b8s s THR 77 Ca -0.29 -1.83 0.11 0.00 -1.18 0.00 0.00 61.69 58.50 3b8s s THR 77 Cb 0.11 -1.58 -0.04 0.00 1.34 0.00 0.00 72.50 72.32 3b8s s THR 77 CO 0.37 -0.67 -0.20 -0.72 -0.54 0.00 0.00 174.62 172.86 3b8s s TYR 78 N -2.92 2.38 -0.02 3.99 -0.85 0.08 -0.14 117.35 119.87 3b8s s TYR 78 Ca 0.10 -0.33 0.05 0.00 -0.52 0.00 0.00 57.07 56.38 3b8s s TYR 78 Cb 0.00 -1.17 -0.01 0.00 0.38 0.00 0.00 41.96 41.16 3b8s s TYR 78 CO -0.00 0.51 -0.17 -0.80 -1.52 0.00 0.00 175.55 173.57 3b8s s ASN 79 N -2.74 1.98 -0.15 -0.18 0.01 0.09 -2.49 114.94 111.47 3b8s s ASN 79 Ca 0.22 -0.31 -0.04 0.00 -0.71 0.00 0.00 52.86 52.02 3b8s s ASN 79 Cb -0.08 -0.31 -0.03 0.00 0.41 0.00 0.00 41.25 41.24 3b8s s ASN 79 CO 0.11 0.19 -0.03 -0.69 -1.51 0.00 0.00 177.10 175.17 3b8s s VAL 80 N -0.27 3.95 -0.08 1.60 1.01 0.77 -0.60 120.40 126.78 3b8s s VAL 80 Ca 0.04 -0.34 0.03 0.00 0.00 0.00 0.00 61.98 61.71 3b8s s VAL 80 Cb -0.08 -2.73 -0.02 0.00 0.00 0.00 0.00 36.38 33.56 3b8s s VAL 80 CO 0.00 0.50 -0.18 -0.31 0.00 0.00 0.00 175.10 175.11 3b8s s TYR 81 N 0.31 2.64 -0.20 5.22 1.51 0.16 0.22 117.35 127.21 3b8s s TYR 81 Ca -0.03 -0.55 -0.03 0.00 -1.01 0.00 0.00 57.07 55.44 3b8s s TYR 81 Cb -0.14 -1.69 -0.01 0.00 -0.11 0.00 0.00 41.96 40.01 3b8s s TYR 81 CO 0.03 -0.11 -0.07 -0.06 -1.11 0.00 0.00 175.55 174.23 3b8s s PHE 82 N -0.14 2.93 -1.57 2.71 0.08 0.43 -1.55 117.98 120.87 3b8s s PHE 82 Ca -0.03 -0.89 -0.11 0.00 0.12 0.00 0.00 56.93 56.03 3b8s s PHE 82 Cb -0.14 -2.04 0.09 0.00 -0.57 0.00 0.00 43.02 40.36 3b8s s PHE 82 CO 0.04 -0.47 0.66 -0.25 -0.10 0.00 0.00 175.22 175.09 3b8s n ASP 83 N 4.49 -2.28 0.00 1.36 8.00 -0.26 -1.28 116.55 126.57 3b8s n ASP 83 Ca -0.18 -0.98 0.00 0.00 0.71 0.00 0.00 54.79 54.33 3b8s n ASP 83 Cb 0.51 -3.00 0.00 0.00 -0.02 0.00 0.00 41.12 38.61 3b8s n ASP 83 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3b8s n GLY 84 N -1.67 0.83 3.38 0.44 0.00 -1.26 -5.01 105.19 101.89 3b8s n GLY 84 Ca -0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 3b8s n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3b8s s VAL 85 N -3.35 3.07 0.12 1.61 1.01 -0.41 -5.05 120.40 117.40 3b8s s VAL 85 Ca 0.00 -0.66 -0.31 0.00 0.00 0.00 0.00 61.98 61.01 3b8s s VAL 85 Cb 0.00 -2.28 -0.09 0.00 0.00 0.00 0.00 36.38 34.01 3b8s s VAL 85 CO 0.00 0.53 1.57 -0.75 0.00 0.00 0.00 175.10 176.45 3b8s s LYS 86 N 0.26 4.22 0.00 2.72 2.20 -1.26 -0.43 119.74 127.45 3b8s s LYS 86 Ca -0.09 2.31 0.00 0.00 -0.36 0.00 0.00 55.97 57.82 3b8s s LYS 86 Cb -0.15 -3.33 0.00 0.00 -1.51 0.00 0.00 37.83 32.84 3b8s s LYS 86 CO 0.05 -0.63 0.00 1.33 -0.36 0.00 0.00 175.35 175.74 3b8s n VAL 87 N 4.25 0.00 -3.55 4.02 0.24 0.13 -4.90 118.33 118.52 3b8s n VAL 87 Ca 0.14 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.31 3b8s n VAL 87 Cb 0.40 0.45 -0.04 0.00 -1.47 0.00 0.00 33.84 33.17 3b8s n VAL 87 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3b8s s ALA 88 N -1.95 -1.31 0.14 2.33 0.00 -1.17 -4.94 121.76 114.86 3b8s s ALA 88 Ca 0.00 0.46 -0.06 0.00 0.00 0.00 0.00 51.96 52.36 3b8s s ALA 88 Cb 0.00 0.54 -0.02 0.00 0.00 0.00 0.00 23.12 23.64 3b8s s ALA 88 CO 0.00 -0.58 0.18 0.95 0.00 0.00 0.00 175.76 176.31 3b8s s THR 89 N -2.97 0.09 -1.78 0.00 -4.23 -1.26 -0.16 115.64 105.33 3b8s s THR 89 Ca -0.02 -1.60 0.00 0.00 -1.18 0.00 0.00 61.69 58.89 3b8s s THR 89 Cb -0.00 -1.89 0.00 0.00 1.34 0.00 0.00 72.50 71.95 3b8s s THR 89 CO -0.06 -0.40 0.00 0.61 -0.54 0.00 0.00 174.62 174.23 3b8s n GLY 90 N -0.15 -1.48 3.83 3.99 0.00 -1.04 -5.00 105.19 105.34 3b8s n GLY 90 Ca -0.07 -1.02 -0.38 0.00 0.00 0.00 0.00 46.02 44.55 3b8s n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3b8s s ALA 91 N -1.42 3.71 0.23 4.61 0.00 -1.26 -0.75 121.76 126.89 3b8s s ALA 91 Ca 0.00 -0.33 -0.30 0.00 0.00 0.00 0.00 51.96 51.33 3b8s s ALA 91 Cb 0.00 -2.31 -0.09 0.00 0.00 0.00 0.00 23.12 20.72 3b8s s ALA 91 CO 0.00 0.44 1.08 0.42 0.00 0.00 0.00 175.76 177.70 3b8s s ILE 92 N -0.81 3.72 -0.69 0.00 1.01 -0.36 -4.78 121.20 119.29 3b8s s ILE 92 Ca 0.21 1.62 0.05 0.00 0.00 0.00 0.00 60.65 62.53 3b8s s ILE 92 Cb -0.15 -4.03 0.24 0.00 0.01 0.00 0.00 42.46 38.53 3b8s s ILE 92 CO 0.10 0.34 0.77 0.35 0.00 0.00 0.00 174.94 176.50 3b8s n THR 93 N 1.75 2.54 -4.65 2.92 -2.24 -1.26 -4.89 114.28 108.45 3b8s n THR 93 Ca 0.00 -5.23 0.00 0.00 -2.27 0.00 0.00 64.05 56.55 3b8s n THR 93 Cb 0.46 -2.12 0.00 0.00 -2.10 0.00 0.00 70.33 66.56 3b8s n THR 93 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3b8s n GLY 94 N 1.09 1.00 0.00 3.38 0.00 -1.26 -3.67 105.19 105.74 3b8s n GLY 94 Ca 0.28 -0.72 0.15 0.00 0.00 0.00 0.00 46.02 45.73 3b8s n GLY 94 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3b8s n SER 95 N -0.46 0.02 -3.78 1.61 3.41 -1.26 -4.60 113.62 108.56 3b8s n SER 95 Ca 0.00 -0.03 -0.24 0.00 -0.26 0.00 0.00 58.87 58.35 3b8s n SER 95 Cb 0.00 -0.32 -0.17 0.00 -0.26 0.00 0.00 64.21 63.46 3b8s n SER 95 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3b8s s GLN 96 N -2.66 0.69 -0.04 4.33 -0.21 -1.24 -0.65 119.66 119.89 3b8s s GLN 96 Ca 0.26 0.03 0.05 0.00 0.02 0.00 0.00 55.36 55.71 3b8s s GLN 96 Cb 0.20 -1.13 -0.01 0.00 1.00 0.00 0.00 33.01 33.08 3b8s s GLN 96 CO 0.48 -0.33 -0.17 0.99 -2.12 0.00 0.00 175.29 174.14 3b8s s THR 97 N 1.94 1.41 -0.27 -0.19 2.01 -0.22 -4.52 115.64 115.80 3b8s s THR 97 Ca 0.04 -0.72 -0.09 0.00 0.31 0.00 0.00 61.69 61.23 3b8s s THR 97 Cb -0.13 -1.20 -0.04 0.00 0.01 0.00 0.00 72.50 71.14 3b8s s THR 97 CO -0.06 0.40 0.14 -0.89 -0.69 0.00 0.00 174.62 173.53 3b8s s THR 98 N -0.06 4.87 -0.40 -0.82 2.01 -1.26 -0.79 115.64 119.18 3b8s s THR 98 Ca -0.01 0.02 -0.18 0.00 0.31 0.00 0.00 61.69 61.82 3b8s s THR 98 Cb -0.10 -3.31 0.01 0.00 0.01 0.00 0.00 72.50 69.11 3b8s s THR 98 CO 0.01 0.29 0.49 0.00 -0.69 0.00 0.00 174.62 174.72 3b8s s ALA 99 N 1.70 3.42 -0.17 7.40 0.00 0.11 -4.96 121.76 129.27 3b8s s ALA 99 Ca 0.07 -1.32 -0.04 0.00 0.00 0.00 0.00 51.96 50.67 3b8s s ALA 99 Cb -0.16 -3.08 -0.02 0.00 0.00 0.00 0.00 23.12 19.86 3b8s s ALA 99 CO 0.08 -1.51 -0.04 -1.12 0.00 0.00 0.00 175.76 173.17 3b8s s SER 100 N 1.84 4.72 0.36 0.00 0.01 -1.26 -0.94 113.70 118.42 3b8s s SER 100 Ca 0.16 -0.17 -0.11 0.00 1.31 0.00 0.00 55.95 57.14 3b8s s SER 100 Cb -0.16 -1.78 0.04 0.00 0.21 0.00 0.00 66.02 64.34 3b8s s SER 100 CO 0.15 0.14 0.66 2.22 0.41 0.00 0.00 173.24 176.82 3b8s n PHE 101 N 3.74 -2.05 -4.27 2.43 -1.74 -0.51 -4.99 117.46 110.07 3b8s n PHE 101 Ca -0.17 -1.87 -0.22 0.00 -0.56 0.00 0.00 57.45 54.63 3b8s n PHE 101 Cb 0.52 0.77 -0.12 0.00 1.52 0.00 0.00 39.48 42.18 3b8s n PHE 101 CO 0.00 0.00 0.00 -1.21 -0.56 0.00 0.00 176.76 174.99 3b8s s GLU 102 N -2.27 1.09 -0.11 3.97 2.02 -1.26 -0.07 118.70 122.07 3b8s s GLU 102 Ca 0.18 -1.19 -0.06 0.00 0.02 0.00 0.00 54.97 53.92 3b8s s GLU 102 Cb -0.04 -1.21 0.05 0.00 0.10 0.00 0.00 34.13 33.03 3b8s s GLU 102 CO 0.13 0.27 0.25 -0.47 0.02 0.00 0.00 175.26 175.46 3b8s s TYR 103 N -1.53 -0.34 -2.60 1.61 5.04 -0.54 -4.95 117.35 114.05 3b8s s TYR 103 Ca 0.07 0.80 0.25 0.00 -2.44 0.00 0.00 57.07 55.75 3b8s s TYR 103 Cb -0.08 0.06 0.34 0.00 0.35 0.00 0.00 41.96 42.62 3b8s s TYR 103 CO 0.04 -0.23 1.33 0.41 -1.34 0.00 0.00 175.55 175.76 3b8s n GLY 104 N 4.18 0.48 3.23 8.97 0.00 -1.26 -0.71 105.19 120.08 3b8s n GLY 104 Ca -0.25 -0.62 -0.33 0.00 0.00 0.00 0.00 46.02 44.83 3b8s n GLY 104 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3b8s s GLN 105 N -2.15 3.15 0.67 1.61 0.74 -1.26 -4.87 119.66 117.55 3b8s s GLN 105 Ca 0.27 -0.79 -0.13 0.00 0.05 0.00 0.00 55.36 54.76 3b8s s GLN 105 Cb 0.20 -2.54 0.00 0.00 1.10 0.00 0.00 33.01 31.76 3b8s s GLN 105 CO 0.38 0.02 1.08 0.20 -0.55 0.00 0.00 175.29 176.42 3b8s s GLY 106 N 0.78 1.94 0.00 2.59 0.00 -1.26 -4.91 107.32 106.45 3b8s s GLY 106 Ca -0.07 0.33 0.00 0.00 0.00 0.00 0.00 44.72 44.98 3b8s s GLY 106 CO -0.00 0.66 0.00 0.61 0.00 0.00 0.00 173.10 174.37 3b8s n GLY 107 N -1.16 -0.80 3.51 0.20 0.00 0.45 -4.71 105.19 102.69 3b8s n GLY 107 Ca 0.09 -1.61 -0.34 0.00 0.00 0.00 0.00 46.02 44.16 3b8s n GLY 107 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3b8s s LEU 108 N 0.00 3.36 0.05 0.99 1.43 -1.26 -1.17 118.68 122.07 3b8s s LEU 108 Ca 0.00 -0.11 0.05 0.00 -1.03 0.00 0.00 54.13 53.04 3b8s s LEU 108 Cb 0.00 -1.83 -0.02 0.00 0.03 0.00 0.00 46.19 44.37 3b8s s LEU 108 CO 0.00 0.14 -0.14 -0.31 0.23 0.00 0.00 176.35 176.28 3b8s s TYR 109 N 0.52 1.18 -0.51 0.29 2.02 -0.72 -4.99 117.35 115.15 3b8s s TYR 109 Ca -0.01 -0.38 -0.25 0.00 -0.37 0.00 0.00 57.07 56.05 3b8s s TYR 109 Cb -0.14 -0.69 0.03 0.00 -0.40 0.00 0.00 41.96 40.76 3b8s s TYR 109 CO 0.02 0.03 0.97 -0.65 -1.57 0.00 0.00 175.55 174.36 3b8s s GLN 110 N -1.27 3.46 -0.14 -0.62 -1.52 -1.26 -0.92 119.66 117.38 3b8s s GLN 110 Ca 0.00 0.02 -0.12 0.00 -1.95 0.00 0.00 55.36 53.31 3b8s s GLN 110 Cb -0.08 -3.99 -0.05 0.00 -0.22 0.00 0.00 33.01 28.67 3b8s s GLN 110 CO 0.01 -1.39 0.25 1.41 -0.25 0.00 0.00 175.29 175.32 3b8s s MET 111 N 4.01 4.07 0.00 2.91 -2.45 0.53 -1.11 119.30 127.27 3b8s s MET 111 Ca 0.36 0.04 0.07 0.00 -1.25 0.00 0.00 55.69 54.90 3b8s s MET 111 Cb -0.11 -3.36 -0.02 0.00 1.25 0.00 0.00 34.83 32.59 3b8s s MET 111 CO 0.24 0.39 -0.21 -1.21 1.05 0.00 0.00 175.02 175.28 3b8s s GLU 112 N 0.02 1.62 -0.15 4.11 2.02 -0.60 -1.33 118.70 124.38 3b8s s GLU 112 Ca 0.16 -0.82 0.00 0.00 0.02 0.00 0.00 54.97 54.32 3b8s s GLU 112 Cb -0.13 -1.62 -0.00 0.00 0.10 0.00 0.00 34.13 32.48 3b8s s GLU 112 CO 0.04 0.44 -0.16 0.42 0.02 0.00 0.00 175.26 176.02 3b8s s ILE 113 N -0.60 2.63 -0.09 -1.63 1.01 -1.26 -0.67 121.20 120.59 3b8s s ILE 113 Ca 0.08 -0.78 -0.00 0.00 0.00 0.00 0.00 60.65 59.94 3b8s s ILE 113 Cb -0.08 -2.11 -0.03 0.00 0.01 0.00 0.00 42.46 40.25 3b8s s ILE 113 CO 0.00 0.52 -0.06 -0.70 0.00 0.00 0.00 174.94 174.70 3b8s s GLU 114 N 0.81 3.00 -0.14 2.79 2.12 0.23 -1.01 118.70 126.50 3b8s s GLU 114 Ca -0.05 -0.54 -0.03 0.00 0.36 0.00 0.00 54.97 54.71 3b8s s GLU 114 Cb -0.15 -2.68 -0.03 0.00 0.26 0.00 0.00 34.13 31.53 3b8s s GLU 114 CO -0.00 0.56 -0.05 0.00 -0.54 0.00 0.00 175.26 175.22 3b8s s ALA 115 N -0.51 2.95 0.06 6.30 0.00 -0.25 -0.73 121.76 129.58 3b8s s ALA 115 Ca 0.08 -0.84 0.07 0.00 0.00 0.00 0.00 51.96 51.27 3b8s s ALA 115 Cb -0.12 -1.46 -0.03 0.00 0.00 0.00 0.00 23.12 21.51 3b8s s ALA 115 CO 0.02 0.28 -0.19 0.00 0.00 0.00 0.00 175.76 175.86 3b8s n ASP 117 N 1.65 0.00 0.13 0.00 5.68 -0.26 -0.32 116.55 123.42 3b8s n ASP 117 Ca -0.18 -0.88 0.06 0.00 -0.50 0.00 0.00 54.79 53.28 3b8s n ASP 117 Cb 0.54 0.00 0.52 0.00 -1.14 0.00 0.00 41.12 41.03 3b8s n ASP 117 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3b8s h ALA 118 N 1.05 1.82 0.00 2.12 0.00 -2.01 -2.66 119.26 119.58 3b8s h ALA 118 Ca 0.00 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.71 3b8s h ALA 118 Cb 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3b8s h ALA 118 CO 0.00 0.16 -0.81 1.79 0.00 0.00 0.00 179.25 180.38 3b8s h THR 119 N 0.28 1.57 0.00 0.00 1.35 -1.98 -3.50 112.91 110.64 3b8s h THR 119 Ca 0.07 -2.75 0.00 0.00 -0.55 0.00 0.00 66.41 63.18 3b8s h THR 119 Cb -0.00 2.49 0.00 0.00 -1.73 0.00 0.00 68.15 68.91 3b8s h THR 119 CO -0.01 0.79 0.00 0.61 -0.25 0.00 0.00 175.52 176.65 3b8s n GLY 120 N 0.80 -0.63 3.23 5.82 0.00 -1.01 -4.49 105.19 108.91 3b8s n GLY 120 Ca -0.01 -1.20 -0.20 0.00 0.00 0.00 0.00 46.02 44.61 3b8s n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3b8s s SER 122 N -2.10 0.89 -0.08 0.00 0.01 -0.27 -4.86 113.70 107.29 3b8s s SER 122 Ca 0.05 -0.08 -0.11 0.00 1.31 0.00 0.00 55.95 57.12 3b8s s SER 122 Cb -0.08 -0.37 -0.05 0.00 0.21 0.00 0.00 66.02 65.74 3b8s s SER 122 CO 0.03 -0.10 0.26 -0.54 0.41 0.00 0.00 173.24 173.30 3b8s s LYS 123 N 1.16 3.73 0.97 12.44 1.02 -1.26 -1.09 119.74 136.72 3b8s s LYS 123 Ca -0.07 0.09 -0.12 0.00 0.02 0.00 0.00 55.97 55.89 3b8s s LYS 123 Cb -0.14 -3.23 0.17 0.00 -0.52 0.00 0.00 37.83 34.11 3b8s s LYS 123 CO -0.02 0.67 1.09 -1.54 -0.92 0.00 0.00 175.35 174.63 3b8s s SER 124 N -0.84 2.70 0.48 2.83 1.04 -0.18 -4.77 113.70 114.97 3b8s s SER 124 Ca 0.18 1.62 -0.24 0.00 0.48 0.00 0.00 55.95 57.99 3b8s s SER 124 Cb -0.14 -2.27 -0.07 0.00 0.10 0.00 0.00 66.02 63.64 3b8s s SER 124 CO 0.07 -3.14 1.40 0.00 0.98 0.00 0.00 173.24 172.55 3b8s s ALA 125 N -2.76 3.09 0.40 5.32 0.00 -1.26 -4.68 121.76 121.86 3b8s s ALA 125 Ca 0.65 1.42 -0.25 0.00 0.00 0.00 0.00 51.96 53.78 3b8s s ALA 125 Cb -0.21 -3.58 -0.09 0.00 0.00 0.00 0.00 23.12 19.25 3b8s s ALA 125 CO 0.59 -1.26 1.13 -1.25 0.00 0.00 0.00 175.76 174.97 3b8s s PRO 126 N -2.61 4.10 -0.07 0.00 0.04 -1.26 -4.74 135.00 130.45 3b8s s PRO 126 Ca 0.65 1.73 -0.08 0.00 0.04 0.00 0.00 61.00 63.34 3b8s s PRO 126 Cb -0.43 -2.64 0.02 0.00 0.04 0.00 0.00 34.50 31.49 3b8s s PRO 126 CO 0.53 -0.25 0.22 0.54 0.04 0.00 0.00 177.00 178.08 3b8s s VAL 127 N -1.48 0.02 0.01 -0.36 0.11 -0.44 -4.93 120.40 113.33 3b8s s VAL 127 Ca 0.57 -0.14 -0.30 0.00 -2.93 0.00 0.00 61.98 59.18 3b8s s VAL 127 Cb -0.28 -0.36 -0.05 0.00 -1.53 0.00 0.00 36.38 34.16 3b8s s VAL 127 CO 0.35 -0.08 1.23 -0.70 -3.33 0.00 0.00 175.10 172.57 3b8s s GLU 128 N -0.22 4.38 -0.09 1.54 2.12 -1.26 -0.35 118.70 124.82 3b8s s GLU 128 Ca -0.03 1.77 -0.00 0.00 0.36 0.00 0.00 54.97 57.06 3b8s s GLU 128 Cb -0.03 -3.45 -0.03 0.00 0.26 0.00 0.00 34.13 30.88 3b8s s GLU 128 CO 0.01 -0.37 -0.07 -1.50 -0.54 0.00 0.00 175.26 172.79 3b8s s ILE 129 N 1.67 3.70 -0.20 -3.70 2.07 -0.10 -4.89 121.20 119.76 3b8s s ILE 129 Ca 0.58 -0.46 -0.05 0.00 -1.41 0.00 0.00 60.65 59.31 3b8s s ILE 129 Cb -0.28 -2.54 -0.02 0.00 0.13 0.00 0.00 42.46 39.74 3b8s s ILE 129 CO 0.26 0.57 0.00 -0.89 -1.91 0.00 0.00 174.94 172.97 3b8s s THR 130 N -0.44 3.98 -0.27 4.00 2.01 -0.37 -1.75 115.64 122.80 3b8s s THR 130 Ca 0.07 -0.31 0.03 0.00 0.31 0.00 0.00 61.69 61.78 3b8s s THR 130 Cb -0.12 -2.79 0.07 0.00 0.01 0.00 0.00 72.50 69.66 3b8s s THR 130 CO 0.02 0.43 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.68 3b8s s ILE 131 N 0.96 2.03 0.06 1.82 1.01 -0.32 -0.85 121.20 125.90 3b8s s ILE 131 Ca 0.01 -1.66 -0.30 0.00 0.00 0.00 0.00 60.65 58.70 3b8s s ILE 131 Cb -0.14 -2.23 -0.05 0.00 0.01 0.00 0.00 42.46 40.05 3b8s s ILE 131 CO 0.02 -0.15 1.09 0.00 0.00 0.00 0.00 174.94 175.90 3b8s s ALA 132 N 1.14 3.30 0.08 9.38 0.00 0.28 -0.41 121.76 135.52 3b8s s ALA 132 Ca -0.05 0.72 -0.00 0.00 0.00 0.00 0.00 51.96 52.63 3b8s s ALA 132 Cb -0.20 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.50 3b8s s ALA 132 CO -0.06 -0.31 -0.02 0.34 0.00 0.00 0.00 175.76 175.71 3b8s s ASP 133 N 0.84 0.59 0.00 0.00 2.15 -1.26 -0.63 116.67 118.36 3b8s s ASP 133 Ca 0.54 -1.04 0.15 0.00 0.43 0.00 0.00 52.55 52.63 3b8s s ASP 133 Cb -0.26 0.20 0.88 0.00 -0.30 0.00 0.00 42.92 43.44 3b8s s ASP 133 CO 0.29 -0.60 1.56 0.35 -0.17 0.00 0.00 175.17 176.61 3b8s n THR 134 N 0.04 0.00 0.73 1.71 -2.24 -1.26 -1.83 114.28 111.43 3b8s n THR 134 Ca -0.12 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.78 3b8s n THR 134 Cb 0.62 -0.24 0.27 0.00 -2.10 0.00 0.00 70.33 68.88 3b8s n THR 134 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3b8s n ASP 135 N -0.73 0.59 0.00 3.42 5.75 -1.26 -1.39 116.55 122.92 3b8s n ASP 135 Ca 0.11 0.13 0.00 0.00 -0.01 0.00 0.00 54.79 55.02 3b8s n ASP 135 Cb 0.05 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.13 3b8s n ASP 135 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3b8s n GLY 136 N 1.39 0.51 0.46 6.12 0.00 -0.76 -4.69 105.19 108.22 3b8s n GLY 136 Ca 0.04 -0.23 0.28 0.00 0.00 0.00 0.00 46.02 46.11 3b8s n GLY 136 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3b8s h SER 137 N 0.00 0.12 -0.04 1.61 4.64 -1.89 0.50 113.55 118.48 3b8s h SER 137 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 3b8s h SER 137 Cb 0.00 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3b8s h SER 137 CO 0.00 0.04 0.00 0.00 -0.87 0.00 0.00 176.83 176.00 3b8s n HIS 138 N -4.34 0.05 -4.52 4.77 1.44 -1.26 -4.29 115.22 107.07 3b8s n HIS 138 Ca 0.21 -0.02 -0.33 0.00 -2.01 0.00 0.00 57.72 55.56 3b8s n HIS 138 Cb 0.96 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.96 3b8s n HIS 138 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 3b8s s LEU 139 N -1.85 3.22 0.54 2.39 1.43 0.16 -4.68 118.68 119.89 3b8s s LEU 139 Ca 0.38 -0.06 -0.19 0.00 -1.03 0.00 0.00 54.13 53.23 3b8s s LEU 139 Cb 0.19 -1.77 -0.06 0.00 0.03 0.00 0.00 46.19 44.58 3b8s s LEU 139 CO 0.31 0.33 1.10 -0.54 0.23 0.00 0.00 176.35 177.78 3b8s s LYS 140 N -1.11 3.41 0.09 1.70 -0.14 -1.26 -4.90 119.74 117.53 3b8s s LYS 140 Ca 0.15 1.50 -0.36 0.00 -1.36 0.00 0.00 55.97 55.90 3b8s s LYS 140 Cb -0.11 -2.02 -0.17 0.00 -1.68 0.00 0.00 37.83 33.84 3b8s s LYS 140 CO 0.05 -0.78 1.16 -2.30 -0.76 0.00 0.00 175.35 172.72 3b8s n PRO 141 N -1.36 0.72 -1.79 -1.68 -0.02 -1.26 -4.76 135.00 124.84 3b8s n PRO 141 Ca 0.11 0.26 -0.41 0.00 -2.02 0.00 0.00 63.50 61.43 3b8s n PRO 141 Cb 0.52 -1.78 -0.01 0.00 -0.02 0.00 0.00 33.50 32.21 3b8s n PRO 141 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3b8s s LEU 142 N 0.55 4.33 -0.12 2.45 2.96 -0.68 -4.90 118.68 123.27 3b8s s LEU 142 Ca 0.82 3.00 -0.29 0.00 -0.22 0.00 0.00 54.13 57.44 3b8s s LEU 142 Cb -1.02 -3.65 -0.01 0.00 0.50 0.00 0.00 46.19 42.00 3b8s s LEU 142 CO 0.52 -0.90 1.00 -0.89 -1.32 0.00 0.00 176.35 174.76 3b8s s THR 143 N -0.57 4.78 0.28 3.68 2.01 -1.26 -4.93 115.64 119.63 3b8s s THR 143 Ca 0.58 2.02 -0.05 0.00 0.31 0.00 0.00 61.69 64.55 3b8s s THR 143 Cb -0.47 -4.30 -0.05 0.00 0.01 0.00 0.00 72.50 67.68 3b8s s THR 143 CO 0.56 -0.01 0.54 -0.04 -0.69 0.00 0.00 174.62 174.98 3b8s s MET 144 N 2.12 3.64 -0.41 4.92 1.00 -1.26 -4.83 119.30 124.48 3b8s s MET 144 Ca 0.47 0.02 0.05 0.00 0.00 0.00 0.00 55.69 56.24 3b8s s MET 144 Cb -0.18 -2.66 0.20 0.00 0.00 0.00 0.00 34.83 32.19 3b8s s MET 144 CO 0.17 0.23 0.42 -1.71 0.00 0.00 0.00 175.02 174.13 3b8s n ASN 145 N -0.83 -0.46 -4.79 3.03 5.15 0.65 -5.04 115.26 112.98 3b8s n ASN 145 Ca -0.02 -2.51 -0.36 0.00 -0.60 0.00 0.00 54.58 51.09 3b8s n ASN 145 Cb 0.54 -0.44 -0.07 0.00 -0.53 0.00 0.00 39.78 39.27 3b8s n ASN 145 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3b8s s VAL 146 N -0.29 5.14 -0.14 3.44 1.01 -1.25 -4.03 120.40 124.28 3b8s s VAL 146 Ca 0.33 0.08 -0.35 0.00 0.00 0.00 0.00 61.98 62.04 3b8s s VAL 146 Cb 0.08 -3.25 -0.12 0.00 0.00 0.00 0.00 36.38 33.10 3b8s s VAL 146 CO -0.17 0.57 1.90 -0.67 0.00 0.00 0.00 175.10 176.74 3b8s n ASP 147 N 2.41 3.21 0.09 3.32 -0.08 -1.26 -4.84 116.55 119.41 3b8s n ASP 147 Ca -0.19 0.92 0.06 0.00 -1.51 0.00 0.00 54.79 54.07 3b8s n ASP 147 Cb 0.54 -1.34 0.31 0.00 2.34 0.00 0.00 41.12 42.98 3b8s n ASP 147 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 3b8s n PRO 148 N 6.68 0.07 0.26 -0.67 -0.04 -1.26 -1.41 135.00 138.63 3b8s n PRO 148 Ca 0.25 0.56 0.10 0.00 -0.04 0.00 0.00 63.50 64.37 3b8s n PRO 148 Cb 0.27 -1.79 0.68 0.00 -0.04 0.00 0.00 33.50 32.62 3b8s n PRO 148 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 3b8s h ASN 149 N 0.00 0.00 -2.55 3.54 -1.24 -1.88 -3.40 115.58 110.05 3b8s h ASN 149 Ca 0.00 0.00 -0.56 0.00 0.71 0.00 0.00 56.30 56.45 3b8s h ASN 149 Cb 0.09 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.12 3b8s h ASN 149 CO 0.00 0.11 1.21 0.20 -1.29 0.00 0.00 177.43 177.66 3b8s s ASN 150 N -6.53 6.25 0.56 1.15 0.01 -0.50 -4.75 114.94 111.12 3b8s s ASN 150 Ca -0.04 1.91 -0.00 0.00 -0.71 0.00 0.00 52.86 54.02 3b8s s ASN 150 Cb 0.15 -2.53 0.03 0.00 0.41 0.00 0.00 41.25 39.31 3b8s s ASN 150 CO 0.62 -1.32 0.79 -0.54 -1.51 0.00 0.00 177.10 175.15 3b8s s LYS 151 N 4.88 2.59 -0.02 -0.60 1.02 -1.26 -5.02 119.74 121.33 3b8s s LYS 151 Ca 0.80 -0.64 -0.12 0.00 0.02 0.00 0.00 55.97 56.03 3b8s s LYS 151 Cb -0.30 -2.45 -0.05 0.00 -0.52 0.00 0.00 37.83 34.51 3b8s s LYS 151 CO 0.32 -0.71 0.35 -1.12 -0.92 0.00 0.00 175.35 173.27 3b8s s SER 152 N -4.40 6.70 0.27 2.83 0.01 -1.26 -4.94 113.70 112.92 3b8s s SER 152 Ca 0.56 0.83 0.02 0.00 1.31 0.00 0.00 55.95 58.67 3b8s s SER 152 Cb -0.10 -2.20 -0.05 0.00 0.21 0.00 0.00 66.02 63.88 3b8s s SER 152 CO 0.39 0.33 0.11 -0.31 0.41 0.00 0.00 173.24 174.17 3b8s s TYR 153 N -1.10 1.56 -0.34 2.43 1.51 -1.26 -5.07 117.35 115.08 3b8s s TYR 153 Ca 0.23 -1.23 0.10 0.00 -1.01 0.00 0.00 57.07 55.16 3b8s s TYR 153 Cb -0.15 -0.90 0.45 0.00 -0.11 0.00 0.00 41.96 41.25 3b8s s TYR 153 CO 0.12 -0.38 1.12 0.09 -1.11 0.00 0.00 175.55 175.39 3b8s n ASN 154 N -0.60 3.86 -4.74 2.29 3.02 -1.26 -5.09 115.26 112.73 3b8s n ASN 154 Ca 0.00 -3.33 -0.41 0.00 -0.03 0.00 0.00 54.58 50.81 3b8s n ASN 154 Cb 0.66 -0.43 -0.02 0.00 -0.61 0.00 0.00 39.78 39.38 3b8s n ASN 154 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3b8s s THR 155 N -4.58 2.71 -0.14 3.41 2.01 -1.26 -4.91 115.64 112.87 3b8s s THR 155 Ca 0.43 0.59 -0.38 0.00 0.31 0.00 0.00 61.69 62.64 3b8s s THR 155 Cb 0.40 -3.38 -0.15 0.00 0.01 0.00 0.00 72.50 69.38 3b8s s THR 155 CO -0.05 0.09 1.65 -0.67 -0.69 0.00 0.00 174.62 174.95 3b8s n ASP 156 N 2.34 2.35 0.24 3.53 -0.08 -1.26 -4.84 116.55 118.82 3b8s n ASP 156 Ca 0.07 1.07 0.16 0.00 -1.51 0.00 0.00 54.79 54.58 3b8s n ASP 156 Cb 0.40 -1.20 0.82 0.00 2.34 0.00 0.00 41.12 43.49 3b8s n ASP 156 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 3b8s h PRO 157 N 6.68 0.00 -0.00 -0.67 0.13 -2.04 -1.51 132.00 134.59 3b8s h PRO 157 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3b8s h PRO 157 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 3b8s h PRO 157 CO 0.91 0.00 -0.02 -1.13 -0.23 0.00 0.00 178.00 177.52 3b8s n SER 158 N -2.65 0.06 -4.67 1.44 3.41 -1.26 -4.77 113.62 105.17 3b8s n SER 158 Ca -0.01 -0.09 -0.40 0.00 -0.26 0.00 0.00 58.87 58.11 3b8s n SER 158 Cb 0.10 -0.28 -0.06 0.00 -0.26 0.00 0.00 64.21 63.71 3b8s n SER 158 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3b8s s ILE 159 N -2.64 5.04 -0.02 -1.33 1.01 -0.57 -4.97 121.20 117.71 3b8s s ILE 159 Ca 0.26 1.21 -0.30 0.00 0.00 0.00 0.00 60.65 61.82 3b8s s ILE 159 Cb 0.20 -3.95 -0.06 0.00 0.01 0.00 0.00 42.46 38.66 3b8s s ILE 159 CO 0.48 0.15 1.66 -0.69 0.00 0.00 0.00 174.94 176.54 3b8s s VAL 160 N 1.62 3.44 -0.40 2.92 1.01 -0.72 -4.86 120.40 123.41 3b8s s VAL 160 Ca 0.30 0.65 0.02 0.00 0.00 0.00 0.00 61.98 62.95 3b8s s VAL 160 Cb -0.16 -3.42 0.12 0.00 0.00 0.00 0.00 36.38 32.92 3b8s s VAL 160 CO 0.11 -0.04 0.17 -0.04 0.00 0.00 0.00 175.10 175.30 3b8s s MET 161 N 3.66 1.33 0.26 2.72 -1.94 -1.24 -0.26 119.30 123.82 3b8s s MET 161 Ca 0.74 -1.88 0.09 0.00 -1.71 0.00 0.00 55.69 52.93 3b8s s MET 161 Cb -0.35 -2.64 -0.04 0.00 2.01 0.00 0.00 34.83 33.81 3b8s s MET 161 CO 0.31 -1.06 0.07 0.20 -0.01 0.00 0.00 175.02 174.52 3b8s s GLY 162 N 0.65 1.57 0.14 -0.03 0.00 0.33 -0.33 107.32 109.64 3b8s s GLY 162 Ca 0.14 -1.57 -0.17 0.00 0.00 0.00 0.00 44.72 43.13 3b8s s GLY 162 CO -0.08 -1.62 0.43 -1.08 0.00 0.00 0.00 173.10 170.75 3b8s s THR 163 N -2.25 0.06 -0.20 0.90 -1.32 -0.81 -1.20 115.64 110.81 3b8s s THR 163 Ca 0.32 -0.58 -0.10 0.00 -1.21 0.00 0.00 61.69 60.13 3b8s s THR 163 Cb -0.07 -1.22 -0.05 0.00 -1.51 0.00 0.00 72.50 69.65 3b8s s THR 163 CO 0.22 -0.27 0.13 -0.31 -2.21 0.00 0.00 174.62 172.18 3b8s s TYR 164 N -3.81 3.38 -0.20 9.09 1.51 -0.74 -0.53 117.35 126.04 3b8s s TYR 164 Ca 0.04 0.28 -0.05 0.00 -1.01 0.00 0.00 57.07 56.33 3b8s s TYR 164 Cb 0.01 -2.17 -0.03 0.00 -0.11 0.00 0.00 41.96 39.67 3b8s s TYR 164 CO -0.11 0.24 0.01 0.12 -1.11 0.00 0.00 175.55 174.70 3b8s s PHE 165 N 0.47 3.06 -0.10 2.71 2.19 0.28 -2.17 117.98 124.43 3b8s s PHE 165 Ca 0.07 -0.41 -0.10 0.00 0.33 0.00 0.00 56.93 56.82 3b8s s PHE 165 Cb -0.12 -2.10 -0.05 0.00 -1.31 0.00 0.00 43.02 39.45 3b8s s PHE 165 CO -0.01 -0.22 0.23 0.14 1.83 0.00 0.00 175.22 177.19 3b8s s VAL 166 N 1.00 5.35 0.27 3.12 -7.23 -1.26 -1.20 120.40 120.45 3b8s s VAL 166 Ca 0.02 0.41 -0.01 0.00 -1.81 0.00 0.00 61.98 60.60 3b8s s VAL 166 Cb -0.14 -3.52 0.27 0.00 0.56 0.00 0.00 36.38 33.55 3b8s s VAL 166 CO 0.02 0.56 1.85 -0.08 -0.31 0.00 0.00 175.10 177.14 3b8s h GLU 167 N 5.28 1.00 -0.01 4.82 4.81 -1.15 -2.10 114.58 127.24 3b8s h GLU 167 Ca -0.51 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.66 3b8s h GLU 167 Cb 1.21 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 30.37 3b8s h GLU 167 CO 0.63 0.66 0.00 -2.67 -0.73 0.00 0.00 179.01 176.90 3b8s n TRP 168 N -4.60 0.00 0.52 0.92 2.14 -1.26 -3.96 117.44 111.20 3b8s n TRP 168 Ca 0.17 -0.00 0.09 0.00 2.07 0.00 0.00 57.50 59.83 3b8s n TRP 168 Cb 0.29 0.00 0.37 0.00 -0.81 0.00 0.00 31.31 31.16 3b8s n TRP 168 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 3b8s n GLY 169 N 1.03 -1.11 0.00 -1.67 0.00 -0.79 -2.75 105.19 99.91 3b8s n GLY 169 Ca 0.22 -0.03 0.14 0.00 0.00 0.00 0.00 46.02 46.36 3b8s n GLY 169 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3b8s n ILE 170 N -1.66 0.00 0.00 -0.61 -5.35 -1.23 -0.34 119.36 110.17 3b8s n ILE 170 Ca 0.04 -0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.51 3b8s n ILE 170 Cb 0.20 -0.43 0.00 0.00 -1.74 0.00 0.00 39.64 37.67 3b8s n ILE 170 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 3b8s n TYR 171 N -1.44 0.00 -0.26 4.28 4.01 -1.11 -4.21 117.16 118.42 3b8s n TYR 171 Ca 0.08 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.90 3b8s n TYR 171 Cb 0.32 0.00 0.21 0.00 -0.31 0.00 0.00 39.34 39.56 3b8s n TYR 171 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 3b8s h GLY 172 N 0.00 1.14 2.00 2.72 0.00 -1.84 0.82 103.07 107.91 3b8s h GLY 172 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.26 3b8s h GLY 172 CO 0.00 -0.20 0.00 3.21 0.00 0.00 0.00 176.54 179.55 3b8s h ARG 173 N 0.31 0.00 -6.24 4.80 3.08 -1.85 -3.46 114.38 111.03 3b8s h ARG 173 Ca 0.45 0.00 -0.48 0.00 0.07 0.00 0.00 59.98 60.02 3b8s h ARG 173 Cb 0.77 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.71 3b8s h ARG 173 CO -0.51 0.00 -0.73 -3.47 -1.07 0.00 0.00 179.97 174.19 3b8s n ASP 174 N -2.90 -4.04 -4.21 7.04 2.03 0.28 -4.93 116.55 109.81 3b8s n ASP 174 Ca -0.01 -0.76 -0.35 0.00 0.52 0.00 0.00 54.79 54.19 3b8s n ASP 174 Cb 0.19 -3.28 -0.14 0.00 -0.72 0.00 0.00 41.12 37.18 3b8s n ASP 174 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 3b8s s TYR 175 N -3.20 3.12 0.36 -0.67 5.04 0.53 -4.96 117.35 117.58 3b8s s TYR 175 Ca 0.63 -1.54 0.08 0.00 -2.44 0.00 0.00 57.07 53.80 3b8s s TYR 175 Cb -0.33 -2.10 -0.04 0.00 0.35 0.00 0.00 41.96 39.84 3b8s s TYR 175 CO 0.78 -0.72 0.21 0.95 -1.34 0.00 0.00 175.55 175.42 3b8s s THR 176 N 1.33 2.91 0.27 4.34 -4.23 -1.26 -3.49 115.64 115.52 3b8s s THR 176 Ca -0.01 -1.59 0.00 0.00 -1.18 0.00 0.00 61.69 58.91 3b8s s THR 176 Cb -0.17 -3.01 0.25 0.00 1.34 0.00 0.00 72.50 70.91 3b8s s THR 176 CO -0.03 -0.12 1.74 0.58 -0.54 0.00 0.00 174.62 176.25 3b8s h VAL 177 N 1.40 0.65 0.00 2.29 2.07 -1.96 0.88 116.25 121.58 3b8s h VAL 177 Ca -0.43 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 66.90 3b8s h VAL 177 Cb 1.25 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 3b8s h VAL 177 CO 0.63 0.10 0.00 -0.90 0.02 0.00 0.00 177.57 177.42 3b8s n ASP 178 N -4.93 0.00 0.16 0.57 5.75 -1.26 -2.05 116.55 114.80 3b8s n ASP 178 Ca 0.18 0.36 0.12 0.00 -0.01 0.00 0.00 54.79 55.44 3b8s n ASP 178 Cb 0.50 -0.42 0.15 0.00 -1.03 0.00 0.00 41.12 40.31 3b8s n ASP 178 CO 0.00 0.00 0.00 0.78 -0.11 0.00 0.00 177.20 177.87 3b8s h ASN 179 N 0.00 0.00 -3.04 -1.12 2.35 -0.95 0.19 115.58 113.00 3b8s h ASN 179 Ca 0.00 -0.02 -0.53 0.00 -0.55 0.00 0.00 56.30 55.21 3b8s h ASN 179 Cb 0.17 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.57 3b8s h ASN 179 CO 0.00 0.01 0.74 -0.04 -1.65 0.00 0.00 177.43 176.49 3b8s s MET 180 N -3.24 4.31 -0.87 0.81 -1.94 -0.87 -4.48 119.30 113.03 3b8s s MET 180 Ca 0.05 2.13 -0.21 0.00 -1.71 0.00 0.00 55.69 55.95 3b8s s MET 180 Cb 0.08 -3.22 -0.13 0.00 2.01 0.00 0.00 34.83 33.57 3b8s s MET 180 CO 0.70 -0.44 1.97 -0.35 -0.01 0.00 0.00 175.02 176.88 3b8s n PRO 181 N 3.70 1.69 -0.13 2.03 -0.04 -1.26 -4.77 135.00 136.22 3b8s n PRO 181 Ca 0.11 -1.96 0.10 0.00 -0.04 0.00 0.00 63.50 61.71 3b8s n PRO 181 Cb 0.42 -2.98 0.44 0.00 -0.04 0.00 0.00 33.50 31.34 3b8s n PRO 181 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 3b8s h VAL 182 N 4.45 0.94 0.00 0.52 3.04 -1.93 -0.22 116.25 123.04 3b8s h VAL 182 Ca 0.44 -0.19 -0.02 0.00 -1.01 0.00 0.00 66.70 65.92 3b8s h VAL 182 Cb 0.67 0.34 -0.00 0.00 -2.01 0.00 0.00 31.29 30.29 3b8s h VAL 182 CO 1.94 0.10 -0.08 0.44 -1.01 0.00 0.00 177.57 178.96 3b8s h ASP 183 N 0.55 0.00 -0.55 3.17 3.32 -2.00 -2.33 116.42 118.58 3b8s h ASP 183 Ca 0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.35 3b8s h ASP 183 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 3b8s h ASP 183 CO -0.09 0.08 0.00 0.59 -1.72 0.00 0.00 179.24 178.09 3b8s n ASN 184 N -3.44 3.56 -4.10 6.45 3.02 -0.09 -4.92 115.26 115.74 3b8s n ASN 184 Ca -0.02 -2.20 -0.23 0.00 -0.03 0.00 0.00 54.58 52.11 3b8s n ASN 184 Cb 0.22 -0.46 -0.15 0.00 -0.61 0.00 0.00 39.78 38.78 3b8s n ASN 184 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3b8s s LEU 185 N -1.32 1.96 -0.15 3.41 1.43 -0.88 -4.89 118.68 118.24 3b8s s LEU 185 Ca 0.40 -0.27 0.13 0.00 -1.03 0.00 0.00 54.13 53.36 3b8s s LEU 185 Cb 0.24 -0.77 -0.24 0.00 0.03 0.00 0.00 46.19 45.46 3b8s s LEU 185 CO 0.23 0.15 0.25 0.35 0.23 0.00 0.00 176.35 177.56 3b8s n THR 186 N 2.92 1.50 -4.11 5.49 -2.24 0.55 -4.90 114.28 113.49 3b8s n THR 186 Ca -0.16 -0.79 -0.21 0.00 -2.27 0.00 0.00 64.05 60.62 3b8s n THR 186 Cb 0.54 -0.84 -0.16 0.00 -2.10 0.00 0.00 70.33 67.77 3b8s n THR 186 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3b8s s HIS 187 N -2.53 0.76 -0.23 4.78 3.76 -1.13 -1.67 115.29 119.02 3b8s s HIS 187 Ca -0.12 -0.22 -0.02 0.00 -0.15 0.00 0.00 55.06 54.55 3b8s s HIS 187 Cb 0.07 -0.70 0.01 0.00 1.11 0.00 0.00 32.58 33.07 3b8s s HIS 187 CO 0.80 -0.22 -0.07 0.42 -0.85 0.00 0.00 174.74 174.82 3b8s s ILE 188 N 1.07 2.99 -0.24 0.60 1.01 0.46 -1.93 121.20 125.15 3b8s s ILE 188 Ca -0.09 -0.79 -0.13 0.00 0.00 0.00 0.00 60.65 59.65 3b8s s ILE 188 Cb -0.14 -2.42 -0.05 0.00 0.01 0.00 0.00 42.46 39.86 3b8s s ILE 188 CO -0.01 0.33 0.26 -0.76 0.00 0.00 0.00 174.94 174.77 3b8s s LEU 189 N 1.39 4.10 -0.41 2.97 1.43 0.31 -1.02 118.68 127.45 3b8s s LEU 189 Ca 0.03 0.23 -0.16 0.00 -1.03 0.00 0.00 54.13 53.20 3b8s s LEU 189 Cb -0.15 -2.26 0.02 0.00 0.03 0.00 0.00 46.19 43.82 3b8s s LEU 189 CO -0.05 -0.03 0.35 -0.47 0.23 0.00 0.00 176.35 176.39 3b8s s TYR 190 N 1.38 3.21 -0.14 0.29 5.04 -0.22 -0.56 117.35 126.35 3b8s s TYR 190 Ca 0.12 -0.49 -0.06 0.00 -2.44 0.00 0.00 57.07 54.20 3b8s s TYR 190 Cb -0.15 -2.71 -0.04 0.00 0.35 0.00 0.00 41.96 39.42 3b8s s TYR 190 CO 0.07 -0.62 0.08 0.20 -1.34 0.00 0.00 175.55 173.94 3b8s s GLY 191 N 1.73 2.00 0.05 8.97 0.00 -0.34 -0.80 107.32 118.93 3b8s s GLY 191 Ca 0.08 -0.71 0.02 0.00 0.00 0.00 0.00 44.72 44.10 3b8s s GLY 191 CO 0.11 -0.24 -0.07 -1.36 0.00 0.00 0.00 173.10 171.55 3b8s s PHE 192 N -0.43 0.62 -0.31 1.90 0.08 -1.26 -0.46 117.98 118.12 3b8s s PHE 192 Ca 0.10 -0.57 -0.17 0.00 0.12 0.00 0.00 56.93 56.41 3b8s s PHE 192 Cb -0.12 -0.38 -0.02 0.00 -0.57 0.00 0.00 43.02 41.93 3b8s s PHE 192 CO 0.02 -0.12 0.49 0.42 -0.10 0.00 0.00 175.22 175.93 3b8s s ILE 193 N -1.73 5.06 0.67 0.64 -1.09 0.13 -4.68 121.20 120.20 3b8s s ILE 193 Ca -0.08 0.55 -0.11 0.00 -2.23 0.00 0.00 60.65 58.78 3b8s s ILE 193 Cb -0.08 -3.87 -0.01 0.00 -1.58 0.00 0.00 42.46 36.92 3b8s s ILE 193 CO -0.01 -0.05 1.05 -2.16 -1.23 0.00 0.00 174.94 172.54 3b8s s PRO 194 N 2.30 3.19 -0.13 2.79 0.04 -1.25 -2.06 135.00 139.88 3b8s s PRO 194 Ca 0.19 0.82 0.01 0.00 0.04 0.00 0.00 61.00 62.05 3b8s s PRO 194 Cb -0.16 -2.03 -0.01 0.00 0.04 0.00 0.00 34.50 32.35 3b8s s PRO 194 CO 0.11 -0.88 -0.16 0.42 0.04 0.00 0.00 177.00 176.53 3b8s s ILE 195 N -3.13 2.73 0.43 0.56 1.01 -1.26 -2.79 121.20 118.75 3b8s s ILE 195 Ca 0.57 -0.77 -0.26 0.00 0.00 0.00 0.00 60.65 60.19 3b8s s ILE 195 Cb -0.12 -2.13 -0.08 0.00 0.01 0.00 0.00 42.46 40.13 3b8s s ILE 195 CO 0.54 0.53 1.34 0.00 0.00 0.00 0.00 174.94 177.36 3b8s n GLY 197 N 0.63 0.52 3.69 0.00 0.00 -1.26 0.70 105.19 109.47 3b8s n GLY 197 Ca 0.04 -1.54 -0.42 0.00 0.00 0.00 0.00 46.02 44.10 3b8s n GLY 197 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3b8s s PRO 198 N -1.63 4.26 -0.24 1.61 0.04 -1.26 -4.89 135.00 132.89 3b8s s PRO 198 Ca 0.00 2.06 0.18 0.00 0.04 0.00 0.00 61.00 63.28 3b8s s PRO 198 Cb 0.00 -3.58 0.42 0.00 0.04 0.00 0.00 34.50 31.38 3b8s s PRO 198 CO 0.00 -0.62 1.26 0.09 0.04 0.00 0.00 177.00 177.77 3b8s n ASN 199 N 5.45 0.22 -0.12 6.66 3.02 -1.26 -3.12 115.26 126.11 3b8s n ASN 199 Ca 0.14 -2.09 0.20 0.00 -0.03 0.00 0.00 54.58 52.80 3b8s n ASN 199 Cb 0.43 0.01 0.60 0.00 -0.61 0.00 0.00 39.78 40.22 3b8s n ASN 199 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 3b8s h GLU 200 N 1.64 0.20 0.00 3.52 4.39 -1.91 -1.64 114.58 120.78 3b8s h GLU 200 Ca -0.30 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.38 3b8s h GLU 200 Cb 1.36 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.97 3b8s h GLU 200 CO 0.00 0.13 -0.06 0.77 -1.16 0.00 0.00 179.01 178.70 3b8s h SER 201 N 0.21 0.00 0.10 1.42 0.02 -1.92 -2.18 113.55 111.20 3b8s h SER 201 Ca 0.35 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.29 3b8s h SER 201 Cb 1.08 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.62 3b8s h SER 201 CO -0.07 0.06 -0.06 0.58 -1.14 0.00 0.00 176.83 176.20 3b8s h VAL 202 N 0.00 0.74 0.00 2.27 2.07 -1.27 -1.76 116.25 118.30 3b8s h VAL 202 Ca -0.00 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 3b8s h VAL 202 Cb 0.15 1.13 -0.00 0.00 -1.52 0.00 0.00 31.29 31.04 3b8s h VAL 202 CO 0.01 0.06 -0.02 0.11 0.02 0.00 0.00 177.57 177.74 3b8s h LYS 203 N 0.00 0.00 0.00 1.57 1.57 -1.56 -1.77 116.57 116.38 3b8s h LYS 203 Ca -0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 3b8s h LYS 203 Cb 0.12 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 3b8s h LYS 203 CO 0.01 0.02 -0.11 0.66 -0.57 0.00 0.00 179.45 179.46 3b8s h SER 204 N 0.00 0.00 0.01 0.86 4.64 -1.49 -2.60 113.55 114.96 3b8s h SER 204 Ca -0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 3b8s h SER 204 Cb 0.27 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.36 3b8s h SER 204 CO 0.00 0.11 -0.30 0.58 -0.87 0.00 0.00 176.83 176.36 3b8s h VAL 205 N 0.00 1.62 0.00 0.95 2.07 -1.49 -3.50 116.25 115.89 3b8s h VAL 205 Ca -0.00 -2.34 0.00 0.00 0.82 0.00 0.00 66.70 65.18 3b8s h VAL 205 Cb 0.52 3.18 0.00 0.00 -1.52 0.00 0.00 31.29 33.47 3b8s h VAL 205 CO 0.01 0.57 0.00 0.61 0.02 0.00 0.00 177.57 178.79 3b8s n GLY 206 N 1.59 1.69 0.30 2.17 0.00 -0.98 -4.94 105.19 105.02 3b8s n GLY 206 Ca -0.14 -1.02 -0.10 0.00 0.00 0.00 0.00 46.02 44.77 3b8s n GLY 206 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3b8s h GLY 207 N 0.00 1.13 0.61 -0.02 0.00 -1.87 -2.29 103.07 100.63 3b8s h GLY 207 Ca 0.00 -0.86 0.06 0.00 0.00 0.00 0.00 47.33 46.53 3b8s h GLY 207 CO 0.00 0.79 0.25 3.43 0.00 0.00 0.00 176.54 181.00 3b8s h ASN 208 N 0.94 0.32 -0.54 0.19 2.35 -1.96 0.22 115.58 117.10 3b8s h ASN 208 Ca 0.16 0.05 -0.08 0.00 -0.55 0.00 0.00 56.30 55.88 3b8s h ASN 208 Cb 0.59 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.94 3b8s h ASN 208 CO 0.04 0.21 0.03 -1.28 -1.65 0.00 0.00 177.43 174.78 3b8s h SER 209 N 0.47 0.90 -0.32 5.81 0.87 -1.87 -0.63 113.55 118.79 3b8s h SER 209 Ca 0.25 -0.29 -0.03 0.00 -1.23 0.00 0.00 61.79 60.50 3b8s h SER 209 Cb 0.22 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 3b8s h SER 209 CO -0.21 0.97 0.10 0.15 -0.53 0.00 0.00 176.83 177.31 3b8s h PHE 210 N 0.81 0.51 -0.68 2.24 3.04 -1.04 -2.41 116.94 119.40 3b8s h PHE 210 Ca 0.16 -0.05 -0.02 0.00 3.98 0.00 0.00 57.97 62.04 3b8s h PHE 210 Cb 0.49 -0.15 -0.03 0.00 2.56 0.00 0.00 35.95 38.82 3b8s h PHE 210 CO 0.04 0.52 0.35 -0.91 -2.02 0.00 0.00 178.31 176.28 3b8s h ASN 211 N 0.35 0.85 -0.73 0.41 2.35 -0.48 -0.61 115.58 117.72 3b8s h ASN 211 Ca 0.10 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 3b8s h ASN 211 Cb 0.25 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 38.36 3b8s h ASN 211 CO -0.00 0.70 0.46 0.00 -1.65 0.00 0.00 177.43 176.94 3b8s h ALA 212 N 1.43 0.92 -0.39 -0.83 0.00 -0.97 -1.19 119.26 118.23 3b8s h ALA 212 Ca 0.24 -0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.94 3b8s h ALA 212 Cb 0.06 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3b8s h ALA 212 CO -0.04 0.37 -0.31 1.25 0.00 0.00 0.00 179.25 180.52 3b8s h LEU 213 N 0.99 0.96 -0.79 0.00 5.85 -0.91 -1.15 115.31 120.25 3b8s h LEU 213 Ca 0.26 -0.45 -0.02 0.00 0.84 0.00 0.00 57.88 58.52 3b8s h LEU 213 Cb -0.07 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.66 3b8s h LEU 213 CO -0.05 1.20 0.41 1.56 -0.34 0.00 0.00 178.44 181.22 3b8s h GLN 214 N 0.72 1.12 -0.41 1.25 1.08 -0.95 -1.46 115.11 116.46 3b8s h GLN 214 Ca 0.07 -0.15 -0.02 0.00 -1.45 0.00 0.00 58.65 57.11 3b8s h GLN 214 Cb 0.90 -0.21 -0.02 0.00 -0.05 0.00 0.00 27.48 28.10 3b8s h GLN 214 CO 0.08 0.85 0.20 1.15 -0.95 0.00 0.00 178.83 180.16 3b8s h THR 215 N 1.11 1.18 0.00 -0.54 2.02 -1.11 -2.84 112.91 112.73 3b8s h THR 215 Ca 0.28 -0.50 -0.03 0.00 0.77 0.00 0.00 66.41 66.93 3b8s h THR 215 Cb 0.07 0.75 -0.00 0.00 -1.74 0.00 0.00 68.15 67.22 3b8s h THR 215 CO -0.04 0.19 -0.14 0.00 0.37 0.00 0.00 175.52 175.90 3b8s h ALA 216 N 1.05 1.72 -0.10 6.16 0.00 -0.84 -2.82 119.26 124.43 3b8s h ALA 216 Ca 0.14 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3b8s h ALA 216 Cb 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3b8s h ALA 216 CO -0.02 0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.41 3b8s s ARG 218 N -1.89 4.30 -0.91 0.00 0.52 -1.08 -2.04 118.95 117.84 3b8s s ARG 218 Ca 0.34 2.11 0.00 0.00 -0.52 0.00 0.00 55.73 57.66 3b8s s ARG 218 Cb 0.20 -3.29 0.00 0.00 0.52 0.00 0.00 34.95 32.38 3b8s s ARG 218 CO 0.31 -0.49 0.00 0.41 0.02 0.00 0.00 175.30 175.55 3b8s n GLY 219 N 3.57 1.04 3.19 -3.53 0.00 -1.26 -4.25 105.19 103.95 3b8s n GLY 219 Ca 0.12 -0.58 -0.30 0.00 0.00 0.00 0.00 46.02 45.26 3b8s n GLY 219 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3b8s s VAL 220 N -2.29 1.81 0.46 1.61 1.01 -0.87 -4.82 120.40 117.31 3b8s s VAL 220 Ca 0.00 -0.90 -0.25 0.00 0.00 0.00 0.00 61.98 60.83 3b8s s VAL 220 Cb 0.00 -1.56 -0.08 0.00 0.00 0.00 0.00 36.38 34.74 3b8s s VAL 220 CO 0.00 0.51 1.35 0.20 0.00 0.00 0.00 175.10 177.16 3b8s s ASN 221 N 0.16 5.92 0.57 3.32 0.01 -1.26 -4.97 114.94 118.69 3b8s s ASN 221 Ca -0.11 2.75 -0.20 0.00 -0.71 0.00 0.00 52.86 54.59 3b8s s ASN 221 Cb -0.15 -2.64 -0.05 0.00 0.41 0.00 0.00 41.25 38.82 3b8s s ASN 221 CO 0.05 -1.13 1.21 0.47 -1.51 0.00 0.00 177.10 176.19 3b8s n ASP 222 N -0.28 1.91 0.00 -1.22 8.00 -1.26 -2.77 116.55 120.93 3b8s n ASP 222 Ca 0.06 0.91 0.00 0.00 0.71 0.00 0.00 54.79 56.46 3b8s n ASP 222 Cb 0.44 -1.50 0.00 0.00 -0.02 0.00 0.00 41.12 40.03 3b8s n ASP 222 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3b8s n TYR 223 N -1.35 0.00 -3.81 1.24 4.02 0.22 -4.89 117.16 112.59 3b8s n TYR 223 Ca 0.12 0.00 -0.31 0.00 -0.01 0.00 0.00 57.90 57.70 3b8s n TYR 223 Cb 0.45 -0.39 -0.04 0.00 -0.02 0.00 0.00 39.34 39.34 3b8s n TYR 223 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 3b8s s GLU 224 N -0.37 3.51 0.44 -0.72 2.02 -1.11 -2.94 118.70 119.53 3b8s s GLU 224 Ca 0.00 -0.30 -0.21 0.00 0.02 0.00 0.00 54.97 54.49 3b8s s GLU 224 Cb 0.00 -2.95 -0.11 0.00 0.10 0.00 0.00 34.13 31.17 3b8s s GLU 224 CO 0.00 0.54 0.95 0.14 0.02 0.00 0.00 175.26 176.92 3b8s s VAL 225 N -1.59 4.41 0.26 2.63 -7.23 -1.26 -1.12 120.40 116.49 3b8s s VAL 225 Ca 0.38 1.46 -0.03 0.00 -1.81 0.00 0.00 61.98 61.98 3b8s s VAL 225 Cb -0.13 -3.61 -0.02 0.00 0.56 0.00 0.00 36.38 33.18 3b8s s VAL 225 CO 0.27 -0.36 0.31 0.68 -0.31 0.00 0.00 175.10 175.68 3b8s s VAL 226 N -2.23 0.00 -0.16 1.32 -7.23 -1.12 -4.92 120.40 106.07 3b8s s VAL 226 Ca 0.62 -1.77 -0.18 0.00 -1.81 0.00 0.00 61.98 58.83 3b8s s VAL 226 Cb -0.09 -2.46 -0.04 0.00 0.56 0.00 0.00 36.38 34.35 3b8s s VAL 226 CO 0.15 0.00 0.49 -0.63 -0.31 0.00 0.00 175.10 174.80 3b8s s ILE 227 N -3.79 5.15 -0.01 -0.62 1.01 -1.26 -3.81 121.20 117.87 3b8s s ILE 227 Ca 0.33 0.95 -0.26 0.00 0.00 0.00 0.00 60.65 61.68 3b8s s ILE 227 Cb 0.03 -3.83 -0.20 0.00 0.01 0.00 0.00 42.46 38.48 3b8s s ILE 227 CO 0.15 0.26 1.32 -0.74 0.00 0.00 0.00 174.94 175.93 3b8s h HIS 228 N 7.06 0.01 -3.03 3.97 2.76 -1.94 -3.41 115.15 120.57 3b8s h HIS 228 Ca -0.38 -0.00 -0.62 0.00 -2.20 0.00 0.00 60.37 57.17 3b8s h HIS 228 Cb 1.17 -0.00 -0.40 0.00 1.55 0.00 0.00 27.41 29.72 3b8s h HIS 228 CO 0.66 0.44 -0.71 0.34 -1.30 0.00 0.00 177.93 177.36 3b8s s ASP 229 N -5.64 3.80 0.50 3.26 -1.08 -1.26 -4.59 116.67 111.65 3b8s s ASP 229 Ca -0.16 -2.99 0.23 0.00 -0.52 0.00 0.00 52.55 49.11 3b8s s ASP 229 Cb 0.02 -1.22 1.32 0.00 -1.46 0.00 0.00 42.92 41.58 3b8s s ASP 229 CO 0.67 -0.21 2.06 1.55 0.52 0.00 0.00 175.17 179.76 3b8s h PRO 230 N 6.31 0.00 0.17 4.34 0.13 -1.98 -0.50 132.00 140.47 3b8s h PRO 230 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 3b8s h PRO 230 Cb 0.88 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.00 3b8s h PRO 230 CO 0.56 0.13 -0.14 2.35 -0.23 0.00 0.00 178.00 180.67 3b8s h TRP 231 N 0.00 -0.37 -0.51 1.56 2.91 -1.95 -0.51 115.95 117.08 3b8s h TRP 231 Ca -0.00 0.00 -0.10 0.00 1.13 0.00 0.00 58.89 59.92 3b8s h TRP 231 Cb 0.30 0.14 -0.02 0.00 -0.51 0.00 0.00 29.16 29.07 3b8s h TRP 231 CO 0.00 -0.22 -0.07 0.00 -1.03 0.00 0.00 178.44 177.13 3b8s h ALA 232 N 0.48 0.69 -0.03 2.65 0.00 -1.86 0.60 119.26 121.80 3b8s h ALA 232 Ca -0.00 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 3b8s h ALA 232 Cb 0.30 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 3b8s h ALA 232 CO -0.02 0.56 -0.00 0.00 0.00 0.00 0.00 179.25 179.79 3b8s h ALA 233 N 0.92 0.04 0.00 0.00 0.00 -0.94 0.81 119.26 120.09 3b8s h ALA 233 Ca 0.14 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3b8s h ALA 233 Cb 0.61 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.39 3b8s h ALA 233 CO 0.04 -0.29 0.00 2.48 0.00 0.00 0.00 179.25 181.48 3b8s n TYR 234 N -4.90 0.00 -0.13 0.00 0.18 -0.25 0.01 117.16 112.07 3b8s n TYR 234 Ca -0.07 0.00 -0.22 0.00 1.88 0.00 0.00 57.90 59.49 3b8s n TYR 234 Cb 0.19 0.02 -0.11 0.00 -0.38 0.00 0.00 39.34 39.06 3b8s n TYR 234 CO 0.00 0.00 0.00 1.04 -2.08 0.00 0.00 176.86 175.82 3b8s n GLN 235 N 0.00 0.61 -1.75 -3.48 6.02 -0.88 -1.28 117.38 116.62 3b8s n GLN 235 Ca 0.00 0.18 -0.42 0.00 -0.01 0.00 0.00 57.00 56.75 3b8s n GLN 235 Cb 0.29 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 30.03 3b8s n GLN 235 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 3b8s s LYS 236 N -2.50 4.13 -0.35 -1.09 2.20 0.18 -4.53 119.74 117.77 3b8s s LYS 236 Ca -0.35 2.58 -0.28 0.00 -0.36 0.00 0.00 55.97 57.56 3b8s s LYS 236 Cb 0.11 -3.07 0.02 0.00 -1.51 0.00 0.00 37.83 33.37 3b8s s LYS 236 CO 0.55 -0.73 1.01 -1.12 -0.36 0.00 0.00 175.35 174.70 3b8s s SER 237 N 1.09 6.80 -0.39 1.43 0.01 -1.26 -0.32 113.70 121.05 3b8s s SER 237 Ca 0.73 0.81 -0.14 0.00 1.31 0.00 0.00 55.95 58.65 3b8s s SER 237 Cb -0.49 -2.51 0.01 0.00 0.21 0.00 0.00 66.02 63.24 3b8s s SER 237 CO 0.34 -0.89 0.29 -0.36 0.41 0.00 0.00 173.24 173.03 3b8s s PHE 238 N 3.62 3.24 0.42 2.43 0.40 -1.26 -4.98 117.98 121.84 3b8s s PHE 238 Ca 0.42 -0.48 0.08 0.00 -0.60 0.00 0.00 56.93 56.36 3b8s s PHE 238 Cb -0.12 -2.57 0.90 0.00 0.51 0.00 0.00 43.02 41.75 3b8s s PHE 238 CO 0.18 -0.53 2.06 -1.00 0.70 0.00 0.00 175.22 176.63 3b8s h PRO 239 N 8.59 0.50 0.00 0.24 0.13 -1.96 -1.22 132.00 138.28 3b8s h PRO 239 Ca -0.28 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 3b8s h PRO 239 Cb 1.13 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.15 3b8s h PRO 239 CO 0.70 0.33 0.00 -0.56 -0.23 0.00 0.00 178.00 178.24 3b8s h GLN 240 N 0.51 0.00 -0.01 0.86 -0.00 -1.96 -0.26 115.11 114.25 3b8s h GLN 240 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.81 3b8s h GLN 240 Cb 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.49 3b8s h GLN 240 CO -0.04 0.00 -0.35 0.00 -0.00 0.00 0.00 178.83 178.44 3b8s n ALA 241 N -2.08 3.29 -1.97 0.06 0.00 -0.49 -4.65 120.51 114.67 3b8s n ALA 241 Ca -0.01 -0.58 -0.08 0.00 0.00 0.00 0.00 53.44 52.78 3b8s n ALA 241 Cb 0.19 -0.90 -0.01 0.00 0.00 0.00 0.00 19.45 18.73 3b8s n ALA 241 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3b8s n GLY 242 N 1.38 0.23 3.75 0.00 0.00 -0.11 -5.00 105.19 105.44 3b8s n GLY 242 Ca 0.11 -0.60 -0.41 0.00 0.00 0.00 0.00 46.02 45.12 3b8s n GLY 242 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3b8s s HIS 243 N -2.36 3.16 0.32 1.61 3.76 -1.06 -5.02 115.29 115.70 3b8s s HIS 243 Ca 0.00 1.27 0.05 0.00 -0.15 0.00 0.00 55.06 56.23 3b8s s HIS 243 Cb 0.00 -3.66 -0.06 0.00 1.11 0.00 0.00 32.58 29.97 3b8s s HIS 243 CO 0.00 -1.97 0.02 -1.21 -0.85 0.00 0.00 174.74 170.74 3b8s s GLU 244 N -0.79 1.64 0.33 1.40 2.02 -1.26 -4.71 118.70 117.33 3b8s s GLU 244 Ca 0.54 -1.89 0.09 0.00 0.02 0.00 0.00 54.97 53.73 3b8s s GLU 244 Cb -0.38 -1.00 0.83 0.00 0.10 0.00 0.00 34.13 33.68 3b8s s GLU 244 CO 0.44 -0.12 1.79 -0.92 0.02 0.00 0.00 175.26 176.48 3b8s h TYR 245 N 2.14 0.95 -0.00 1.61 3.20 -2.02 -1.74 116.97 121.11 3b8s h TYR 245 Ca -0.41 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.49 3b8s h TYR 245 Cb 1.24 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 39.22 3b8s h TYR 245 CO 0.62 0.21 -0.32 -1.13 -1.64 0.00 0.00 178.16 175.90 3b8s n SER 246 N -4.70 0.45 -4.68 -2.11 3.41 -1.26 -4.90 113.62 99.83 3b8s n SER 246 Ca 0.23 -0.20 -0.46 0.00 -0.26 0.00 0.00 58.87 58.18 3b8s n SER 246 Cb 0.61 0.04 -0.04 0.00 -0.26 0.00 0.00 64.21 64.56 3b8s n SER 246 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3b8s n THR 247 N -1.34 0.61 0.21 6.66 -1.04 -0.66 -4.87 114.28 113.85 3b8s n THR 247 Ca 0.08 -0.11 0.07 0.00 -2.04 0.00 0.00 64.05 62.05 3b8s n THR 247 Cb 0.33 -2.01 0.42 0.00 -1.82 0.00 0.00 70.33 67.26 3b8s n THR 247 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 3b8s h PRO 248 N 9.50 0.00 -4.36 -2.82 0.13 -1.90 -3.41 132.00 129.14 3b8s h PRO 248 Ca -0.49 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.14 3b8s h PRO 248 Cb 1.26 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 32.05 3b8s h PRO 248 CO 0.94 0.31 -0.80 0.42 -0.23 0.00 0.00 178.00 178.64 3b8s s ILE 249 N -3.80 0.99 0.00 -3.56 1.01 -1.26 -4.55 121.20 110.03 3b8s s ILE 249 Ca -0.01 -0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.28 3b8s s ILE 249 Cb 0.12 -0.95 0.00 0.00 0.01 0.00 0.00 42.46 41.64 3b8s s ILE 249 CO 0.67 0.33 0.00 0.29 0.00 0.00 0.00 174.94 176.23 3b8s n LYS 250 N 4.16 2.38 0.00 2.79 5.02 -0.40 -4.73 118.16 127.37 3b8s n LYS 250 Ca -0.20 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.09 3b8s n LYS 250 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.52 3b8s n LYS 250 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3b8s n GLY 251 N 2.98 0.31 0.33 0.72 0.00 0.56 -2.10 105.19 108.00 3b8s n GLY 251 Ca 0.00 -0.94 -0.03 0.00 0.00 0.00 0.00 46.02 45.05 3b8s n GLY 251 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3b8s h ASN 252 N 0.00 0.92 -0.19 1.61 2.35 -0.33 -3.02 115.58 116.92 3b8s h ASN 252 Ca 0.00 -0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.61 3b8s h ASN 252 Cb 0.00 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.12 3b8s h ASN 252 CO 0.00 0.82 0.08 1.88 -1.65 0.00 0.00 177.43 178.56 3b8s h TYR 253 N 0.98 0.28 -0.61 1.19 -1.99 -0.53 0.54 116.97 116.83 3b8s h TYR 253 Ca 0.23 -0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.94 3b8s h TYR 253 Cb 0.19 -0.08 -0.03 0.00 2.00 0.00 0.00 36.73 38.81 3b8s h TYR 253 CO 0.02 0.31 0.37 0.00 -0.00 0.00 0.00 178.16 178.85 3b8s h ALA 254 N 0.94 1.50 -0.24 3.88 0.00 -1.44 -1.22 119.26 122.69 3b8s h ALA 254 Ca 0.06 -0.07 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 3b8s h ALA 254 Cb 0.14 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3b8s h ALA 254 CO -0.01 0.43 -0.48 0.52 0.00 0.00 0.00 179.25 179.72 3b8s h MET 255 N 0.84 0.63 -0.47 0.00 2.86 -1.30 -1.97 114.93 115.52 3b8s h MET 255 Ca 0.22 -0.36 -0.10 0.00 -2.06 0.00 0.00 59.70 57.40 3b8s h MET 255 Cb -0.04 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 3b8s h MET 255 CO -0.04 0.97 -0.11 -0.07 1.06 0.00 0.00 176.91 178.72 3b8s h LEU 256 N 0.50 0.85 -0.34 1.22 3.38 -0.59 0.62 115.31 120.95 3b8s h LEU 256 Ca 0.03 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 57.76 3b8s h LEU 256 Cb 1.02 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 3b8s h LEU 256 CO 0.10 0.98 0.16 0.24 0.09 0.00 0.00 178.44 180.01 3b8s h MET 257 N 0.77 0.33 -0.12 1.13 2.86 -1.07 -0.75 114.93 118.09 3b8s h MET 257 Ca 0.13 -0.02 -0.09 0.00 -2.06 0.00 0.00 59.70 57.65 3b8s h MET 257 Cb 0.62 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 3b8s h MET 257 CO 0.04 0.22 -0.34 0.00 1.06 0.00 0.00 176.91 177.89 3b8s h ALA 258 N 1.18 1.21 -0.70 6.32 0.00 -1.18 -2.72 119.26 123.37 3b8s h ALA 258 Ca 0.14 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 3b8s h ALA 258 Cb 0.06 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3b8s h ALA 258 CO -0.10 0.53 0.31 1.25 0.00 0.00 0.00 179.25 181.25 3b8s h LEU 259 N 0.20 0.93 -1.81 0.00 5.85 -0.51 -1.72 115.31 118.26 3b8s h LEU 259 Ca 0.03 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 3b8s h LEU 259 Cb 0.71 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.49 3b8s h LEU 259 CO 0.05 0.82 -0.03 0.11 -0.34 0.00 0.00 178.44 179.06 3b8s h LYS 260 N 0.98 0.08 -0.10 1.25 1.79 -0.84 0.01 116.57 119.74 3b8s h LYS 260 Ca 0.24 -0.01 -0.16 0.00 -2.18 0.00 0.00 60.65 58.54 3b8s h LYS 260 Cb 0.15 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.78 3b8s h LYS 260 CO -0.03 0.12 -0.61 1.96 -1.08 0.00 0.00 179.45 179.81 3b8s h GLN 261 N 0.09 0.36 -0.09 3.15 1.08 -1.25 -2.07 115.11 116.38 3b8s h GLN 261 Ca 0.02 -0.25 -0.23 0.00 -1.45 0.00 0.00 58.65 56.74 3b8s h GLN 261 Cb 0.11 0.04 0.01 0.00 -0.05 0.00 0.00 27.48 27.59 3b8s h GLN 261 CO 0.00 0.86 -0.86 -0.09 -0.95 0.00 0.00 178.83 177.80 3b8s h ARG 262 N 0.27 0.74 -2.83 1.46 2.43 -1.03 -3.40 114.38 112.01 3b8s h ARG 262 Ca -0.01 -0.68 -0.61 0.00 -0.81 0.00 0.00 59.98 57.88 3b8s h ARG 262 Cb 1.14 0.16 -0.41 0.00 -0.42 0.00 0.00 29.97 30.45 3b8s h ARG 262 CO 0.10 1.27 -0.71 -0.80 -1.51 0.00 0.00 179.97 178.32 3b8s s ASN 263 N -7.15 3.64 0.49 -3.80 -0.87 -0.07 -4.99 114.94 102.20 3b8s s ASN 263 Ca -0.10 -3.59 0.33 0.00 -1.57 0.00 0.00 52.86 47.93 3b8s s ASN 263 Cb 0.08 -1.22 1.58 0.00 -0.02 0.00 0.00 41.25 41.67 3b8s s ASN 263 CO 0.91 -0.11 2.00 1.55 -2.57 0.00 0.00 177.10 178.87 3b8s h PRO 264 N 5.47 0.00 0.00 -0.60 0.13 -1.59 -1.90 132.00 133.51 3b8s h PRO 264 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 3b8s h PRO 264 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 3b8s h PRO 264 CO 0.60 0.00 -0.28 -0.25 -0.23 0.00 0.00 178.00 177.84 3b8s n ASP 265 N -2.79 0.50 -4.77 1.44 8.00 -1.26 -4.90 116.55 112.77 3b8s n ASP 265 Ca -0.00 0.25 -0.41 0.00 0.71 0.00 0.00 54.79 55.34 3b8s n ASP 265 Cb 0.18 -0.23 -0.01 0.00 -0.02 0.00 0.00 41.12 41.04 3b8s n ASP 265 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3b8s s LEU 266 N -3.71 4.34 -0.25 0.64 2.96 -0.72 -5.01 118.68 116.94 3b8s s LEU 266 Ca 0.10 2.97 -0.09 0.00 -0.22 0.00 0.00 54.13 56.89 3b8s s LEU 266 Cb 0.15 -3.66 -0.04 0.00 0.50 0.00 0.00 46.19 43.15 3b8s s LEU 266 CO 0.64 -0.83 0.12 -0.54 -1.32 0.00 0.00 176.35 174.41 3b8s s LYS 267 N -1.64 3.85 -0.20 1.98 -0.14 -0.67 -5.03 119.74 117.89 3b8s s LYS 267 Ca 0.55 -0.38 -0.03 0.00 -1.36 0.00 0.00 55.97 54.75 3b8s s LYS 267 Cb -0.46 -3.44 -0.01 0.00 -1.68 0.00 0.00 37.83 32.25 3b8s s LYS 267 CO 0.58 -0.07 -0.07 0.42 -0.76 0.00 0.00 175.35 175.45 3b8s s ILE 268 N 1.37 3.24 -0.08 2.17 1.01 -1.26 -0.41 121.20 127.24 3b8s s ILE 268 Ca 0.06 -0.55 0.02 0.00 0.00 0.00 0.00 60.65 60.18 3b8s s ILE 268 Cb -0.15 -2.45 0.01 0.00 0.01 0.00 0.00 42.46 39.89 3b8s s ILE 268 CO 0.06 0.45 -0.13 -0.63 0.00 0.00 0.00 174.94 174.68 3b8s s ILE 269 N 1.28 1.25 0.14 2.92 1.01 -0.19 0.74 121.20 128.35 3b8s s ILE 269 Ca 0.03 -0.53 -0.30 0.00 0.00 0.00 0.00 60.65 59.85 3b8s s ILE 269 Cb -0.14 -1.14 -0.07 0.00 0.01 0.00 0.00 42.46 41.12 3b8s s ILE 269 CO -0.03 0.38 1.11 -2.16 0.00 0.00 0.00 174.94 174.25 3b8s s PRO 270 N 0.74 4.56 -0.30 2.79 0.04 -1.26 -1.06 135.00 140.52 3b8s s PRO 270 Ca -0.13 1.71 -0.11 0.00 0.04 0.00 0.00 61.00 62.50 3b8s s PRO 270 Cb -0.16 -3.30 -0.04 0.00 0.04 0.00 0.00 34.50 31.04 3b8s s PRO 270 CO 0.03 0.00 0.20 0.45 0.04 0.00 0.00 177.00 177.73 3b8s s SER 271 N 0.19 6.00 -0.25 6.66 0.15 0.02 -1.57 113.70 124.91 3b8s s SER 271 Ca 0.51 -0.16 -0.11 0.00 0.70 0.00 0.00 55.95 56.89 3b8s s SER 271 Cb -0.29 -2.12 -0.05 0.00 -1.71 0.00 0.00 66.02 61.86 3b8s s SER 271 CO 0.33 -0.11 0.20 -0.63 1.20 0.00 0.00 173.24 174.23 3b8s s ILE 272 N 1.74 5.32 0.00 6.45 1.01 0.43 0.20 121.20 136.35 3b8s s ILE 272 Ca 0.07 0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.97 3b8s s ILE 272 Cb -0.16 -3.54 0.00 0.00 0.01 0.00 0.00 42.46 38.77 3b8s s ILE 272 CO 0.11 0.31 0.00 0.61 0.00 0.00 0.00 174.94 175.96 3b8s n GLY 273 N 4.43 0.82 0.19 6.18 0.00 -0.88 -0.12 105.19 115.82 3b8s n GLY 273 Ca -0.14 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.56 3b8s n GLY 273 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b8s n GLY 274 N 0.00 -3.68 0.20 -0.02 0.00 0.13 -4.21 105.19 97.61 3b8s n GLY 274 Ca 0.00 -2.00 -0.02 0.00 0.00 0.00 0.00 46.02 44.00 3b8s n GLY 274 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 3b8s h TRP 275 N 0.00 -0.17 -0.00 1.61 2.91 -1.91 -2.89 115.95 115.50 3b8s h TRP 275 Ca 0.00 0.04 0.00 0.00 1.13 0.00 0.00 58.89 60.06 3b8s h TRP 275 Cb 0.00 0.15 0.00 0.00 -0.51 0.00 0.00 29.16 28.80 3b8s h TRP 275 CO 0.00 -0.18 -0.67 0.25 -1.03 0.00 0.00 178.44 176.81 3b8s n THR 276 N -5.31 0.00 -1.05 2.65 -2.24 -1.26 -4.13 114.28 102.94 3b8s n THR 276 Ca 0.05 -0.05 0.09 0.00 -2.27 0.00 0.00 64.05 61.87 3b8s n THR 276 Cb 0.28 0.69 0.21 0.00 -2.10 0.00 0.00 70.33 69.41 3b8s n THR 276 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3b8s n LEU 277 N -1.21 3.27 0.03 3.22 4.77 -1.11 -3.24 117.00 122.73 3b8s n LEU 277 Ca 0.06 -3.08 0.12 0.00 -0.03 0.00 0.00 56.01 53.07 3b8s n LEU 277 Cb 0.35 -0.50 0.13 0.00 -2.33 0.00 0.00 43.42 41.07 3b8s n LEU 277 CO 0.36 0.72 0.24 -1.20 -1.33 0.00 0.00 177.39 176.17 3b8s n SER 278 N -0.91 0.63 -0.23 -1.43 7.64 -1.12 -4.37 113.62 113.82 3b8s n SER 278 Ca 0.20 -0.11 0.04 0.00 1.01 0.00 0.00 58.87 60.00 3b8s n SER 278 Cb 0.80 0.43 0.15 0.00 -1.01 0.00 0.00 64.21 64.58 3b8s n SER 278 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 3b8s h ASP 279 N 0.00 -0.02 0.28 6.43 5.19 -1.83 -0.83 116.42 125.64 3b8s h ASP 279 Ca 0.00 0.14 -0.01 0.00 -0.62 0.00 0.00 57.03 56.54 3b8s h ASP 279 Cb 0.68 0.19 -0.00 0.00 0.18 0.00 0.00 39.33 40.38 3b8s h ASP 279 CO 0.00 -0.03 -0.03 -0.65 -3.12 0.00 0.00 179.24 175.41 3b8s h PRO 280 N 0.25 0.00 -0.13 3.56 0.11 -1.78 -2.79 132.00 131.22 3b8s h PRO 280 Ca 0.38 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.50 3b8s h PRO 280 Cb 0.62 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.72 3b8s h PRO 280 CO -0.48 0.03 0.09 0.74 -0.21 0.00 0.00 178.00 178.17 3b8s h PHE 281 N 0.00 0.12 0.00 0.65 0.04 -1.46 -1.87 116.94 114.42 3b8s h PHE 281 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3b8s h PHE 281 Cb 0.18 -0.04 0.00 0.00 2.20 0.00 0.00 35.95 38.29 3b8s h PHE 281 CO 0.00 0.07 0.00 1.88 -0.60 0.00 0.00 178.31 179.66 3b8s h TYR 282 N 0.13 0.00 -0.17 -0.55 -1.99 -1.63 -1.68 116.97 111.08 3b8s h TYR 282 Ca 0.05 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.78 3b8s h TYR 282 Cb 0.05 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.78 3b8s h TYR 282 CO -0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 178.16 177.91 3b8s n ASP 283 N -2.88 1.46 -0.03 3.88 8.00 -0.70 -4.01 116.55 122.27 3b8s n ASP 283 Ca -0.00 -1.73 0.16 0.00 0.71 0.00 0.00 54.79 53.93 3b8s n ASP 283 Cb 0.22 -0.11 0.90 0.00 -0.02 0.00 0.00 41.12 42.11 3b8s n ASP 283 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3b8s n PHE 284 N 0.21 0.00 0.26 1.24 3.01 -0.63 -2.97 117.46 118.57 3b8s n PHE 284 Ca 0.15 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.72 3b8s n PHE 284 Cb 0.28 -0.03 0.69 0.00 -0.01 0.00 0.00 39.48 40.42 3b8s n PHE 284 CO 0.00 0.00 0.00 -0.39 1.01 0.00 0.00 176.76 177.38 3b8s h VAL 285 N 0.17 0.65 -3.58 -4.37 -1.51 -1.79 -3.38 116.25 102.43 3b8s h VAL 285 Ca 0.00 -0.56 -0.64 0.00 -1.23 0.00 0.00 66.70 64.27 3b8s h VAL 285 Cb 0.06 1.35 -0.14 0.00 -2.13 0.00 0.00 31.29 30.44 3b8s h VAL 285 CO 0.00 0.13 0.17 -0.62 -1.23 0.00 0.00 177.57 176.02 3b8s s ASP 286 N -6.28 6.39 0.44 4.19 -1.08 -1.16 -4.96 116.67 114.22 3b8s s ASP 286 Ca -0.03 -0.06 0.20 0.00 -0.52 0.00 0.00 52.55 52.13 3b8s s ASP 286 Cb 0.13 -2.33 1.15 0.00 -1.46 0.00 0.00 42.92 40.41 3b8s s ASP 286 CO 0.60 -0.71 1.88 0.50 0.52 0.00 0.00 175.17 177.96 3b8s h LYS 287 N 8.69 0.32 -0.99 4.34 3.64 -1.88 -0.68 116.57 130.01 3b8s h LYS 287 Ca -0.26 -0.02 0.17 0.00 -1.27 0.00 0.00 60.65 59.27 3b8s h LYS 287 Cb 1.10 -0.07 -0.10 0.00 -0.41 0.00 0.00 32.23 32.75 3b8s h LYS 287 CO 0.88 0.21 0.62 0.87 -2.27 0.00 0.00 179.45 179.75 3b8s h LYS 288 N 0.33 0.77 -0.12 1.90 1.57 -1.93 0.29 116.57 119.38 3b8s h LYS 288 Ca 0.43 -0.05 -0.21 0.00 -1.87 0.00 0.00 60.65 58.96 3b8s h LYS 288 Cb 1.18 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.32 3b8s h LYS 288 CO -0.13 0.51 -0.76 -0.91 -0.57 0.00 0.00 179.45 177.59 3b8s h ASN 289 N 0.80 0.74 -0.72 0.86 2.35 -1.40 -2.43 115.58 115.77 3b8s h ASN 289 Ca 0.54 -0.48 -0.03 0.00 -0.55 0.00 0.00 56.30 55.78 3b8s h ASN 289 Cb 0.81 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.93 3b8s h ASN 289 CO -0.33 1.26 0.33 0.03 -1.65 0.00 0.00 177.43 177.07 3b8s h ARG 290 N 0.42 1.05 -0.28 0.81 3.08 -1.19 -1.40 114.38 116.88 3b8s h ARG 290 Ca -0.04 -0.16 0.03 0.00 0.07 0.00 0.00 59.98 59.87 3b8s h ARG 290 Cb 1.36 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 31.19 3b8s h ARG 290 CO 0.14 0.84 0.08 -0.44 -1.07 0.00 0.00 179.97 179.53 3b8s h ASP 291 N 1.02 0.08 -0.32 7.04 3.32 -0.40 0.57 116.42 127.74 3b8s h ASP 291 Ca 0.25 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.33 3b8s h ASP 291 Cb 0.14 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 3b8s h ASP 291 CO -0.03 0.08 0.21 0.74 -1.72 0.00 0.00 179.24 178.52 3b8s h THR 292 N 0.20 1.09 0.27 0.35 2.02 -1.29 -2.03 112.91 113.51 3b8s h THR 292 Ca 0.13 -0.17 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 3b8s h THR 292 Cb 0.11 0.63 0.00 0.00 -1.74 0.00 0.00 68.15 67.15 3b8s h THR 292 CO -0.14 0.08 -0.13 0.15 0.37 0.00 0.00 175.52 175.85 3b8s h PHE 293 N 0.43 -0.33 -0.76 3.16 3.57 -0.99 -2.15 116.94 119.86 3b8s h PHE 293 Ca 0.12 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.63 3b8s h PHE 293 Cb -0.04 0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.77 3b8s h PHE 293 CO -0.05 -0.17 0.49 0.28 -2.23 0.00 0.00 178.31 176.63 3b8s h VAL 294 N -0.41 1.15 -0.88 1.41 2.07 -0.84 -0.74 116.25 118.00 3b8s h VAL 294 Ca -0.04 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.12 3b8s h VAL 294 Cb 0.31 0.08 -0.04 0.00 -1.52 0.00 0.00 31.29 30.12 3b8s h VAL 294 CO 0.06 0.18 0.45 0.00 0.02 0.00 0.00 177.57 178.28 3b8s h ALA 295 N 1.31 1.13 -0.18 1.67 0.00 -1.35 -1.91 119.26 119.93 3b8s h ALA 295 Ca 0.30 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 3b8s h ALA 295 Cb -0.04 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 3b8s h ALA 295 CO -0.09 0.67 -0.39 0.66 0.00 0.00 0.00 179.25 180.10 3b8s h SER 296 N 1.24 0.43 -0.56 0.00 4.64 -0.67 -2.40 113.55 116.23 3b8s h SER 296 Ca 0.30 -0.18 -0.10 0.00 -0.47 0.00 0.00 61.79 61.34 3b8s h SER 296 Cb 0.08 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.03 3b8s h SER 296 CO -0.04 0.78 -0.05 0.58 -0.87 0.00 0.00 176.83 177.23 3b8s h VAL 297 N 0.34 1.27 -0.49 0.95 2.07 -0.92 0.66 116.25 120.14 3b8s h VAL 297 Ca 0.03 -1.19 0.03 0.00 0.82 0.00 0.00 66.70 66.39 3b8s h VAL 297 Cb 0.84 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 31.48 3b8s h VAL 297 CO 0.07 0.43 0.28 0.50 0.02 0.00 0.00 177.57 178.87 3b8s h LYS 298 N 0.91 0.55 -0.63 1.57 3.64 -1.22 -0.52 116.57 120.87 3b8s h LYS 298 Ca 0.15 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.46 3b8s h LYS 298 Cb 0.61 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.27 3b8s h LYS 298 CO 0.04 0.36 0.23 -0.22 -2.27 0.00 0.00 179.45 177.59 3b8s h LYS 299 N 0.57 0.95 -0.63 1.90 3.64 -1.21 -2.05 116.57 119.73 3b8s h LYS 299 Ca 0.20 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 3b8s h LYS 299 Cb 0.04 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.68 3b8s h LYS 299 CO -0.10 0.82 0.41 0.35 -2.27 0.00 0.00 179.45 178.66 3b8s h PHE 300 N 0.88 0.80 -0.02 1.91 3.04 -0.55 -0.08 116.94 122.93 3b8s h PHE 300 Ca 0.21 0.02 -0.11 0.00 3.98 0.00 0.00 57.97 62.07 3b8s h PHE 300 Cb 0.24 -0.27 -0.01 0.00 2.56 0.00 0.00 35.95 38.46 3b8s h PHE 300 CO 0.01 0.51 -0.48 -0.07 -2.02 0.00 0.00 178.31 176.27 3b8s h LEU 301 N 0.86 0.05 -0.26 0.59 3.38 -0.92 0.61 115.31 119.62 3b8s h LEU 301 Ca 0.23 -0.02 -0.21 0.00 0.09 0.00 0.00 57.88 57.97 3b8s h LEU 301 Cb -0.09 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3b8s h LEU 301 CO -0.05 0.53 -0.89 0.11 0.09 0.00 0.00 178.44 178.23 3b8s h LYS 302 N 0.04 0.29 -0.15 1.13 1.57 -1.08 -3.31 116.57 115.06 3b8s h LYS 302 Ca -0.00 -0.31 -0.12 0.00 -1.87 0.00 0.00 60.65 58.35 3b8s h LYS 302 Cb 0.87 0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.26 3b8s h LYS 302 CO 0.06 1.01 -0.36 1.15 -0.57 0.00 0.00 179.45 180.74 3b8s h THR 303 N 0.17 1.36 -3.47 -0.16 2.02 -0.76 -3.39 112.91 108.68 3b8s h THR 303 Ca -0.06 -1.63 -0.70 0.00 0.77 0.00 0.00 66.41 64.79 3b8s h THR 303 Cb 1.51 2.01 -0.35 0.00 -1.74 0.00 0.00 68.15 69.58 3b8s h THR 303 CO 0.14 0.49 -0.27 0.26 0.37 0.00 0.00 175.52 176.52 3b8s s TRP 304 N -3.95 3.58 -0.64 3.16 0.52 0.18 -4.66 118.94 117.13 3b8s s TRP 304 Ca -0.13 -2.82 0.24 0.00 0.02 0.00 0.00 56.10 53.41 3b8s s TRP 304 Cb 0.06 -3.21 0.91 0.00 -1.15 0.00 0.00 33.47 30.08 3b8s s TRP 304 CO 0.81 -0.80 1.73 1.63 0.02 0.00 0.00 176.95 180.34 3b8s n LYS 305 N 3.05 0.19 0.25 4.98 5.02 -1.19 -2.73 118.16 127.73 3b8s n LYS 305 Ca 0.13 0.31 0.13 0.00 -2.02 0.00 0.00 58.31 56.87 3b8s n LYS 305 Cb 0.38 -1.80 0.59 0.00 -0.02 0.00 0.00 35.03 34.18 3b8s n LYS 305 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3b8s h PHE 306 N 0.00 0.00 -3.84 2.13 -0.00 -1.51 -3.43 116.94 110.29 3b8s h PHE 306 Ca 0.00 0.00 -0.51 0.00 -0.00 0.00 0.00 57.97 57.46 3b8s h PHE 306 Cb 0.49 0.00 0.04 0.00 -0.00 0.00 0.00 35.95 36.48 3b8s h PHE 306 CO 0.00 0.13 0.54 0.71 -0.00 0.00 0.00 178.31 179.69 3b8s s TYR 307 N -3.76 3.37 -0.36 6.09 4.12 -1.10 -4.55 117.35 121.16 3b8s s TYR 307 Ca 0.00 1.59 0.15 0.00 0.02 0.00 0.00 57.07 58.83 3b8s s TYR 307 Cb 0.10 -3.44 0.47 0.00 -1.52 0.00 0.00 41.96 37.58 3b8s s TYR 307 CO 0.59 -1.07 1.38 -0.25 0.02 0.00 0.00 175.55 176.23 3b8s n ASP 308 N 1.03 3.64 0.00 2.29 8.00 0.23 -4.98 116.55 126.76 3b8s n ASP 308 Ca -0.01 -2.77 0.00 0.00 0.71 0.00 0.00 54.79 52.72 3b8s n ASP 308 Cb 0.44 -0.47 0.00 0.00 -0.02 0.00 0.00 41.12 41.07 3b8s n ASP 308 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3b8s n GLY 309 N -0.27 0.00 2.99 0.44 0.00 -1.26 -1.39 105.19 105.70 3b8s n GLY 309 Ca 0.19 -1.15 -0.13 0.00 0.00 0.00 0.00 46.02 44.93 3b8s n GLY 309 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3b8s s VAL 310 N -3.85 -0.02 -0.18 1.61 0.11 -0.53 -4.22 120.40 113.34 3b8s s VAL 310 Ca 0.00 0.06 -0.02 0.00 -2.93 0.00 0.00 61.98 59.09 3b8s s VAL 310 Cb 0.00 -0.23 -0.01 0.00 -1.53 0.00 0.00 36.38 34.61 3b8s s VAL 310 CO 0.00 0.03 -0.09 -0.62 -3.33 0.00 0.00 175.10 171.09 3b8s s ASP 311 N 0.47 4.15 -0.32 3.54 2.15 -0.61 -0.98 116.67 125.07 3b8s s ASP 311 Ca -0.03 -0.36 -0.10 0.00 0.43 0.00 0.00 52.55 52.48 3b8s s ASP 311 Cb -0.05 -1.67 -0.01 0.00 -0.30 0.00 0.00 42.92 40.89 3b8s s ASP 311 CO -0.02 0.07 0.18 -0.63 -0.17 0.00 0.00 175.17 174.60 3b8s s ILE 312 N 0.91 4.78 -0.78 4.11 -1.09 -0.44 -0.43 121.20 128.27 3b8s s ILE 312 Ca -0.02 -0.37 0.03 0.00 -2.23 0.00 0.00 60.65 58.05 3b8s s ILE 312 Cb -0.15 -3.45 0.25 0.00 -1.58 0.00 0.00 42.46 37.54 3b8s s ILE 312 CO 0.00 0.04 0.90 0.47 -1.23 0.00 0.00 174.94 175.12 3b8s n ASP 313 N 5.01 4.36 -4.58 3.58 9.92 0.83 -2.47 116.55 133.19 3b8s n ASP 313 Ca -0.13 -3.38 -0.42 0.00 -0.53 0.00 0.00 54.79 50.32 3b8s n ASP 313 Cb 0.49 -0.86 -0.05 0.00 -0.64 0.00 0.00 41.12 40.06 3b8s n ASP 313 CO 0.00 0.00 0.00 0.86 0.13 0.00 0.00 177.20 178.19 3b8s s TRP 314 N -2.33 3.11 -0.47 1.24 -0.11 -1.26 0.22 118.94 119.33 3b8s s TRP 314 Ca 0.35 0.54 0.02 0.00 1.22 0.00 0.00 56.10 58.23 3b8s s TRP 314 Cb 0.08 -3.39 0.12 0.00 -1.50 0.00 0.00 33.47 28.78 3b8s s TRP 314 CO -0.01 -0.73 0.22 -1.21 -4.62 0.00 0.00 176.95 170.60 3b8s s GLU 315 N 3.09 1.93 -0.01 5.86 2.02 -1.26 -4.23 118.70 126.10 3b8s s GLU 315 Ca 0.31 -2.32 -0.09 0.00 0.02 0.00 0.00 54.97 52.90 3b8s s GLU 315 Cb -0.13 -3.38 0.01 0.00 0.10 0.00 0.00 34.13 30.72 3b8s s GLU 315 CO 0.17 -1.07 0.17 -0.06 0.02 0.00 0.00 175.26 174.50 3b8s s PHE 316 N 0.23 -0.02 0.14 1.61 0.08 -1.26 -4.16 117.98 114.60 3b8s s PHE 316 Ca 0.14 -0.01 -0.34 0.00 0.12 0.00 0.00 56.93 56.85 3b8s s PHE 316 Cb -0.23 -0.01 -0.14 0.00 -0.57 0.00 0.00 43.02 42.07 3b8s s PHE 316 CO -0.03 -0.29 1.59 -2.30 -0.10 0.00 0.00 175.22 174.09 3b8s n PRO 317 N 1.53 2.12 0.00 0.24 -0.02 -1.26 -0.53 135.00 137.09 3b8s n PRO 317 Ca -0.22 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 3b8s n PRO 317 Cb 0.56 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 3b8s n PRO 317 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3b8s n GLY 318 N 3.46 1.59 0.00 -1.23 0.00 -1.26 -4.83 105.19 102.93 3b8s n GLY 318 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3b8s n GLY 318 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b8s n GLY 319 N -2.00 -2.79 0.14 -0.02 0.00 0.31 -4.13 105.19 96.71 3b8s n GLY 319 Ca 0.00 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 43.93 3b8s n GLY 319 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b8s n GLY 320 N -0.01 0.96 0.00 -0.02 0.00 -1.26 -4.32 105.19 100.55 3b8s n GLY 320 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 3b8s n GLY 320 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b8s n GLY 321 N -2.07 1.64 0.22 -0.02 0.00 -1.26 -4.83 105.19 98.87 3b8s n GLY 321 Ca 0.00 -1.96 -0.04 0.00 0.00 0.00 0.00 46.02 44.02 3b8s n GLY 321 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3b8s h ALA 322 N -1.12 0.71 -1.62 4.61 0.00 -1.77 -3.36 119.26 116.71 3b8s h ALA 322 Ca 0.00 0.01 -0.57 0.00 0.00 0.00 0.00 54.91 54.35 3b8s h ALA 322 Cb 0.00 -0.11 -0.09 0.00 0.00 0.00 0.00 17.79 17.59 3b8s h ALA 322 CO 0.00 -0.02 0.86 0.00 0.00 0.00 0.00 179.25 180.09 3b8s s ALA 323 N -6.13 3.02 0.51 0.00 0.00 -1.26 -4.90 121.76 113.00 3b8s s ALA 323 Ca -0.13 -1.03 0.27 0.00 0.00 0.00 0.00 51.96 51.07 3b8s s ALA 323 Cb 0.14 -3.98 1.59 0.00 0.00 0.00 0.00 23.12 20.87 3b8s s ALA 323 CO 0.74 -2.66 2.16 0.00 0.00 0.00 0.00 175.76 176.00 3b8s h ALA 324 N 9.54 1.47 0.00 0.00 0.00 -1.98 -2.92 119.26 125.36 3b8s h ALA 324 Ca -0.26 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3b8s h ALA 324 Cb 1.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3b8s h ALA 324 CO 1.17 0.07 -0.80 0.38 0.00 0.00 0.00 179.25 180.07 3b8s h ASP 325 N 0.00 0.00 -3.65 0.00 2.03 -1.93 -3.46 116.42 109.41 3b8s h ASP 325 Ca -0.00 -0.06 -0.50 0.00 -0.73 0.00 0.00 57.03 55.74 3b8s h ASP 325 Cb 0.15 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.65 3b8s h ASP 325 CO 0.01 0.03 0.09 -0.54 -1.03 0.00 0.00 179.24 177.80 3b8s s LYS 326 N -3.29 3.77 0.00 4.15 1.02 -1.11 -5.03 119.74 119.26 3b8s s LYS 326 Ca 0.02 0.43 0.00 0.00 0.02 0.00 0.00 55.97 56.45 3b8s s LYS 326 Cb 0.10 -2.42 0.00 0.00 -0.52 0.00 0.00 37.83 35.00 3b8s s LYS 326 CO 0.76 -0.01 0.00 0.41 -0.92 0.00 0.00 175.35 175.59 3b8s n GLY 327 N -1.23 4.09 2.90 -3.33 0.00 -1.26 -4.20 105.19 102.15 3b8s n GLY 327 Ca 0.02 -0.90 -0.30 0.00 0.00 0.00 0.00 46.02 44.83 3b8s n GLY 327 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3b8s s ASP 328 N 0.00 4.40 0.65 1.61 -1.08 -1.26 -4.76 116.67 116.23 3b8s s ASP 328 Ca 0.00 -2.13 0.42 0.00 -0.52 0.00 0.00 52.55 50.32 3b8s s ASP 328 Cb 0.00 -1.35 2.28 0.00 -1.46 0.00 0.00 42.92 42.39 3b8s s ASP 328 CO 0.00 -0.37 2.33 -0.65 0.52 0.00 0.00 175.17 177.01 3b8s h PRO 329 N 7.56 0.00 0.06 4.34 0.11 -1.94 -0.89 132.00 141.24 3b8s h PRO 329 Ca -0.07 0.00 -0.27 0.00 0.11 0.00 0.00 66.00 65.77 3b8s h PRO 329 Cb 1.00 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 3b8s h PRO 329 CO 0.52 0.00 -1.44 0.28 -0.21 0.00 0.00 178.00 177.15 3b8s h VAL 330 N 0.00 0.90 0.00 3.15 2.07 -1.94 -3.43 116.25 117.00 3b8s h VAL 330 Ca -0.00 -2.28 0.00 0.00 0.82 0.00 0.00 66.70 65.24 3b8s h VAL 330 Cb 0.04 2.46 0.00 0.00 -1.52 0.00 0.00 31.29 32.27 3b8s h VAL 330 CO 0.00 0.57 -1.64 0.59 0.02 0.00 0.00 177.57 177.11 3b8s n ASN 331 N -4.07 0.97 -0.16 0.57 3.02 -1.11 -4.52 115.26 109.95 3b8s n ASN 331 Ca -0.29 -0.14 -0.10 0.00 -0.03 0.00 0.00 54.58 54.01 3b8s n ASN 331 Cb 0.82 1.67 -0.00 0.00 -0.61 0.00 0.00 39.78 41.66 3b8s n ASN 331 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 3b8s h ASP 332 N 0.00 0.87 0.43 6.41 3.32 -1.43 -2.06 116.42 123.95 3b8s h ASP 332 Ca 0.00 -0.34 -0.02 0.00 0.02 0.00 0.00 57.03 56.69 3b8s h ASP 332 Cb 0.74 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.05 3b8s h ASP 332 CO 0.00 1.00 -0.25 1.23 -1.72 0.00 0.00 179.24 179.50 3b8s h GLY 333 N 0.71 -0.67 0.61 2.75 0.00 -1.78 0.35 103.07 105.04 3b8s h GLY 333 Ca 0.12 0.27 0.11 0.00 0.00 0.00 0.00 47.33 47.84 3b8s h GLY 333 CO 0.04 -0.25 0.59 -2.55 0.00 0.00 0.00 176.54 174.36 3b8s h PRO 334 N -0.64 0.84 -0.59 4.80 0.11 -1.80 -0.92 132.00 133.81 3b8s h PRO 334 Ca -0.05 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.94 3b8s h PRO 334 Cb 0.52 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.41 3b8s h PRO 334 CO 0.06 0.56 0.08 0.00 -0.21 0.00 0.00 178.00 178.49 3b8s h ALA 335 N 1.56 1.04 -0.28 -0.75 0.00 -1.08 -0.96 119.26 118.79 3b8s h ALA 335 Ca 0.44 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 3b8s h ALA 335 Cb 0.50 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3b8s h ALA 335 CO -0.21 0.61 0.03 -0.92 0.00 0.00 0.00 179.25 178.77 3b8s h TYR 336 N 0.90 0.51 -0.30 0.00 5.03 -0.37 0.32 116.97 123.06 3b8s h TYR 336 Ca 0.18 -0.08 -0.01 0.00 2.58 0.00 0.00 58.73 61.40 3b8s h TYR 336 Cb 0.41 -0.14 -0.01 0.00 1.55 0.00 0.00 36.73 38.54 3b8s h TYR 336 CO 0.03 0.59 0.13 0.82 -1.32 0.00 0.00 178.16 178.41 3b8s h ILE 337 N 0.28 1.17 -0.83 1.81 2.04 -1.10 -1.98 117.51 118.90 3b8s h ILE 337 Ca 0.08 -0.49 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 3b8s h ILE 337 Cb 0.37 0.93 -0.04 0.00 -0.74 0.00 0.00 36.82 37.34 3b8s h ILE 337 CO 0.01 0.17 0.49 0.00 0.00 0.00 0.00 178.15 178.82 3b8s h ALA 338 N 0.98 1.06 -0.46 1.87 0.00 -1.12 -1.65 119.26 119.94 3b8s h ALA 338 Ca 0.10 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.96 3b8s h ALA 338 Cb 0.15 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 3b8s h ALA 338 CO -0.01 0.54 0.20 1.25 0.00 0.00 0.00 179.25 181.22 3b8s h LEU 339 N 1.14 0.26 -0.56 0.00 5.85 -0.73 0.65 115.31 121.92 3b8s h LEU 339 Ca 0.30 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 59.04 3b8s h LEU 339 Cb -0.02 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 3b8s h LEU 339 CO -0.05 0.18 0.29 0.24 -0.34 0.00 0.00 178.44 178.76 3b8s h MET 340 N 0.40 0.79 -0.38 1.25 2.86 -1.03 0.11 114.93 118.94 3b8s h MET 340 Ca 0.21 -0.10 -0.00 0.00 -2.06 0.00 0.00 59.70 57.74 3b8s h MET 340 Cb 0.16 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.65 3b8s h MET 340 CO -0.18 0.62 0.23 -0.09 1.06 0.00 0.00 176.91 178.55 3b8s h ARG 341 N 0.76 0.52 -0.17 1.72 2.43 -1.04 -1.47 114.38 117.12 3b8s h ARG 341 Ca 0.20 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.19 3b8s h ARG 341 Cb 0.07 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 3b8s h ARG 341 CO -0.03 0.39 -0.42 0.93 -1.51 0.00 0.00 179.97 179.33 3b8s h GLU 342 N 0.50 0.40 -0.41 0.20 5.08 -0.55 -1.67 114.58 118.13 3b8s h GLU 342 Ca 0.14 -0.21 -0.15 0.00 -1.00 0.00 0.00 59.36 58.14 3b8s h GLU 342 Cb 0.01 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 3b8s h GLU 342 CO -0.03 0.76 -0.34 -0.07 -1.00 0.00 0.00 179.01 178.33 3b8s h LEU 343 N 0.33 1.01 -0.67 1.33 3.38 -0.72 -2.62 115.31 117.35 3b8s h LEU 343 Ca 0.03 -0.45 -0.09 0.00 0.09 0.00 0.00 57.88 57.46 3b8s h LEU 343 Cb 0.89 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 3b8s h LEU 343 CO 0.07 1.25 0.06 -0.09 0.09 0.00 0.00 178.44 179.82 3b8s h ARG 344 N 0.79 1.08 -0.27 1.13 9.65 -1.06 0.16 114.38 125.86 3b8s h ARG 344 Ca 0.07 -0.31 0.04 0.00 -1.10 0.00 0.00 59.98 58.68 3b8s h ARG 344 Cb 0.93 -0.11 -0.04 0.00 -1.39 0.00 0.00 29.97 29.36 3b8s h ARG 344 CO 0.09 1.02 0.04 0.28 2.80 0.00 0.00 179.97 184.19 3b8s h VAL 345 N 1.00 0.85 -0.39 0.20 2.07 -1.32 -0.32 116.25 118.35 3b8s h VAL 345 Ca 0.19 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.66 3b8s h VAL 345 Cb 0.50 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 3b8s h VAL 345 CO 0.02 0.02 0.21 -0.03 0.02 0.00 0.00 177.57 177.82 3b8s h MET 346 N 0.13 0.54 -0.59 1.57 1.85 -1.06 -1.97 114.93 115.40 3b8s h MET 346 Ca 0.13 -0.06 -0.06 0.00 -0.61 0.00 0.00 59.70 59.10 3b8s h MET 346 Cb 0.14 -0.11 -0.03 0.00 0.43 0.00 0.00 31.60 32.04 3b8s h MET 346 CO -0.18 0.44 0.13 -0.07 -0.40 0.00 0.00 176.91 176.83 3b8s h LEU 347 N 0.50 0.87 -0.74 3.39 3.38 -0.50 -2.05 115.31 120.17 3b8s h LEU 347 Ca 0.14 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 57.96 3b8s h LEU 347 Cb 0.05 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 3b8s h LEU 347 CO -0.02 0.85 0.47 0.44 0.09 0.00 0.00 178.44 180.27 3b8s h ASP 348 N 0.88 0.79 -0.27 -0.43 3.32 -0.80 0.78 116.42 120.70 3b8s h ASP 348 Ca 0.19 -0.01 0.06 0.00 0.02 0.00 0.00 57.03 57.29 3b8s h ASP 348 Cb 0.33 -0.18 -0.07 0.00 0.22 0.00 0.00 39.33 39.64 3b8s h ASP 348 CO 0.00 0.56 -0.16 -0.33 -1.72 0.00 0.00 179.24 177.59 3b8s h GLU 349 N 0.94 -0.13 -0.72 3.56 5.08 -0.84 -0.82 114.58 121.65 3b8s h GLU 349 Ca 0.29 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.67 3b8s h GLU 349 Cb -0.03 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 3b8s h GLU 349 CO -0.09 -0.09 0.48 -0.07 -1.00 0.00 0.00 179.01 178.24 3b8s h LEU 350 N -0.14 0.81 -0.65 1.33 3.38 -0.75 -1.39 115.31 117.90 3b8s h LEU 350 Ca 0.15 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.01 3b8s h LEU 350 Cb 0.36 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 3b8s h LEU 350 CO -0.36 0.57 0.07 -0.33 0.09 0.00 0.00 178.44 178.49 3b8s h GLU 351 N 0.95 1.09 -0.54 1.13 5.08 -0.20 -1.20 114.58 120.88 3b8s h GLU 351 Ca 0.27 -0.31 -0.09 0.00 -1.00 0.00 0.00 59.36 58.23 3b8s h GLU 351 Cb -0.06 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 3b8s h GLU 351 CO -0.07 1.02 -0.01 0.00 -1.00 0.00 0.00 179.01 178.95 3b8s h ALA 352 N 1.03 0.74 -0.14 3.43 0.00 -0.71 0.14 119.26 123.74 3b8s h ALA 352 Ca 0.19 -0.30 -0.14 0.00 0.00 0.00 0.00 54.91 54.66 3b8s h ALA 352 Cb 0.48 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3b8s h ALA 352 CO 0.02 0.57 -0.53 0.93 0.00 0.00 0.00 179.25 180.24 3b8s h GLU 353 N 0.85 0.39 0.00 0.00 5.08 -1.12 -3.37 114.58 116.41 3b8s h GLU 353 Ca 0.15 -0.24 -0.05 0.00 -1.00 0.00 0.00 59.36 58.22 3b8s h GLU 353 Cb 0.55 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 3b8s h GLU 353 CO 0.03 0.83 -1.47 0.25 -1.00 0.00 0.00 179.01 177.65 3b8s n THR 354 N -3.95 0.19 -0.89 1.13 -2.24 -0.47 -5.00 114.28 103.06 3b8s n THR 354 Ca -0.02 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 3b8s n THR 354 Cb 0.58 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 3b8s n THR 354 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3b8s n GLY 355 N 2.15 0.84 3.93 3.38 0.00 0.03 -5.04 105.19 110.48 3b8s n GLY 355 Ca -0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.71 3b8s n GLY 355 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3b8s s ARG 356 N -0.11 2.64 -0.16 1.61 0.52 -1.25 -5.04 118.95 117.16 3b8s s ARG 356 Ca 0.00 -0.21 -0.03 0.00 -0.52 0.00 0.00 55.73 54.97 3b8s s ARG 356 Cb 0.00 -2.28 -0.02 0.00 0.52 0.00 0.00 34.95 33.16 3b8s s ARG 356 CO 0.00 -0.86 -0.05 0.99 0.02 0.00 0.00 175.30 175.41 3b8s s THR 357 N -3.02 3.77 -0.05 0.02 2.01 -1.26 -4.47 115.64 112.64 3b8s s THR 357 Ca 0.56 -0.40 0.04 0.00 0.31 0.00 0.00 61.69 62.20 3b8s s THR 357 Cb -0.11 -2.65 -0.03 0.00 0.01 0.00 0.00 72.50 69.72 3b8s s THR 357 CO 0.44 0.49 -0.14 -0.31 -0.69 0.00 0.00 174.62 174.40 3b8s s TYR 358 N 0.47 2.71 0.02 4.92 2.02 -1.26 -4.88 117.35 121.34 3b8s s TYR 358 Ca -0.04 -0.16 0.00 0.00 -0.37 0.00 0.00 57.07 56.50 3b8s s TYR 358 Cb -0.14 -1.63 -0.04 0.00 -0.40 0.00 0.00 41.96 39.75 3b8s s TYR 358 CO 0.03 0.19 0.08 -1.21 -1.57 0.00 0.00 175.55 173.07 3b8s s GLU 359 N -0.72 3.02 -0.18 -0.62 2.02 -0.49 -4.96 118.70 116.77 3b8s s GLU 359 Ca 0.11 -0.53 0.01 0.00 0.02 0.00 0.00 54.97 54.58 3b8s s GLU 359 Cb -0.11 -2.83 0.03 0.00 0.10 0.00 0.00 34.13 31.33 3b8s s GLU 359 CO 0.01 0.63 -0.15 -1.17 0.02 0.00 0.00 175.26 174.59 3b8s s LEU 360 N -1.89 2.08 0.34 1.80 2.96 -1.26 -1.45 118.68 121.27 3b8s s LEU 360 Ca 0.24 -0.68 0.03 0.00 -0.22 0.00 0.00 54.13 53.50 3b8s s LEU 360 Cb -0.12 -1.33 -0.04 0.00 0.50 0.00 0.00 46.19 45.20 3b8s s LEU 360 CO 0.16 -0.06 0.10 0.42 -1.32 0.00 0.00 176.35 175.64 3b8s s THR 361 N 1.37 0.81 -0.22 3.68 -4.23 -0.15 -0.42 115.64 116.49 3b8s s THR 361 Ca 0.03 -2.00 -0.17 0.00 -1.18 0.00 0.00 61.69 58.37 3b8s s THR 361 Cb -0.14 -2.58 0.06 0.00 1.34 0.00 0.00 72.50 71.18 3b8s s THR 361 CO -0.11 0.00 0.57 -0.55 -0.54 0.00 0.00 174.62 173.99 3b8s s SER 362 N -3.50 -0.65 -0.15 3.99 0.15 -1.06 -1.33 113.70 111.15 3b8s s SER 362 Ca 0.32 1.18 -0.17 0.00 0.70 0.00 0.00 55.95 57.98 3b8s s SER 362 Cb 0.06 1.14 -0.04 0.00 -1.71 0.00 0.00 66.02 65.47 3b8s s SER 362 CO 0.15 -0.21 0.42 0.00 1.20 0.00 0.00 173.24 174.80 3b8s s ALA 363 N 0.76 3.52 0.11 5.45 0.00 -1.03 0.22 121.76 130.80 3b8s s ALA 363 Ca -0.04 -0.33 0.07 0.00 0.00 0.00 0.00 51.96 51.66 3b8s s ALA 363 Cb -0.05 -2.59 -0.04 0.00 0.00 0.00 0.00 23.12 20.45 3b8s s ALA 363 CO -0.06 -0.06 -0.16 0.96 0.00 0.00 0.00 175.76 176.44 3b8s s ILE 364 N 0.78 1.46 0.48 0.00 -4.36 -0.73 -4.29 121.20 114.54 3b8s s ILE 364 Ca 0.22 -1.63 -0.22 0.00 -0.26 0.00 0.00 60.65 58.76 3b8s s ILE 364 Cb -0.14 -1.50 -0.07 0.00 1.25 0.00 0.00 42.46 42.00 3b8s s ILE 364 CO 0.08 -0.28 1.16 -0.83 0.24 0.00 0.00 174.94 175.31 3b8s s GLY 365 N -2.22 2.75 0.00 6.27 0.00 -1.26 -1.59 107.32 111.27 3b8s s GLY 365 Ca 0.07 0.91 0.05 0.00 0.00 0.00 0.00 44.72 45.76 3b8s s GLY 365 CO 0.04 1.35 0.72 3.33 0.00 0.00 0.00 173.10 178.53 3b8s n VAL 366 N -0.68 0.14 -2.01 1.40 0.24 -1.26 -4.38 118.33 111.78 3b8s n VAL 366 Ca 0.08 -0.57 -0.38 0.00 -2.04 0.00 0.00 64.34 61.43 3b8s n VAL 366 Cb 0.49 1.02 0.01 0.00 -1.47 0.00 0.00 33.84 33.89 3b8s n VAL 366 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3b8s s GLY 367 N -0.49 2.87 0.31 7.63 0.00 -1.26 -3.99 107.32 112.39 3b8s s GLY 367 Ca 0.06 1.20 0.06 0.00 0.00 0.00 0.00 44.72 46.04 3b8s s GLY 367 CO 0.06 1.73 1.78 0.10 0.00 0.00 0.00 173.10 176.77 3b8s h TYR 368 N 2.09 1.06 0.00 1.90 -0.00 -1.90 -0.34 116.97 119.78 3b8s h TYR 368 Ca -0.50 0.03 -0.03 0.00 0.00 0.00 0.00 58.73 58.23 3b8s h TYR 368 Cb 1.26 -0.32 -0.00 0.00 0.00 0.00 0.00 36.73 37.67 3b8s h TYR 368 CO 0.51 0.24 -0.16 0.38 -0.00 0.00 0.00 178.16 179.13 3b8s h ASP 369 N 0.76 0.00 0.01 0.10 2.03 -1.93 -2.26 116.42 115.13 3b8s h ASP 369 Ca 0.58 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 56.77 3b8s h ASP 369 Cb 0.90 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.39 3b8s h ASP 369 CO -0.37 0.16 -0.54 0.11 -1.03 0.00 0.00 179.24 177.57 3b8s h LYS 370 N 0.00 0.02 -0.44 4.15 1.79 -1.43 -3.38 116.57 117.28 3b8s h LYS 370 Ca -0.00 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.42 3b8s h LYS 370 Cb 0.58 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.22 3b8s h LYS 370 CO 0.02 1.02 0.22 0.82 -1.08 0.00 0.00 179.45 180.44 3b8s h ILE 371 N -0.95 1.15 0.00 1.86 2.04 -1.28 -2.68 117.51 117.65 3b8s h ILE 371 Ca -0.14 -0.41 0.00 0.00 1.00 0.00 0.00 64.86 65.31 3b8s h ILE 371 Cb 1.16 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 37.83 3b8s h ILE 371 CO -0.07 0.17 0.00 -1.84 0.00 0.00 0.00 178.15 176.41 3b8s n GLU 372 N -4.40 0.19 0.00 2.37 0.28 -0.86 -2.58 120.64 115.64 3b8s n GLU 372 Ca 0.03 0.43 0.14 0.00 -0.16 0.00 0.00 57.16 57.60 3b8s n GLU 372 Cb 0.11 -1.87 0.53 0.00 1.43 0.00 0.00 31.44 31.65 3b8s n GLU 372 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 3b8s n ASP 373 N -2.23 0.99 -3.90 -1.84 8.00 -1.01 -4.83 116.55 111.73 3b8s n ASP 373 Ca 0.02 -1.06 -0.18 0.00 0.71 0.00 0.00 54.79 54.28 3b8s n ASP 373 Cb 0.22 0.03 -0.16 0.00 -0.02 0.00 0.00 41.12 41.19 3b8s n ASP 373 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3b8s s VAL 374 N -2.27 0.44 -0.95 2.53 1.01 -1.06 -3.54 120.40 116.56 3b8s s VAL 374 Ca 0.32 -0.13 -0.23 0.00 0.00 0.00 0.00 61.98 61.95 3b8s s VAL 374 Cb 0.20 -0.45 0.06 0.00 0.00 0.00 0.00 36.38 36.19 3b8s s VAL 374 CO 0.43 0.18 1.37 -0.62 0.00 0.00 0.00 175.10 176.46 3b8s s ASP 375 N 0.57 6.45 0.44 3.32 -1.08 -1.26 -4.85 116.67 120.26 3b8s s ASP 375 Ca -0.07 -1.33 0.24 0.00 -0.52 0.00 0.00 52.55 50.88 3b8s s ASP 375 Cb -0.10 -2.55 0.89 0.00 -1.46 0.00 0.00 42.92 39.70 3b8s s ASP 375 CO -0.00 -1.52 1.81 1.88 0.52 0.00 0.00 175.17 177.86 3b8s h TYR 376 N 9.73 0.00 -0.48 -5.34 0.05 -1.94 -2.22 116.97 116.77 3b8s h TYR 376 Ca 0.10 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.86 3b8s h TYR 376 Cb 1.02 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.74 3b8s h TYR 376 CO 1.23 0.21 0.21 0.00 -1.05 0.00 0.00 178.16 178.76 3b8s h ALA 377 N 1.79 1.47 0.03 3.88 0.00 -1.89 0.09 119.26 124.64 3b8s h ALA 377 Ca -0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 3b8s h ALA 377 Cb 0.77 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3b8s h ALA 377 CO 0.03 0.41 -0.02 0.22 0.00 0.00 0.00 179.25 179.90 3b8s h ASP 378 N 0.67 -0.04 -0.93 0.00 1.82 -1.85 -3.36 116.42 112.74 3b8s h ASP 378 Ca 0.17 -0.65 0.01 0.00 -0.39 0.00 0.00 57.03 56.16 3b8s h ASP 378 Cb 0.11 0.01 -0.05 0.00 0.68 0.00 0.00 39.33 40.08 3b8s h ASP 378 CO -0.02 0.68 0.61 0.00 -1.61 0.00 0.00 179.24 178.90 3b8s h ALA 379 N 0.07 1.18 0.00 -0.78 0.00 -1.30 -3.19 119.26 115.24 3b8s h ALA 379 Ca -0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3b8s h ALA 379 Cb 0.69 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 3b8s h ALA 379 CO 0.01 0.56 -0.04 -0.24 0.00 0.00 0.00 179.25 179.54 3b8s h VAL 380 N 1.25 0.11 0.00 0.00 3.04 -1.12 -2.65 116.25 116.88 3b8s h VAL 380 Ca 0.34 -0.51 -0.00 0.00 -1.01 0.00 0.00 66.70 65.52 3b8s h VAL 380 Cb -0.13 1.46 -0.00 0.00 -2.01 0.00 0.00 31.29 30.60 3b8s h VAL 380 CO -0.08 0.04 -0.01 0.06 -1.01 0.00 0.00 177.57 176.57 3b8s h GLN 381 N 0.00 0.00 -0.00 4.17 3.07 -1.70 -1.00 115.11 119.65 3b8s h GLN 381 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3b8s h GLN 381 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.01 3b8s h GLN 381 CO 0.00 0.01 -0.77 0.66 0.09 0.00 0.00 178.83 178.82 3b8s n TYR 382 N -3.45 0.00 -4.19 0.06 4.02 -1.00 -4.99 117.16 107.62 3b8s n TYR 382 Ca -0.03 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.56 3b8s n TYR 382 Cb 0.09 -0.07 -0.09 0.00 -0.02 0.00 0.00 39.34 39.25 3b8s n TYR 382 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 176.86 174.21 3b8s s MET 383 N -2.91 2.43 -0.13 -0.72 -1.94 -0.38 -4.81 119.30 110.84 3b8s s MET 383 Ca 0.11 -0.88 -0.26 0.00 -1.71 0.00 0.00 55.69 52.95 3b8s s MET 383 Cb 0.17 -2.47 -0.26 0.00 2.01 0.00 0.00 34.83 34.27 3b8s s MET 383 CO 0.77 0.54 0.72 -0.44 -0.01 0.00 0.00 175.02 176.60 3b8s h ASP 384 N 3.60 0.09 -4.55 3.03 3.32 -1.01 -3.48 116.42 117.43 3b8s h ASP 384 Ca -0.48 -0.93 -0.17 0.00 0.02 0.00 0.00 57.03 55.46 3b8s h ASP 384 Cb 1.17 -0.03 -0.23 0.00 0.22 0.00 0.00 39.33 40.46 3b8s h ASP 384 CO 0.57 1.14 -0.60 -0.31 -1.72 0.00 0.00 179.24 178.32 3b8s s TYR 385 N -2.28 0.06 -0.24 4.55 1.51 -1.21 -4.70 117.35 115.04 3b8s s TYR 385 Ca -0.19 -0.13 -0.04 0.00 -1.01 0.00 0.00 57.07 55.70 3b8s s TYR 385 Cb -0.01 -0.06 -0.00 0.00 -0.11 0.00 0.00 41.96 41.77 3b8s s TYR 385 CO 0.70 -0.17 -0.01 0.42 -1.11 0.00 0.00 175.55 175.38 3b8s s ILE 386 N -0.91 3.49 -0.64 2.71 1.01 0.11 -2.58 121.20 124.40 3b8s s ILE 386 Ca -0.10 -0.57 -0.23 0.00 0.00 0.00 0.00 60.65 59.76 3b8s s ILE 386 Cb -0.06 -2.66 0.07 0.00 0.01 0.00 0.00 42.46 39.82 3b8s s ILE 386 CO 0.00 0.33 0.95 -0.36 0.00 0.00 0.00 174.94 175.85 3b8s s PHE 387 N 1.47 2.71 -0.40 3.97 0.08 0.13 -0.30 117.98 125.64 3b8s s PHE 387 Ca 0.05 -0.49 -0.29 0.00 0.12 0.00 0.00 56.93 56.31 3b8s s PHE 387 Cb -0.15 -4.24 0.01 0.00 -0.57 0.00 0.00 43.02 38.07 3b8s s PHE 387 CO -0.02 -1.59 1.40 0.00 -0.10 0.00 0.00 175.22 174.91 3b8s s ALA 388 N 3.98 3.08 -1.21 5.36 0.00 0.02 -1.77 121.76 131.22 3b8s s ALA 388 Ca 0.23 -0.13 -0.19 0.00 0.00 0.00 0.00 51.96 51.86 3b8s s ALA 388 Cb -0.17 -3.92 -0.02 0.00 0.00 0.00 0.00 23.12 19.01 3b8s s ALA 388 CO 0.11 -2.33 1.90 -1.33 0.00 0.00 0.00 175.76 174.12 3b8s n MET 389 N 7.99 2.38 -1.98 0.00 2.81 -0.62 -2.76 117.12 124.94 3b8s n MET 389 Ca 0.16 -2.71 -0.40 0.00 -1.81 0.00 0.00 57.70 52.94 3b8s n MET 389 Cb 0.48 -3.46 -0.00 0.00 -0.71 0.00 0.00 33.22 29.52 3b8s n MET 389 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 3b8s n THR 390 N 6.60 5.16 -3.82 2.03 -2.24 -1.26 -4.39 114.28 116.36 3b8s n THR 390 Ca 0.48 -4.26 -0.08 0.00 -2.27 0.00 0.00 64.05 57.92 3b8s n THR 390 Cb 0.44 -2.11 0.02 0.00 -2.10 0.00 0.00 70.33 66.58 3b8s n THR 390 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 3b8s s TYR 391 N -0.93 0.06 -1.60 4.78 -0.85 -1.26 -4.64 117.35 112.91 3b8s s TYR 391 Ca 0.54 -0.69 -0.04 0.00 -0.52 0.00 0.00 57.07 56.36 3b8s s TYR 391 Cb 0.18 0.81 0.00 0.00 0.38 0.00 0.00 41.96 43.34 3b8s s TYR 391 CO -0.09 -1.49 0.51 -0.25 -1.52 0.00 0.00 175.55 172.71 3b8s n ASP 392 N -1.22 -6.11 0.06 -0.18 8.00 -0.45 -4.92 116.55 111.73 3b8s n ASP 392 Ca -0.07 -0.24 -0.09 0.00 0.71 0.00 0.00 54.79 55.10 3b8s n ASP 392 Cb 0.60 -4.96 0.04 0.00 -0.02 0.00 0.00 41.12 36.78 3b8s n ASP 392 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 3b8s h PHE 393 N -1.16 0.46 -3.98 1.24 0.04 -0.93 -3.45 116.94 109.17 3b8s h PHE 393 Ca -0.53 -0.21 -0.20 0.00 2.80 0.00 0.00 57.97 59.83 3b8s h PHE 393 Cb 1.37 -0.07 -0.17 0.00 2.20 0.00 0.00 35.95 39.28 3b8s h PHE 393 CO 0.53 0.96 -0.70 0.71 -0.60 0.00 0.00 178.31 179.21 3b8s s TYR 394 N -3.56 0.68 0.02 -0.55 1.51 -1.26 -4.95 117.35 109.25 3b8s s TYR 394 Ca -0.05 -0.83 -0.28 0.00 -1.01 0.00 0.00 57.07 54.90 3b8s s TYR 394 Cb 0.11 -0.42 0.10 0.00 -0.11 0.00 0.00 41.96 41.63 3b8s s TYR 394 CO 0.83 -0.20 1.24 0.20 -1.11 0.00 0.00 175.55 176.51 3b8s s GLY 395 N -2.55 -0.16 0.00 0.71 0.00 -1.26 -4.53 107.32 99.53 3b8s s GLY 395 Ca 0.03 0.13 0.16 0.00 0.00 0.00 0.00 44.72 45.04 3b8s s GLY 395 CO -0.05 3.65 1.36 0.61 0.00 0.00 0.00 173.10 178.68 3b8s n GLY 396 N -0.76 -0.52 0.28 0.20 0.00 -1.26 -3.00 105.19 100.13 3b8s n GLY 396 Ca -0.01 -0.10 0.15 0.00 0.00 0.00 0.00 46.02 46.06 3b8s n GLY 396 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 3b8s h TRP 397 N 0.00 0.00 -4.03 1.61 0.09 -1.95 -3.42 115.95 108.25 3b8s h TRP 397 Ca 0.00 0.00 -0.34 0.00 0.09 0.00 0.00 58.89 58.64 3b8s h TRP 397 Cb 0.01 0.00 -0.08 0.00 0.08 0.00 0.00 29.16 29.17 3b8s h TRP 397 CO 0.00 0.07 -0.31 0.27 0.09 0.00 0.00 178.44 178.57 3b8s n ASN 398 N -3.58 0.22 -1.63 0.11 0.23 -1.16 -5.06 115.26 104.39 3b8s n ASN 398 Ca -0.02 -2.44 0.07 0.00 -0.53 0.00 0.00 54.58 51.66 3b8s n ASN 398 Cb 0.19 0.92 0.34 0.00 -2.08 0.00 0.00 39.78 39.15 3b8s n ASN 398 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 3b8s n ASN 399 N -1.95 4.86 -4.42 0.53 3.02 -1.26 -4.87 115.26 111.16 3b8s n ASN 399 Ca 0.01 -2.67 -0.44 0.00 -0.03 0.00 0.00 54.58 51.45 3b8s n ASN 399 Cb 0.40 -0.62 -0.08 0.00 -0.61 0.00 0.00 39.78 38.86 3b8s n ASN 399 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3b8s s VAL 400 N -2.29 5.22 0.68 2.41 1.01 -1.26 -1.74 120.40 124.43 3b8s s VAL 400 Ca 0.47 -0.88 -0.15 0.00 0.00 0.00 0.00 61.98 61.42 3b8s s VAL 400 Cb 0.34 -4.06 0.01 0.00 0.00 0.00 0.00 36.38 32.67 3b8s s VAL 400 CO 0.17 -0.49 1.13 -2.84 0.00 0.00 0.00 175.10 173.07 3b8s s PRO 401 N 1.71 2.63 0.00 2.72 0.02 -1.26 -4.56 135.00 136.26 3b8s s PRO 401 Ca 0.05 1.47 0.00 0.00 0.02 0.00 0.00 61.00 62.54 3b8s s PRO 401 Cb -0.22 -1.92 0.00 0.00 0.02 0.00 0.00 34.50 32.38 3b8s s PRO 401 CO 0.08 -1.39 0.00 0.41 -0.33 0.00 0.00 177.00 175.77 3b8s n GLY 402 N -0.32 0.64 3.61 0.52 0.00 -1.26 -4.89 105.19 103.49 3b8s n GLY 402 Ca 0.11 -0.80 -0.43 0.00 0.00 0.00 0.00 46.02 44.91 3b8s n GLY 402 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3b8s s HIS 403 N -2.00 3.10 0.16 1.61 3.76 -1.26 -4.76 115.29 115.90 3b8s s HIS 403 Ca 0.00 0.86 0.31 0.00 -0.15 0.00 0.00 55.06 56.08 3b8s s HIS 403 Cb 0.00 -3.63 1.29 0.00 1.11 0.00 0.00 32.58 31.36 3b8s s HIS 403 CO 0.00 -0.80 1.96 -0.56 -0.85 0.00 0.00 174.74 174.50 3b8s h GLN 404 N 8.38 0.00 0.00 1.40 3.07 -1.85 -3.33 115.11 122.78 3b8s h GLN 404 Ca -0.23 0.00 -0.09 0.00 0.09 0.00 0.00 58.65 58.42 3b8s h GLN 404 Cb 1.08 0.00 -0.18 0.00 0.08 0.00 0.00 27.48 28.46 3b8s h GLN 404 CO 0.98 0.07 -0.64 -2.37 0.09 0.00 0.00 178.83 176.97 3b8s n THR 405 N -3.22 0.00 -1.88 1.86 5.66 -1.26 -0.32 114.28 115.12 3b8s n THR 405 Ca 0.00 -0.41 -0.37 0.00 -3.05 0.00 0.00 64.05 60.23 3b8s n THR 405 Cb 0.33 0.65 0.05 0.00 -1.55 0.00 0.00 70.33 69.80 3b8s n THR 405 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3b8s s ALA 406 N 0.00 2.47 -0.09 1.79 0.00 -1.25 -4.80 121.76 119.88 3b8s s ALA 406 Ca 0.14 1.12 -0.22 0.00 0.00 0.00 0.00 51.96 53.00 3b8s s ALA 406 Cb 0.16 -3.50 -0.18 0.00 0.00 0.00 0.00 23.12 19.59 3b8s s ALA 406 CO -0.07 -1.37 0.77 1.25 0.00 0.00 0.00 175.76 176.34 3b8s h LEU 407 N 0.75 -0.06-10.24 0.00 5.85 -1.47 0.32 115.31 110.45 3b8s h LEU 407 Ca -0.51 -0.59 -0.63 0.00 0.84 0.00 0.00 57.88 56.99 3b8s h LEU 407 Cb 1.32 0.02 -0.09 0.00 0.37 0.00 0.00 40.66 42.28 3b8s h LEU 407 CO 0.54 0.66 -0.39 -0.31 -0.34 0.00 0.00 178.44 178.60 3b8s s TYR 408 N -2.81 1.65 0.03 1.25 1.51 -0.25 -0.70 117.35 118.04 3b8s s TYR 408 Ca -0.14 -0.92 -0.30 0.00 -1.01 0.00 0.00 57.07 54.69 3b8s s TYR 408 Cb -0.01 -1.76 -0.06 0.00 -0.11 0.00 0.00 41.96 40.02 3b8s s TYR 408 CO 0.53 -0.19 1.33 0.00 -1.11 0.00 0.00 175.55 176.10 3b8s s GLY 410 N 1.48 1.62 0.48 0.00 0.00 -1.26 -3.94 107.32 105.70 3b8s s GLY 410 Ca 0.62 -0.55 0.13 0.00 0.00 0.00 0.00 44.72 44.92 3b8s s GLY 410 CO 0.27 -0.19 2.11 0.23 0.00 0.00 0.00 173.10 175.52 3b8s h SER 411 N -0.56 0.18 0.50 1.64 0.87 -1.96 -2.13 113.55 112.09 3b8s h SER 411 Ca -0.45 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.10 3b8s h SER 411 Cb 1.27 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.19 3b8s h SER 411 CO 0.63 0.13 0.00 2.19 -0.53 0.00 0.00 176.83 179.25 3b8s h PHE 412 N 0.21 0.00 -3.57 2.24 -5.15 -1.93 -3.44 116.94 105.30 3b8s h PHE 412 Ca 0.07 0.00 -0.52 0.00 -0.20 0.00 0.00 57.97 57.32 3b8s h PHE 412 Cb 0.03 0.00 0.02 0.00 0.22 0.00 0.00 35.95 36.23 3b8s h PHE 412 CO -0.00 0.00 0.55 -1.64 -2.00 0.00 0.00 178.31 175.22 3b8s s MET 413 N -3.84 4.51 0.75 6.09 -1.94 -0.80 -4.92 119.30 119.15 3b8s s MET 413 Ca -0.01 1.89 -0.11 0.00 -1.71 0.00 0.00 55.69 55.75 3b8s s MET 413 Cb 0.10 -3.22 0.04 0.00 2.01 0.00 0.00 34.83 33.77 3b8s s MET 413 CO 0.45 -0.04 1.08 1.03 -0.01 0.00 0.00 175.02 177.53 3b8s s ARG 414 N -0.56 2.48 0.17 2.03 0.52 -1.26 -4.92 118.95 117.41 3b8s s ARG 414 Ca 0.51 0.78 -0.33 0.00 -0.52 0.00 0.00 55.73 56.17 3b8s s ARG 414 Cb -0.33 -1.95 -0.14 0.00 0.52 0.00 0.00 34.95 33.05 3b8s s ARG 414 CO 0.39 -1.38 1.59 -2.30 0.02 0.00 0.00 175.30 173.62 3b8s n PRO 415 N -3.29 2.25 -0.96 3.54 -0.02 -1.26 -1.54 135.00 133.72 3b8s n PRO 415 Ca 0.07 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.36 3b8s n PRO 415 Cb 0.55 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 3b8s n PRO 415 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3b8s n GLY 416 N 3.43 0.79 0.12 -1.23 0.00 -1.26 -4.19 105.19 102.85 3b8s n GLY 416 Ca 0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.97 3b8s n GLY 416 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3b8s h GLN 417 N 2.28 0.30 -0.39 1.61 4.15 -1.55 -0.94 115.11 120.57 3b8s h GLN 417 Ca 0.00 -0.51 0.08 0.00 0.77 0.00 0.00 58.65 58.99 3b8s h GLN 417 Cb 0.00 0.19 -0.08 0.00 0.21 0.00 0.00 27.48 27.81 3b8s h GLN 417 CO 0.00 1.24 -0.11 0.00 -1.93 0.00 0.00 178.83 178.04 3b8s n ASP 419 N -5.31 2.22 0.00 0.00 8.00 -1.26 -1.61 116.55 118.58 3b8s n ASP 419 Ca 0.02 -1.61 0.00 0.00 0.71 0.00 0.00 54.79 53.91 3b8s n ASP 419 Cb 0.22 0.27 0.00 0.00 -0.02 0.00 0.00 41.12 41.59 3b8s n ASP 419 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3b8s n GLY 420 N 1.23 -1.40 0.54 0.44 0.00 -0.99 -3.81 105.19 101.20 3b8s n GLY 420 Ca 0.10 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.54 3b8s n GLY 420 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b8s n GLY 421 N -1.72 2.16 0.00 -0.02 0.00 -0.51 -4.68 105.19 100.43 3b8s n GLY 421 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3b8s n GLY 421 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b8s n GLY 422 N -2.00 -0.48 2.94 -0.02 0.00 -0.38 -4.83 105.19 100.42 3b8s n GLY 422 Ca 0.00 -1.70 -0.12 0.00 0.00 0.00 0.00 46.02 44.20 3b8s n GLY 422 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3b8s s VAL 423 N -0.00 0.00 0.92 1.61 1.01 -1.26 -1.44 120.40 121.24 3b8s s VAL 423 Ca 0.00 -0.03 -0.15 0.00 0.00 0.00 0.00 61.98 61.81 3b8s s VAL 423 Cb 0.00 -0.11 0.16 0.00 0.00 0.00 0.00 36.38 36.43 3b8s s VAL 423 CO 0.00 -0.01 1.26 1.51 0.00 0.00 0.00 175.10 177.85 3b8s s ASP 424 N -0.01 3.51 0.65 3.32 1.47 -0.20 -4.86 116.67 120.54 3b8s s ASP 424 Ca -0.01 0.49 0.34 0.00 1.18 0.00 0.00 52.55 54.56 3b8s s ASP 424 Cb -0.01 -0.72 1.88 0.00 -0.34 0.00 0.00 42.92 43.74 3b8s s ASP 424 CO 0.00 -2.51 2.09 -0.08 0.68 0.00 0.00 175.17 175.35 3b8s h GLU 425 N -1.48 0.00 -0.02 2.11 4.57 -2.02 0.11 114.58 117.85 3b8s h GLU 425 Ca -0.45 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.73 3b8s h GLU 425 Cb 1.27 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.86 3b8s h GLU 425 CO 0.48 0.00 -0.17 0.09 -1.18 0.00 0.00 179.01 178.23 3b8s n ASN 426 N -3.11 2.63 0.00 1.04 3.02 -1.26 -4.97 115.26 112.60 3b8s n ASN 426 Ca -0.01 -1.82 0.00 0.00 -0.03 0.00 0.00 54.58 52.72 3b8s n ASN 426 Cb 0.29 0.17 0.00 0.00 -0.61 0.00 0.00 39.78 39.63 3b8s n ASN 426 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3b8s n GLY 427 N 1.37 0.56 3.71 7.41 0.00 0.38 -5.06 105.19 113.56 3b8s n GLY 427 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 3b8s n GLY 427 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3b8s s GLU 428 N -0.85 4.52 0.36 1.61 0.41 -1.26 -4.68 118.70 118.82 3b8s s GLU 428 Ca 0.00 1.36 -0.28 0.00 -0.41 0.00 0.00 54.97 55.64 3b8s s GLU 428 Cb 0.00 -3.47 -0.11 0.00 -1.78 0.00 0.00 34.13 28.77 3b8s s GLU 428 CO 0.00 -0.09 1.44 -2.14 -0.49 0.00 0.00 175.26 173.98 3b8s s PRO 429 N 1.18 4.17 -0.56 0.39 0.02 -1.26 -1.04 135.00 137.91 3b8s s PRO 429 Ca 0.50 2.48 -0.28 0.00 0.02 0.00 0.00 61.00 63.72 3b8s s PRO 429 Cb -0.20 -3.00 0.02 0.00 0.02 0.00 0.00 34.50 31.35 3b8s s PRO 429 CO 0.25 -0.44 1.27 0.71 -0.33 0.00 0.00 177.00 178.46 3b8s s TYR 430 N -1.12 2.51 0.10 6.54 1.51 -0.52 -4.86 117.35 121.51 3b8s s TYR 430 Ca 0.52 0.47 0.23 0.00 -1.01 0.00 0.00 57.07 57.27 3b8s s TYR 430 Cb -0.45 -4.47 0.80 0.00 -0.11 0.00 0.00 41.96 37.74 3b8s s TYR 430 CO 0.60 -1.71 1.78 0.87 -1.11 0.00 0.00 175.55 175.98 3b8s h LYS 431 N 10.03 0.00 -3.66 -0.62 1.57 -1.93 -1.36 116.57 120.61 3b8s h LYS 431 Ca -0.26 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.37 3b8s h LYS 431 Cb 1.07 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.33 3b8s h LYS 431 CO 1.17 0.26 -0.01 0.20 -0.57 0.00 0.00 179.45 180.51 3b8s s GLY 432 N -4.30 0.98 0.57 3.86 0.00 -1.26 -4.79 107.32 102.37 3b8s s GLY 432 Ca 0.01 -1.16 -0.21 0.00 0.00 0.00 0.00 44.72 43.36 3b8s s GLY 432 CO 0.65 -0.70 1.27 -1.05 0.00 0.00 0.00 173.10 173.27 3b8s n PRO 433 N -0.54 1.44 -0.78 2.90 -0.02 -1.25 -3.91 135.00 132.85 3b8s n PRO 433 Ca -0.03 0.54 -0.30 0.00 -2.02 0.00 0.00 63.50 61.69 3b8s n PRO 433 Cb 0.61 -2.48 0.17 0.00 -0.02 0.00 0.00 33.50 31.79 3b8s n PRO 433 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3b8s s ALA 434 N -1.34 1.16 -0.91 3.55 0.00 -0.63 -4.62 121.76 118.97 3b8s s ALA 434 Ca 0.74 0.35 -0.25 0.00 0.00 0.00 0.00 51.96 52.80 3b8s s ALA 434 Cb -0.42 -3.36 0.04 0.00 0.00 0.00 0.00 23.12 19.38 3b8s s ALA 434 CO 0.47 -2.84 1.38 0.71 0.00 0.00 0.00 175.76 175.48 3b8s s TYR 435 N -2.67 2.43 0.18 0.00 1.51 -1.26 -4.83 117.35 112.72 3b8s s TYR 435 Ca 0.66 -0.53 0.03 0.00 -1.01 0.00 0.00 57.07 56.23 3b8s s TYR 435 Cb -0.22 -4.67 -0.05 0.00 -0.11 0.00 0.00 41.96 36.91 3b8s s TYR 435 CO 0.59 -2.00 -0.03 0.95 -1.11 0.00 0.00 175.55 173.95 3b8s s THR 436 N 5.28 0.94 0.10 -0.71 -4.23 -1.26 -4.88 115.64 110.88 3b8s s THR 436 Ca 0.42 -2.02 -0.19 0.00 -1.18 0.00 0.00 61.69 58.72 3b8s s THR 436 Cb -0.03 -2.08 -0.06 0.00 1.34 0.00 0.00 72.50 71.66 3b8s s THR 436 CO -0.00 -0.53 1.64 0.00 -0.54 0.00 0.00 174.62 175.18 3b8s h ALA 437 N 2.67 0.34 -0.45 3.99 0.00 -0.85 -2.82 119.26 122.15 3b8s h ALA 437 Ca -0.37 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 3b8s h ALA 437 Cb 1.20 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 3b8s h ALA 437 CO 0.64 -0.05 0.26 0.22 0.00 0.00 0.00 179.25 180.31 3b8s h ASP 438 N 0.27 0.55 -0.74 0.00 3.58 -1.14 -1.41 116.42 117.52 3b8s h ASP 438 Ca 0.09 -0.07 0.08 0.00 0.42 0.00 0.00 57.03 57.55 3b8s h ASP 438 Cb 0.20 -0.14 -0.07 0.00 1.72 0.00 0.00 39.33 41.05 3b8s h ASP 438 CO -0.01 0.46 0.40 0.78 -2.88 0.00 0.00 179.24 177.99 3b8s h ASN 439 N 0.59 0.57 0.21 2.28 2.35 -1.77 0.31 115.58 120.12 3b8s h ASN 439 Ca 0.16 0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.94 3b8s h ASN 439 Cb 0.02 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.33 3b8s h ASN 439 CO -0.03 0.34 -0.10 1.23 -1.65 0.00 0.00 177.43 177.22 3b8s h GLY 440 N 0.70 -0.29 0.82 2.83 0.00 -1.20 -1.31 103.07 104.63 3b8s h GLY 440 Ca 0.35 0.11 0.03 0.00 0.00 0.00 0.00 47.33 47.82 3b8s h GLY 440 CO -0.23 -0.11 0.24 -2.22 0.00 0.00 0.00 176.54 174.22 3b8s h ILE 441 N -0.41 1.00 -0.76 2.60 1.08 -1.07 -1.88 117.51 118.08 3b8s h ILE 441 Ca -0.03 -0.16 -0.02 0.00 -0.39 0.00 0.00 64.86 64.26 3b8s h ILE 441 Cb 0.31 0.49 -0.04 0.00 -3.07 0.00 0.00 36.82 34.51 3b8s h ILE 441 CO 0.05 0.09 0.39 1.56 -0.69 0.00 0.00 178.15 179.54 3b8s h GLN 442 N 0.47 1.06 -0.09 2.37 1.08 -0.89 -0.87 115.11 118.24 3b8s h GLN 442 Ca 0.18 -0.13 -0.09 0.00 -1.45 0.00 0.00 58.65 57.17 3b8s h GLN 442 Cb 0.06 -0.20 -0.01 0.00 -0.05 0.00 0.00 27.48 27.28 3b8s h GLN 442 CO -0.11 0.80 -0.34 -0.07 -0.95 0.00 0.00 178.83 178.15 3b8s h LEU 443 N 1.06 0.17 -0.04 1.46 3.38 -0.85 -0.03 115.31 120.46 3b8s h LEU 443 Ca 0.26 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 3b8s h LEU 443 Cb 0.06 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.77 3b8s h LEU 443 CO -0.04 0.51 -0.09 -0.07 0.09 0.00 0.00 178.44 178.84 3b8s h LEU 444 N 0.15 0.15 -1.32 1.67 3.38 -0.80 -2.94 115.31 115.60 3b8s h LEU 444 Ca 0.02 -0.57 0.05 0.00 0.09 0.00 0.00 57.88 57.47 3b8s h LEU 444 Cb 0.68 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.34 3b8s h LEU 444 CO 0.05 0.69 0.49 -0.07 0.09 0.00 0.00 178.44 179.70 3b8s h LEU 445 N -0.38 0.75 -1.71 1.67 3.38 -1.10 -2.13 115.31 115.78 3b8s h LEU 445 Ca 0.00 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3b8s h LEU 445 Cb 0.67 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 3b8s h LEU 445 CO 0.02 0.50 -0.16 0.00 0.09 0.00 0.00 178.44 178.89 3b8s h ALA 446 N 1.58 1.24 0.00 1.53 0.00 -0.98 0.83 119.26 123.46 3b8s h ALA 446 Ca 0.31 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3b8s h ALA 446 Cb 0.15 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3b8s h ALA 446 CO -0.10 0.20 0.00 1.96 0.00 0.00 0.00 179.25 181.31 3b8s h GLN 447 N 0.00 0.00 0.00 0.00 4.20 -1.20 -3.47 115.11 114.63 3b8s h GLN 447 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3b8s h GLN 447 Cb 0.44 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.22 3b8s h GLN 447 CO 0.02 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.59 3b8s n GLY 448 N 0.56 1.09 3.70 3.46 0.00 0.29 -4.61 105.19 109.67 3b8s n GLY 448 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 3b8s n GLY 448 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3b8s s VAL 449 N -2.00 2.84 0.29 1.61 1.01 -1.08 -4.86 120.40 118.20 3b8s s VAL 449 Ca 0.00 0.41 -0.29 0.00 0.00 0.00 0.00 61.98 62.10 3b8s s VAL 449 Cb 0.00 -3.27 -0.10 0.00 0.00 0.00 0.00 36.38 33.01 3b8s s VAL 449 CO 0.00 0.01 1.41 -2.16 0.00 0.00 0.00 175.10 174.36 3b8s s PRO 450 N 2.20 4.27 0.37 2.72 0.04 -1.26 -4.35 135.00 138.99 3b8s s PRO 450 Ca 0.74 2.31 0.09 0.00 0.04 0.00 0.00 61.00 64.18 3b8s s PRO 450 Cb -0.42 -3.08 0.84 0.00 0.04 0.00 0.00 34.50 31.88 3b8s s PRO 450 CO 0.32 -0.37 1.92 0.00 0.04 0.00 0.00 177.00 178.91 3b8s h ALA 451 N 4.34 1.84 0.00 8.56 0.00 -1.88 -2.50 119.26 129.62 3b8s h ALA 451 Ca -0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3b8s h ALA 451 Cb 1.22 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3b8s h ALA 451 CO 0.73 -0.02 0.00 0.27 0.00 0.00 0.00 179.25 180.23 3b8s n ASN 452 N -4.51 0.00 -0.26 0.00 6.94 -1.19 -1.60 115.26 114.64 3b8s n ASN 452 Ca 0.14 -0.88 0.06 0.00 -0.02 0.00 0.00 54.58 53.88 3b8s n ASN 452 Cb 0.38 0.00 -0.01 0.00 -2.36 0.00 0.00 39.78 37.79 3b8s n ASN 452 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 3b8s n LYS 453 N -0.85 1.99 -3.44 -3.83 5.02 -0.94 -4.13 118.16 111.98 3b8s n LYS 453 Ca 0.11 -0.64 -0.37 0.00 -2.02 0.00 0.00 58.31 55.40 3b8s n LYS 453 Cb 0.05 -1.16 -0.07 0.00 -0.02 0.00 0.00 35.03 33.84 3b8s n LYS 453 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3b8s s LEU 454 N -1.86 4.24 -0.19 -0.35 1.43 -0.62 0.04 118.68 121.37 3b8s s LEU 454 Ca 0.10 0.61 -0.02 0.00 -1.03 0.00 0.00 54.13 53.78 3b8s s LEU 454 Cb 0.10 -2.50 -0.01 0.00 0.03 0.00 0.00 46.19 43.82 3b8s s LEU 454 CO 0.33 0.04 -0.09 -0.69 0.23 0.00 0.00 176.35 176.17 3b8s s VAL 455 N 0.65 3.06 -0.05 -1.59 1.01 0.58 -0.63 120.40 123.43 3b8s s VAL 455 Ca 0.20 -0.62 -0.23 0.00 0.00 0.00 0.00 61.98 61.33 3b8s s VAL 455 Cb -0.14 -2.35 -0.04 0.00 0.00 0.00 0.00 36.38 33.85 3b8s s VAL 455 CO 0.06 0.47 0.68 -0.22 0.00 0.00 0.00 175.10 176.10 3b8s s LEU 456 N 1.14 4.35 -0.03 3.92 2.96 -0.67 -0.80 118.68 129.55 3b8s s LEU 456 Ca 0.01 1.20 -0.18 0.00 -0.22 0.00 0.00 54.13 54.94 3b8s s LEU 456 Cb -0.14 -3.06 -0.05 0.00 0.50 0.00 0.00 46.19 43.43 3b8s s LEU 456 CO -0.03 -0.06 0.49 -0.83 -1.32 0.00 0.00 176.35 174.61 3b8s s GLY 457 N 0.54 2.50 0.07 7.98 0.00 -1.11 -1.25 107.32 116.05 3b8s s GLY 457 Ca 0.36 -0.12 0.05 0.00 0.00 0.00 0.00 44.72 45.01 3b8s s GLY 457 CO 0.18 0.55 -0.03 -0.51 0.00 0.00 0.00 173.10 173.29 3b8s s THR 458 N -0.26 3.86 -0.20 0.90 -4.23 0.37 -4.49 115.64 111.58 3b8s s THR 458 Ca 0.27 -0.98 -0.11 0.00 -1.18 0.00 0.00 61.69 59.68 3b8s s THR 458 Cb -0.17 -2.80 -0.05 0.00 1.34 0.00 0.00 72.50 70.82 3b8s s THR 458 CO 0.14 0.18 0.19 0.00 -0.54 0.00 0.00 174.62 174.58 3b8s s ALA 459 N -1.23 3.64 -0.46 3.99 0.00 -1.26 -2.64 121.76 123.80 3b8s s ALA 459 Ca 0.23 -0.68 0.04 0.00 0.00 0.00 0.00 51.96 51.55 3b8s s ALA 459 Cb -0.11 -2.29 0.63 0.00 0.00 0.00 0.00 23.12 21.35 3b8s s ALA 459 CO 0.15 0.02 1.89 -1.33 0.00 0.00 0.00 175.76 176.50 3b8s n MET 460 N 3.80 2.27 -3.64 0.00 2.81 -0.01 -4.08 117.12 118.27 3b8s n MET 460 Ca -0.14 -3.06 -0.10 0.00 -1.81 0.00 0.00 57.70 52.58 3b8s n MET 460 Cb 0.52 -2.16 -0.03 0.00 -0.71 0.00 0.00 33.22 30.84 3b8s n MET 460 CO 0.00 0.00 0.00 1.52 1.51 0.00 0.00 175.97 179.00 3b8s s TYR 461 N -3.35 -0.28 0.27 2.03 1.13 -1.26 -1.44 117.35 114.46 3b8s s TYR 461 Ca 0.57 -0.04 0.09 0.00 -1.41 0.00 0.00 57.07 56.28 3b8s s TYR 461 Cb 0.48 0.48 -0.04 0.00 -1.10 0.00 0.00 41.96 41.77 3b8s s TYR 461 CO 0.09 -0.92 0.01 0.20 -2.51 0.00 0.00 175.55 172.42 3b8s s GLY 462 N -2.83 1.68 0.12 5.49 0.00 0.14 -4.31 107.32 107.61 3b8s s GLY 462 Ca 0.06 -1.67 0.08 0.00 0.00 0.00 0.00 44.72 43.19 3b8s s GLY 462 CO -0.06 -1.72 -0.12 0.50 0.00 0.00 0.00 173.10 171.70 3b8s s ARG 463 N -3.69 2.03 0.10 2.90 0.52 -0.17 -1.33 118.95 119.31 3b8s s ARG 463 Ca 0.32 -1.11 -0.14 0.00 -0.52 0.00 0.00 55.73 54.28 3b8s s ARG 463 Cb -0.06 -2.23 0.02 0.00 0.52 0.00 0.00 34.95 33.20 3b8s s ARG 463 CO 0.20 0.49 0.33 0.20 0.02 0.00 0.00 175.30 176.54 3b8s s GLY 464 N -2.32 -0.16 0.32 -3.53 0.00 0.05 -0.52 107.32 101.18 3b8s s GLY 464 Ca 0.21 -0.16 0.03 0.00 0.00 0.00 0.00 44.72 44.81 3b8s s GLY 464 CO 0.13 -0.39 0.07 -0.98 0.00 0.00 0.00 173.10 171.93 3b8s s TRP 465 N -3.52 1.90 0.24 1.90 0.51 -0.07 -1.48 118.94 118.42 3b8s s TRP 465 Ca 0.02 -1.01 0.04 0.00 -2.12 0.00 0.00 56.10 53.03 3b8s s TRP 465 Cb 0.02 -1.23 -0.05 0.00 -0.81 0.00 0.00 33.47 31.40 3b8s s TRP 465 CO -0.10 -0.06 -0.01 -1.83 -0.51 0.00 0.00 176.95 174.44 3b8s s GLU 466 N -3.90 1.38 0.00 4.98 -1.05 -0.44 -1.62 118.70 118.05 3b8s s GLU 466 Ca 0.36 -1.70 0.00 0.00 -0.15 0.00 0.00 54.97 53.48 3b8s s GLU 466 Cb 0.08 -0.73 0.00 0.00 -0.44 0.00 0.00 34.13 33.05 3b8s s GLU 466 CO 0.15 -0.07 0.00 0.41 0.95 0.00 0.00 175.26 176.70 3b8s n GLY 467 N -0.45 0.72 3.03 -3.83 0.00 -0.89 -1.23 105.19 102.54 3b8s n GLY 467 Ca -0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 3b8s n GLY 467 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3b8s n VAL 468 N -2.49 3.85 -2.97 1.61 0.31 0.28 -4.24 118.33 114.68 3b8s n VAL 468 Ca 0.00 -3.75 -0.26 0.00 -0.01 0.00 0.00 64.34 60.32 3b8s n VAL 468 Cb 0.00 -2.48 -0.01 0.00 -0.91 0.00 0.00 33.84 30.44 3b8s n VAL 468 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 3b8s s THR 469 N 2.63 5.00 0.43 2.52 -4.23 -1.26 -4.39 115.64 116.34 3b8s s THR 469 Ca 0.46 -0.09 0.26 0.00 -1.18 0.00 0.00 61.69 61.14 3b8s s THR 469 Cb 0.09 -3.86 0.46 0.00 1.34 0.00 0.00 72.50 70.52 3b8s s THR 469 CO -0.02 -0.72 1.71 -0.65 -0.54 0.00 0.00 174.62 174.40 3b8s h PRO 470 N 0.47 0.21 0.00 3.99 0.11 -1.94 -0.97 132.00 133.86 3b8s h PRO 470 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3b8s h PRO 470 Cb 1.21 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3b8s h PRO 470 CO 0.62 0.14 0.00 -0.40 -0.21 0.00 0.00 178.00 178.14 3b8s n ASP 471 N -4.59 0.48 0.04 -2.05 5.75 -1.26 -2.73 116.55 112.19 3b8s n ASP 471 Ca 0.31 0.61 0.12 0.00 -0.01 0.00 0.00 54.79 55.81 3b8s n ASP 471 Cb 1.17 -0.71 0.12 0.00 -1.03 0.00 0.00 41.12 40.67 3b8s n ASP 471 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 3b8s n THR 472 N -2.02 0.24 -2.52 2.12 -2.24 -0.37 -4.95 114.28 104.54 3b8s n THR 472 Ca 0.03 -0.23 -0.41 0.00 -2.27 0.00 0.00 64.05 61.18 3b8s n THR 472 Cb 0.23 0.06 -0.04 0.00 -2.10 0.00 0.00 70.33 68.47 3b8s n THR 472 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3b8s s LEU 473 N -3.95 4.54 0.04 3.22 1.02 -1.10 -4.03 118.68 118.41 3b8s s LEU 473 Ca 0.06 2.17 0.15 0.00 0.02 0.00 0.00 54.13 56.53 3b8s s LEU 473 Cb 0.14 -3.62 -0.16 0.00 0.02 0.00 0.00 46.19 42.57 3b8s s LEU 473 CO 0.75 -0.14 0.82 0.71 0.02 0.00 0.00 176.35 178.51 3b8s h THR 474 N 3.34 0.69 -3.77 5.49 1.35 -1.85 -3.42 112.91 114.73 3b8s h THR 474 Ca -0.46 -2.31 -0.68 0.00 -0.55 0.00 0.00 66.41 62.42 3b8s h THR 474 Cb 1.21 2.22 -0.36 0.00 -1.73 0.00 0.00 68.15 69.49 3b8s h THR 474 CO 0.69 0.39 -0.73 -0.62 -0.25 0.00 0.00 175.52 175.00 3b8s s ASP 475 N -5.96 4.73 0.64 5.36 2.15 -1.26 -5.01 116.67 117.31 3b8s s ASP 475 Ca -0.03 -1.52 0.34 0.00 0.43 0.00 0.00 52.55 51.77 3b8s s ASP 475 Cb 0.08 -1.65 1.87 0.00 -0.30 0.00 0.00 42.92 42.93 3b8s s ASP 475 CO 0.81 -0.27 2.12 1.55 -0.17 0.00 0.00 175.17 179.21 3b8s h PRO 476 N 7.85 0.00 -0.20 4.34 0.13 -1.92 -0.88 132.00 141.32 3b8s h PRO 476 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 3b8s h PRO 476 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 3b8s h PRO 476 CO 0.52 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.38 3b8s n ASN 477 N -3.32 2.33 -3.63 1.44 3.02 -1.26 -4.79 115.26 109.06 3b8s n ASN 477 Ca -0.01 -1.80 -0.28 0.00 -0.03 0.00 0.00 54.58 52.46 3b8s n ASN 477 Cb 0.28 -0.13 -0.16 0.00 -0.61 0.00 0.00 39.78 39.16 3b8s n ASN 477 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3b8s s ASP 478 N -1.64 3.14 0.49 6.41 2.15 -0.34 -5.00 116.67 121.88 3b8s s ASP 478 Ca 0.34 -1.05 0.33 0.00 0.43 0.00 0.00 52.55 52.60 3b8s s ASP 478 Cb 0.20 -0.45 1.60 0.00 -0.30 0.00 0.00 42.92 43.97 3b8s s ASP 478 CO 0.29 -0.38 1.99 1.55 -0.17 0.00 0.00 175.17 178.45 3b8s h PRO 479 N 8.33 0.00 0.00 4.34 0.13 -1.87 -2.28 132.00 140.65 3b8s h PRO 479 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 3b8s h PRO 479 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 3b8s h PRO 479 CO 0.38 0.00 0.00 -1.33 -0.23 0.00 0.00 178.00 176.82 3b8s n MET 480 N -2.75 0.05 -0.07 0.86 2.81 -1.26 -1.96 117.12 114.81 3b8s n MET 480 Ca -0.01 0.24 0.12 0.00 -1.81 0.00 0.00 57.70 56.24 3b8s n MET 480 Cb 0.16 -1.50 0.23 0.00 -0.71 0.00 0.00 33.22 31.39 3b8s n MET 480 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 3b8s n THR 481 N -1.44 0.17 -1.56 2.03 -2.24 -0.86 -4.59 114.28 105.80 3b8s n THR 481 Ca 0.04 -0.52 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 3b8s n THR 481 Cb 0.15 1.07 0.00 0.00 -2.10 0.00 0.00 70.33 69.45 3b8s n THR 481 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3b8s n GLY 482 N 1.35 -0.20 2.91 3.38 0.00 -0.83 -3.08 105.19 108.72 3b8s n GLY 482 Ca 0.17 -1.81 -0.17 0.00 0.00 0.00 0.00 46.02 44.22 3b8s n GLY 482 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3b8s s THR 483 N -0.36 0.35 0.43 2.61 2.01 -1.26 -4.45 115.64 114.98 3b8s s THR 483 Ca 0.00 -0.12 -0.03 0.00 0.31 0.00 0.00 61.69 61.85 3b8s s THR 483 Cb 0.00 -0.35 -0.03 0.00 0.01 0.00 0.00 72.50 72.13 3b8s s THR 483 CO 0.00 0.13 0.70 0.00 -0.69 0.00 0.00 174.62 174.76 3b8s s ALA 484 N 0.32 3.52 -0.05 7.40 0.00 -0.71 -3.84 121.76 128.40 3b8s s ALA 484 Ca -0.03 -0.68 0.21 0.00 0.00 0.00 0.00 51.96 51.46 3b8s s ALA 484 Cb -0.07 -2.40 -0.32 0.00 0.00 0.00 0.00 23.12 20.33 3b8s s ALA 484 CO -0.00 -0.24 0.43 0.25 0.00 0.00 0.00 175.76 176.19 3b8s n THR 485 N -2.09 0.13 -3.61 0.00 -2.24 -0.36 -4.80 114.28 101.30 3b8s n THR 485 Ca -0.01 -0.52 0.00 0.00 -2.27 0.00 0.00 64.05 61.24 3b8s n THR 485 Cb 0.56 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 3b8s n THR 485 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3b8s n GLY 486 N 1.33 0.66 3.84 3.38 0.00 -1.15 -5.02 105.19 108.23 3b8s n GLY 486 Ca -0.07 -0.76 -0.32 0.00 0.00 0.00 0.00 46.02 44.88 3b8s n GLY 486 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3b8s s LYS 487 N -1.13 3.74 0.20 1.61 1.02 -1.26 -1.33 119.74 122.59 3b8s s LYS 487 Ca 0.00 0.94 -0.31 0.00 0.02 0.00 0.00 55.97 56.62 3b8s s LYS 487 Cb 0.00 -2.10 -0.10 0.00 -0.52 0.00 0.00 37.83 35.11 3b8s s LYS 487 CO 0.00 -0.45 1.49 -1.17 -0.92 0.00 0.00 175.35 174.30 3b8s s LEU 488 N -4.45 4.38 0.18 3.17 2.96 -0.55 -3.92 118.68 120.44 3b8s s LEU 488 Ca 0.59 2.62 0.08 0.00 -0.22 0.00 0.00 54.13 57.19 3b8s s LEU 488 Cb -0.11 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 3b8s s LEU 488 CO 0.38 -0.75 -0.03 -0.54 -1.32 0.00 0.00 176.35 174.09 3b8s s LYS 489 N 0.37 2.28 -0.04 1.98 3.01 -1.26 0.07 119.74 126.14 3b8s s LYS 489 Ca 0.64 -1.18 -0.22 0.00 -1.01 0.00 0.00 55.97 54.20 3b8s s LYS 489 Cb -0.42 -2.28 0.07 0.00 -1.01 0.00 0.00 37.83 34.19 3b8s s LYS 489 CO 0.37 0.44 0.97 0.41 0.51 0.00 0.00 175.35 178.05 3b8s n GLY 490 N -0.12 0.25 3.94 -3.33 0.00 -1.26 -5.01 105.19 99.65 3b8s n GLY 490 Ca -0.10 -0.97 -0.20 0.00 0.00 0.00 0.00 46.02 44.75 3b8s n GLY 490 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3b8s s SER 491 N -3.12 5.87 0.45 1.61 1.04 -1.26 -4.85 113.70 113.44 3b8s s SER 491 Ca 0.23 -0.19 0.18 0.00 0.48 0.00 0.00 55.95 56.64 3b8s s SER 491 Cb -0.00 -1.37 1.06 0.00 0.10 0.00 0.00 66.02 65.81 3b8s s SER 491 CO -0.01 -0.27 1.98 0.71 0.98 0.00 0.00 173.24 176.62 3b8s h THR 492 N 1.11 1.01 -0.13 2.02 1.35 -1.94 -1.31 112.91 115.02 3b8s h THR 492 Ca -0.48 -0.74 -0.00 0.00 -0.55 0.00 0.00 66.41 64.64 3b8s h THR 492 Cb 1.25 1.42 -0.01 0.00 -1.73 0.00 0.00 68.15 69.08 3b8s h THR 492 CO 0.57 0.20 0.06 0.00 -0.25 0.00 0.00 175.52 176.10 3b8s h ALA 493 N 1.79 1.86 -0.01 6.62 0.00 -1.95 -1.16 119.26 126.42 3b8s h ALA 493 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3b8s h ALA 493 Cb 0.40 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3b8s h ALA 493 CO 0.03 0.12 -0.03 1.04 0.00 0.00 0.00 179.25 180.40 3b8s n GLN 494 N -4.49 1.33 -0.72 0.00 6.02 -0.57 -4.91 117.38 114.04 3b8s n GLN 494 Ca -0.01 -0.61 0.00 0.00 -0.01 0.00 0.00 57.00 56.37 3b8s n GLN 494 Cb 0.10 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 29.87 3b8s n GLN 494 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3b8s n GLY 495 N 1.15 0.57 3.33 1.08 0.00 -0.44 -4.20 105.19 106.68 3b8s n GLY 495 Ca 0.19 -0.68 -0.46 0.00 0.00 0.00 0.00 46.02 45.07 3b8s n GLY 495 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3b8s s VAL 496 N -2.00 5.33 -0.17 1.61 1.01 -0.73 -1.11 120.40 124.34 3b8s s VAL 496 Ca 0.00 -1.86 0.22 0.00 0.00 0.00 0.00 61.98 60.34 3b8s s VAL 496 Cb 0.00 -4.41 -0.11 0.00 0.00 0.00 0.00 36.38 31.86 3b8s s VAL 496 CO 0.00 -0.97 0.86 0.79 0.00 0.00 0.00 175.10 175.78 3b8s n TRP 497 N 4.85 0.69 -3.82 5.22 7.02 -1.26 -3.33 117.44 126.81 3b8s n TRP 497 Ca -0.02 0.20 -0.12 0.00 -1.02 0.00 0.00 57.50 56.54 3b8s n TRP 497 Cb 0.43 -0.84 -0.12 0.00 -2.42 0.00 0.00 31.31 28.36 3b8s n TRP 497 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 3b8s s GLU 498 N -3.37 0.22 0.27 -0.99 2.12 -1.26 -5.06 118.70 110.62 3b8s s GLU 498 Ca -0.03 0.19 -0.30 0.00 0.36 0.00 0.00 54.97 55.19 3b8s s GLU 498 Cb 0.11 0.10 -0.13 0.00 0.26 0.00 0.00 34.13 34.47 3b8s s GLU 498 CO 0.83 -0.03 1.46 -0.25 -0.54 0.00 0.00 175.26 176.73 3b8s n ASP 499 N 2.88 3.17 0.00 -1.70 8.00 -1.26 -2.33 116.55 125.31 3b8s n ASP 499 Ca -0.13 1.15 0.00 0.00 0.71 0.00 0.00 54.79 56.52 3b8s n ASP 499 Cb 0.59 -1.50 0.00 0.00 -0.02 0.00 0.00 41.12 40.19 3b8s n ASP 499 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3b8s n GLY 500 N 1.97 0.84 3.04 0.44 0.00 0.11 -4.85 105.19 106.74 3b8s n GLY 500 Ca 0.10 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.92 3b8s n GLY 500 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3b8s s VAL 501 N -3.31 0.79 -0.13 1.61 1.01 -0.98 -0.77 120.40 118.62 3b8s s VAL 501 Ca 0.00 -0.43 -0.08 0.00 0.00 0.00 0.00 61.98 61.47 3b8s s VAL 501 Cb 0.00 -0.66 0.05 0.00 0.00 0.00 0.00 36.38 35.77 3b8s s VAL 501 CO 0.00 0.22 0.31 -0.51 0.00 0.00 0.00 175.10 175.12 3b8s s ILE 502 N -0.24 -0.03 0.37 2.22 2.07 -0.44 -4.18 121.20 120.97 3b8s s ILE 502 Ca 0.04 0.11 -0.26 0.00 -1.41 0.00 0.00 60.65 59.12 3b8s s ILE 502 Cb -0.04 -0.47 -0.12 0.00 0.13 0.00 0.00 42.46 41.97 3b8s s ILE 502 CO -0.00 0.04 1.11 0.47 -1.91 0.00 0.00 174.94 174.65 3b8s n ASP 503 N 4.04 1.81 -0.31 4.50 8.00 -0.26 0.25 116.55 134.57 3b8s n ASP 503 Ca -0.23 1.12 0.03 0.00 0.71 0.00 0.00 54.79 56.42 3b8s n ASP 503 Cb 0.55 -1.39 0.18 0.00 -0.02 0.00 0.00 41.12 40.43 3b8s n ASP 503 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 3b8s h TYR 504 N 1.95 0.93 0.00 1.24 3.20 -1.01 -1.05 116.97 122.23 3b8s h TYR 504 Ca -0.44 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.43 3b8s h TYR 504 Cb 1.32 -0.29 -0.00 0.00 1.54 0.00 0.00 36.73 39.30 3b8s h TYR 504 CO 0.47 0.39 -0.13 1.57 -1.64 0.00 0.00 178.16 178.82 3b8s h LYS 505 N 0.86 0.00 -0.32 1.82 2.10 -1.44 -0.37 116.57 119.21 3b8s h LYS 505 Ca 0.41 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.98 3b8s h LYS 505 Cb 0.36 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.68 3b8s h LYS 505 CO -0.24 0.13 -0.10 0.78 -2.00 0.00 0.00 179.45 178.02 3b8s h GLY 506 N 0.48 0.69 0.96 0.07 0.00 -1.40 -2.11 103.07 101.77 3b8s h GLY 506 Ca -0.00 -0.59 0.01 0.00 0.00 0.00 0.00 47.33 46.75 3b8s h GLY 506 CO 0.02 0.54 0.20 -2.22 0.00 0.00 0.00 176.54 175.08 3b8s h ILE 507 N 0.41 1.06 -0.12 2.60 2.04 -0.37 -0.60 117.51 122.54 3b8s h ILE 507 Ca 0.08 -0.14 0.01 0.00 1.00 0.00 0.00 64.86 65.81 3b8s h ILE 507 Cb 0.61 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 3b8s h ILE 507 CO 0.04 0.08 0.04 0.50 0.00 0.00 0.00 178.15 178.80 3b8s h LYS 508 N 0.41 0.10 0.00 2.37 1.63 -1.15 0.12 116.57 120.05 3b8s h LYS 508 Ca 0.12 -0.01 -0.10 0.00 -0.85 0.00 0.00 60.65 59.81 3b8s h LYS 508 Cb -0.02 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.57 3b8s h LYS 508 CO -0.05 0.07 -0.50 0.77 -3.45 0.00 0.00 179.45 176.29 3b8s h SER 509 N 0.10 0.00 0.00 4.20 0.02 -1.22 0.45 113.55 117.10 3b8s h SER 509 Ca 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 3b8s h SER 509 Cb 0.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.57 3b8s h SER 509 CO -0.05 0.50 -0.14 0.49 -1.14 0.00 0.00 176.83 176.48 3b8s n PHE 510 N -3.55 0.00 0.00 3.45 3.72 -0.25 -4.68 117.46 116.15 3b8s n PHE 510 Ca -0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 3b8s n PHE 510 Cb 0.59 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.13 3b8s n PHE 510 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 3b8s n MET 511 N -1.00 0.90 -0.10 -1.08 2.81 0.23 -4.53 117.12 114.35 3b8s n MET 511 Ca 0.00 0.00 -0.19 0.00 -1.81 0.00 0.00 57.70 55.70 3b8s n MET 511 Cb 0.00 -0.76 -0.11 0.00 -0.71 0.00 0.00 33.22 31.65 3b8s n MET 511 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 3b8s h LEU 512 N 0.00 0.00 -0.00 4.03 3.38 -1.10 0.27 115.31 121.89 3b8s h LEU 512 Ca 0.00 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 57.46 3b8s h LEU 512 Cb 0.52 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 3b8s h LEU 512 CO 0.00 1.35 -0.00 0.61 0.09 0.00 0.00 178.44 180.49 3b8s n GLY 513 N 1.48 -1.54 0.37 0.83 0.00 0.15 -1.52 105.19 104.94 3b8s n GLY 513 Ca -0.27 -1.52 0.06 0.00 0.00 0.00 0.00 46.02 44.29 3b8s n GLY 513 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3b8s h ALA 514 N -0.00 1.51 -0.38 4.61 0.00 -1.95 -2.58 119.26 120.47 3b8s h ALA 514 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3b8s h ALA 514 Cb 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.55 3b8s h ALA 514 CO 0.00 0.28 0.00 0.09 0.00 0.00 0.00 179.25 179.62 3b8s n ASN 515 N -4.56 3.32 -1.94 0.00 4.13 -1.26 -4.96 115.26 109.98 3b8s n ASN 515 Ca 0.17 -1.97 -0.21 0.00 1.68 0.00 0.00 54.58 54.25 3b8s n ASN 515 Cb 0.29 -0.25 -0.05 0.00 -1.54 0.00 0.00 39.78 38.23 3b8s n ASN 515 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 3b8s n ASN 516 N 1.39 -5.67 -0.34 6.41 5.03 -0.97 -4.86 115.26 116.26 3b8s n ASN 516 Ca 0.19 0.27 0.12 0.00 0.87 0.00 0.00 54.58 56.03 3b8s n ASN 516 Cb 0.58 -4.85 0.18 0.00 -1.02 0.00 0.00 39.78 34.68 3b8s n ASN 516 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 3b8s n THR 517 N -3.15 0.00 0.00 3.41 -2.24 -1.18 -4.66 114.28 106.46 3b8s n THR 517 Ca -0.22 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 3b8s n THR 517 Cb 0.68 0.80 0.00 0.00 -2.10 0.00 0.00 70.33 69.71 3b8s n THR 517 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3b8s n GLY 518 N 1.39 1.84 3.24 3.38 0.00 -0.58 -4.28 105.19 110.18 3b8s n GLY 518 Ca 0.10 -1.44 -0.13 0.00 0.00 0.00 0.00 46.02 44.54 3b8s n GLY 518 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3b8s s ILE 519 N -0.30 0.45 -1.44 -0.61 -4.36 0.08 -4.82 121.20 110.20 3b8s s ILE 519 Ca 0.00 -1.97 -0.10 0.00 -0.26 0.00 0.00 60.65 58.32 3b8s s ILE 519 Cb 0.00 -2.30 0.06 0.00 1.25 0.00 0.00 42.46 41.47 3b8s s ILE 519 CO 0.00 -0.28 0.71 0.59 0.24 0.00 0.00 174.94 176.20 3b8s n ASN 520 N -0.28 -4.86 0.00 4.36 3.02 -1.26 -1.79 115.26 114.45 3b8s n ASN 520 Ca -0.03 -0.49 0.00 0.00 -0.03 0.00 0.00 54.58 54.03 3b8s n ASN 520 Cb 0.64 -3.93 0.00 0.00 -0.61 0.00 0.00 39.78 35.88 3b8s n ASN 520 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3b8s n GLY 521 N -1.47 0.63 3.87 7.41 0.00 -1.26 -5.05 105.19 109.32 3b8s n GLY 521 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 3b8s n GLY 521 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3b8s s PHE 522 N -2.29 3.55 0.07 1.61 0.40 -0.74 -4.29 117.98 116.30 3b8s s PHE 522 Ca 0.00 0.77 0.06 0.00 -0.60 0.00 0.00 56.93 57.16 3b8s s PHE 522 Cb 0.00 -2.15 -0.04 0.00 0.51 0.00 0.00 43.02 41.34 3b8s s PHE 522 CO 0.00 0.48 -0.08 -1.83 0.70 0.00 0.00 175.22 174.49 3b8s s GLU 523 N -2.11 2.30 0.19 0.44 -1.05 0.85 -3.24 118.70 116.08 3b8s s GLU 523 Ca 0.36 -0.92 -0.15 0.00 -0.15 0.00 0.00 54.97 54.11 3b8s s GLU 523 Cb -0.13 -2.39 -0.07 0.00 -0.44 0.00 0.00 34.13 31.09 3b8s s GLU 523 CO 0.19 0.54 0.59 -0.47 0.95 0.00 0.00 175.26 177.07 3b8s s TYR 524 N -1.17 3.57 0.13 4.83 6.14 -1.26 -0.51 117.35 129.08 3b8s s TYR 524 Ca 0.21 1.10 -0.06 0.00 0.64 0.00 0.00 57.07 58.96 3b8s s TYR 524 Cb -0.11 -2.41 -0.02 0.00 0.42 0.00 0.00 41.96 39.84 3b8s s TYR 524 CO 0.13 0.36 0.18 0.20 0.64 0.00 0.00 175.55 177.06 3b8s s GLY 525 N -1.85 0.48 -0.12 8.97 0.00 0.21 -4.96 107.32 110.06 3b8s s GLY 525 Ca 0.41 -0.96 -0.06 0.00 0.00 0.00 0.00 44.72 44.11 3b8s s GLY 525 CO 0.20 -0.98 0.27 -0.47 0.00 0.00 0.00 173.10 172.11 3b8s s TYR 526 N -3.95 -0.38 -0.61 1.90 5.04 -1.26 -0.73 117.35 117.36 3b8s s TYR 526 Ca 0.14 0.89 -0.24 0.00 -2.44 0.00 0.00 57.07 55.42 3b8s s TYR 526 Cb 0.05 0.06 0.05 0.00 0.35 0.00 0.00 41.96 42.46 3b8s s TYR 526 CO -0.03 -0.27 1.01 0.34 -1.34 0.00 0.00 175.55 175.25 3b8s s ASP 527 N 1.55 6.28 0.48 4.32 -1.08 0.45 -4.90 116.67 123.77 3b8s s ASP 527 Ca -0.07 -0.51 0.23 0.00 -0.52 0.00 0.00 52.55 51.68 3b8s s ASP 527 Cb -0.11 -2.46 1.22 0.00 -1.46 0.00 0.00 42.92 40.12 3b8s s ASP 527 CO -0.09 -1.38 2.00 0.00 0.52 0.00 0.00 175.17 176.22 3b8s h ALA 528 N 9.49 1.34 0.18 3.66 0.00 -1.98 0.59 119.26 132.55 3b8s h ALA 528 Ca -0.27 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 3b8s h ALA 528 Cb 1.07 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.83 3b8s h ALA 528 CO 1.15 0.22 -0.09 1.96 0.00 0.00 0.00 179.25 182.49 3b8s h GLN 529 N 0.00 -0.24 0.00 0.00 4.20 -1.90 -3.35 115.11 113.82 3b8s h GLN 529 Ca -0.00 0.02 -0.06 0.00 0.06 0.00 0.00 58.65 58.67 3b8s h GLN 529 Cb 0.41 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 3b8s h GLN 529 CO 0.02 0.12 -0.27 0.00 -0.67 0.00 0.00 178.83 178.03 3b8s h ALA 530 N -0.54 1.19 -4.83 3.87 0.00 -1.65 -3.41 119.26 113.89 3b8s h ALA 530 Ca -0.03 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 3b8s h ALA 530 Cb 0.47 -0.04 0.04 0.00 0.00 0.00 0.00 17.79 18.26 3b8s h ALA 530 CO 0.04 0.34 -0.17 0.39 0.00 0.00 0.00 179.25 179.85 3b8s n GLU 531 N -3.70 -1.20 -3.66 0.00 -0.58 0.17 -1.10 120.64 110.59 3b8s n GLU 531 Ca -0.01 1.11 -0.06 0.00 -0.42 0.00 0.00 57.16 57.77 3b8s n GLU 531 Cb 0.39 -4.78 -0.08 0.00 -0.57 0.00 0.00 31.44 26.40 3b8s n GLU 531 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3b8s s ALA 532 N -3.08 -1.46 0.47 0.62 0.00 -1.05 -4.03 121.76 113.22 3b8s s ALA 532 Ca 0.09 1.82 -0.09 0.00 0.00 0.00 0.00 51.96 53.78 3b8s s ALA 532 Cb -0.01 -1.43 -0.05 0.00 0.00 0.00 0.00 23.12 21.62 3b8s s ALA 532 CO 0.57 -0.74 0.82 -1.25 0.00 0.00 0.00 175.76 175.16 3b8s s PRO 533 N 2.53 3.67 0.06 0.00 0.04 -1.26 -0.41 135.00 139.64 3b8s s PRO 533 Ca -0.04 0.43 -0.05 0.00 0.04 0.00 0.00 61.00 61.38 3b8s s PRO 533 Cb -0.11 -2.33 -0.02 0.00 0.04 0.00 0.00 34.50 32.08 3b8s s PRO 533 CO -0.15 -0.18 0.08 1.67 0.04 0.00 0.00 177.00 178.46 3b8s s TRP 534 N -2.63 0.30 -0.02 0.56 1.48 0.09 -3.49 118.94 115.24 3b8s s TRP 534 Ca 0.51 -0.75 0.07 0.00 -1.06 0.00 0.00 56.10 54.87 3b8s s TRP 534 Cb -0.10 -0.21 -0.02 0.00 -1.16 0.00 0.00 33.47 31.98 3b8s s TRP 534 CO 0.39 -0.43 -0.24 0.14 -4.06 0.00 0.00 176.95 172.75 3b8s s VAL 535 N -3.54 2.25 -0.04 -0.66 -7.23 -0.95 -0.61 120.40 109.62 3b8s s VAL 535 Ca 0.03 -1.04 -0.01 0.00 -1.81 0.00 0.00 61.98 59.15 3b8s s VAL 535 Cb 0.04 -1.80 0.03 0.00 0.56 0.00 0.00 36.38 35.21 3b8s s VAL 535 CO -0.09 0.58 0.02 0.86 -0.31 0.00 0.00 175.10 176.16 3b8s s TRP 536 N -0.64 0.29 -0.48 2.82 -0.00 0.34 -1.31 118.94 119.95 3b8s s TRP 536 Ca 0.10 0.06 -0.15 0.00 -0.00 0.00 0.00 56.10 56.12 3b8s s TRP 536 Cb -0.10 -0.50 0.08 0.00 -0.00 0.00 0.00 33.47 32.95 3b8s s TRP 536 CO -0.01 -0.19 0.39 1.21 -0.00 0.00 0.00 176.95 178.36 3b8s s ASN 537 N 1.60 6.08 0.30 5.86 3.84 0.96 -0.10 114.94 133.47 3b8s s ASN 537 Ca -0.02 -1.44 -0.02 0.00 0.21 0.00 0.00 52.86 51.59 3b8s s ASN 537 Cb -0.13 -2.16 0.44 0.00 -0.55 0.00 0.00 41.25 38.85 3b8s s ASN 537 CO -0.03 -0.67 1.93 0.03 -2.79 0.00 0.00 177.10 175.57 3b8s h ARG 538 N 8.72 1.01 -0.11 0.43 3.08 -1.84 0.42 114.38 126.10 3b8s h ARG 538 Ca -0.28 -0.10 -0.04 0.00 0.07 0.00 0.00 59.98 59.64 3b8s h ARG 538 Cb 1.10 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 30.94 3b8s h ARG 538 CO 0.89 0.72 -0.08 0.77 -1.07 0.00 0.00 179.97 181.20 3b8s h SER 539 N 1.03 0.26 1.31 7.04 0.02 -1.94 -3.22 113.55 118.05 3b8s h SER 539 Ca 0.27 -0.46 0.00 0.00 -0.84 0.00 0.00 61.79 60.76 3b8s h SER 539 Cb -0.02 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.45 3b8s h SER 539 CO -0.05 0.66 -0.62 0.71 -1.14 0.00 0.00 176.83 176.40 3b8s h THR 540 N -0.15 0.00 -0.10 -2.27 1.35 -1.94 -3.48 112.91 106.32 3b8s h THR 540 Ca 0.02 -0.93 -0.04 0.00 -0.55 0.00 0.00 66.41 64.91 3b8s h THR 540 Cb 0.58 1.61 -0.02 0.00 -1.73 0.00 0.00 68.15 68.59 3b8s h THR 540 CO 0.02 0.00 -0.04 0.61 -0.25 0.00 0.00 175.52 175.86 3b8s n GLY 541 N 1.18 0.55 3.70 5.82 0.00 0.15 -2.09 105.19 114.49 3b8s n GLY 541 Ca 0.02 -0.48 -0.42 0.00 0.00 0.00 0.00 46.02 45.13 3b8s n GLY 541 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3b8s s GLU 542 N -1.42 4.32 -0.03 1.61 2.02 -0.97 -0.56 118.70 123.67 3b8s s GLU 542 Ca 0.00 1.93 -0.00 0.00 0.02 0.00 0.00 54.97 56.92 3b8s s GLU 542 Cb 0.00 -3.47 0.03 0.00 0.10 0.00 0.00 34.13 30.79 3b8s s GLU 542 CO 0.00 -0.49 0.02 -1.17 0.02 0.00 0.00 175.26 173.64 3b8s s LEU 543 N 1.90 0.94 -0.07 1.80 2.96 -0.64 -0.03 118.68 125.54 3b8s s LEU 543 Ca 0.62 -0.00 0.03 0.00 -0.22 0.00 0.00 54.13 54.57 3b8s s LEU 543 Cb -0.32 -0.20 0.00 0.00 0.50 0.00 0.00 46.19 46.18 3b8s s LEU 543 CO 0.27 -0.14 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.36 3b8s s ILE 544 N 1.29 1.56 -0.15 6.68 1.01 -0.43 -0.89 121.20 130.27 3b8s s ILE 544 Ca -0.06 -0.74 -0.02 0.00 0.00 0.00 0.00 60.65 59.83 3b8s s ILE 544 Cb -0.13 -1.37 -0.02 0.00 0.01 0.00 0.00 42.46 40.95 3b8s s ILE 544 CO -0.02 0.45 -0.07 0.28 0.00 0.00 0.00 174.94 175.57 3b8s s THR 545 N 0.41 3.58 0.11 2.92 -1.32 0.32 -2.25 115.64 119.42 3b8s s THR 545 Ca -0.14 -0.47 -0.02 0.00 -1.21 0.00 0.00 61.69 59.85 3b8s s THR 545 Cb -0.16 -2.55 0.01 0.00 -1.51 0.00 0.00 72.50 68.29 3b8s s THR 545 CO 0.05 0.50 0.19 2.22 -2.21 0.00 0.00 174.62 175.38 3b8s n PHE 546 N 3.55 -1.08 -4.42 9.09 -1.74 -1.23 -1.00 117.46 120.63 3b8s n PHE 546 Ca -0.18 -0.61 -0.34 0.00 -0.56 0.00 0.00 57.45 55.76 3b8s n PHE 546 Cb 0.53 0.22 -0.10 0.00 1.52 0.00 0.00 39.48 41.64 3b8s n PHE 546 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 3b8s s ASP 547 N -1.62 5.02 0.21 5.98 1.01 -1.26 -4.07 116.67 121.94 3b8s s ASP 547 Ca 0.06 0.05 0.02 0.00 0.71 0.00 0.00 52.55 53.39 3b8s s ASP 547 Cb -0.01 -1.34 -0.01 0.00 1.01 0.00 0.00 42.92 42.58 3b8s s ASP 547 CO 0.05 0.35 0.08 -0.90 0.21 0.00 0.00 175.17 174.95 3b8s n ASP 548 N 1.95 1.07 -0.17 0.27 5.75 -1.26 -4.92 116.55 119.24 3b8s n ASP 548 Ca -0.17 -2.11 -0.04 0.00 -0.01 0.00 0.00 54.79 52.46 3b8s n ASP 548 Cb 0.53 0.53 0.03 0.00 -1.03 0.00 0.00 41.12 41.18 3b8s n ASP 548 CO 0.00 0.00 0.00 -0.74 -0.11 0.00 0.00 177.20 176.35 3b8s h HIS 549 N 1.35 -0.58 -0.23 2.11 -0.00 -1.96 -0.66 115.15 115.17 3b8s h HIS 549 Ca -0.16 0.06 -0.01 0.00 -0.00 0.00 0.00 60.37 60.26 3b8s h HIS 549 Cb 0.62 0.34 -0.01 0.00 -0.00 0.00 0.00 27.41 28.35 3b8s h HIS 549 CO 0.00 -0.31 0.10 -0.09 -0.00 0.00 0.00 177.93 177.63 3b8s h ARG 550 N -0.11 0.34 -0.12 5.26 2.43 -1.99 -1.14 114.38 119.05 3b8s h ARG 550 Ca 0.24 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.24 3b8s h ARG 550 Cb 0.48 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 3b8s h ARG 550 CO -0.60 0.36 -0.45 0.66 -1.51 0.00 0.00 179.97 178.43 3b8s h SER 551 N 0.23 0.31 -0.39 -3.80 4.64 -1.77 -2.18 113.55 110.60 3b8s h SER 551 Ca 0.08 -0.14 -0.15 0.00 -0.47 0.00 0.00 61.79 61.11 3b8s h SER 551 Cb 0.14 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 3b8s h SER 551 CO -0.01 0.72 -0.35 0.58 -0.87 0.00 0.00 176.83 176.91 3b8s h VAL 552 N 0.24 1.27 -0.76 0.95 2.07 -1.00 -2.06 116.25 116.96 3b8s h VAL 552 Ca 0.02 -1.52 0.03 0.00 0.82 0.00 0.00 66.70 66.04 3b8s h VAL 552 Cb 0.89 1.36 -0.05 0.00 -1.52 0.00 0.00 31.29 31.98 3b8s h VAL 552 CO 0.07 0.51 0.49 -0.07 0.02 0.00 0.00 177.57 178.59 3b8s h LEU 553 N 0.74 0.81 -0.80 2.57 3.38 -1.06 -0.29 115.31 120.67 3b8s h LEU 553 Ca 0.07 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.05 3b8s h LEU 553 Cb 0.94 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.46 3b8s h LEU 553 CO 0.09 0.56 0.52 0.00 0.09 0.00 0.00 178.44 179.70 3b8s h ALA 554 N 1.32 1.04 -0.43 1.53 0.00 -1.28 0.07 119.26 121.51 3b8s h ALA 554 Ca 0.30 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 3b8s h ALA 554 Cb -0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 3b8s h ALA 554 CO -0.10 0.37 0.15 0.87 0.00 0.00 0.00 179.25 180.54 3b8s h LYS 555 N 1.04 0.65 -0.57 0.00 1.57 -0.73 -0.97 116.57 117.55 3b8s h LYS 555 Ca 0.31 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.96 3b8s h LYS 555 Cb -0.05 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.13 3b8s h LYS 555 CO -0.09 0.61 0.34 0.78 -0.57 0.00 0.00 179.45 180.52 3b8s h GLY 556 N 0.54 0.83 1.18 3.86 0.00 -0.67 -0.20 103.07 108.62 3b8s h GLY 556 Ca 0.14 -0.35 -0.05 0.00 0.00 0.00 0.00 47.33 47.06 3b8s h GLY 556 CO -0.01 0.34 0.22 3.43 0.00 0.00 0.00 176.54 180.52 3b8s h ASN 557 N 0.77 0.96 -0.68 0.19 4.21 -0.90 -1.70 115.58 118.43 3b8s h ASN 557 Ca 0.20 -0.16 -0.03 0.00 1.21 0.00 0.00 56.30 57.52 3b8s h ASN 557 Cb -0.00 -0.25 -0.03 0.00 -1.12 0.00 0.00 38.32 36.92 3b8s h ASN 557 CO -0.04 0.89 0.30 0.22 -1.29 0.00 0.00 177.43 177.51 3b8s h TYR 558 N 1.00 1.01 -0.44 1.19 3.20 -0.86 -1.99 116.97 120.08 3b8s h TYR 558 Ca 0.22 -0.06 -0.07 0.00 3.14 0.00 0.00 58.73 61.96 3b8s h TYR 558 Cb 0.27 -0.31 -0.02 0.00 1.54 0.00 0.00 36.73 38.22 3b8s h TYR 558 CO 0.02 0.77 -0.00 0.00 -1.64 0.00 0.00 178.16 177.31 3b8s h ALA 559 N 1.14 0.59 -0.43 1.82 0.00 -0.69 -2.51 119.26 119.17 3b8s h ALA 559 Ca 0.23 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3b8s h ALA 559 Cb 0.16 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3b8s h ALA 559 CO -0.02 0.38 0.24 0.87 0.00 0.00 0.00 179.25 180.72 3b8s h LYS 560 N 0.61 0.60 -0.49 0.00 1.57 -1.28 0.13 116.57 117.71 3b8s h LYS 560 Ca 0.12 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 3b8s h LYS 560 Cb 0.49 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 3b8s h LYS 560 CO 0.02 0.47 0.21 0.77 -0.57 0.00 0.00 179.45 180.35 3b8s h SER 561 N 0.56 0.62 0.26 0.86 0.02 -1.24 -2.69 113.55 111.94 3b8s h SER 561 Ca 0.15 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3b8s h SER 561 Cb 0.04 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.42 3b8s h SER 561 CO -0.03 0.55 -0.67 0.18 -1.14 0.00 0.00 176.83 175.72 3b8s n LEU 562 N -4.36 0.81 -1.42 5.07 4.77 -0.96 -4.97 117.00 115.94 3b8s n LEU 562 Ca 0.04 -0.25 -0.09 0.00 -0.03 0.00 0.00 56.01 55.67 3b8s n LEU 562 Cb 0.14 -0.13 0.02 0.00 -2.33 0.00 0.00 43.42 41.12 3b8s n LEU 562 CO 0.37 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 3b8s n GLY 563 N 1.48 0.18 3.74 -0.72 0.00 -0.60 -4.82 105.19 104.44 3b8s n GLY 563 Ca 0.06 -0.40 -0.32 0.00 0.00 0.00 0.00 46.02 45.36 3b8s n GLY 563 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3b8s s LEU 564 N -3.12 3.10 0.47 0.99 1.43 -0.07 -3.17 118.68 118.31 3b8s s LEU 564 Ca 0.13 2.05 0.12 0.00 -1.03 0.00 0.00 54.13 55.40 3b8s s LEU 564 Cb -0.06 -4.55 1.08 0.00 0.03 0.00 0.00 46.19 42.69 3b8s s LEU 564 CO 0.16 -2.28 2.09 0.00 0.23 0.00 0.00 176.35 176.55 3b8s h ALA 565 N -0.97 1.90 0.00 4.21 0.00 -0.77 -3.46 119.26 120.17 3b8s h ALA 565 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3b8s h ALA 565 Cb 1.25 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3b8s h ALA 565 CO 0.49 0.08 0.00 0.41 0.00 0.00 0.00 179.25 180.22 3b8s n GLY 566 N -1.51 -0.01 3.23 0.00 0.00 -1.25 -1.76 105.19 103.89 3b8s n GLY 566 Ca 0.01 -1.08 -0.20 0.00 0.00 0.00 0.00 46.02 44.76 3b8s n GLY 566 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3b8s s LEU 567 N 0.00 2.34 0.18 0.99 1.43 0.64 -1.66 118.68 122.60 3b8s s LEU 567 Ca 0.00 -0.72 -0.00 0.00 -1.03 0.00 0.00 54.13 52.38 3b8s s LEU 567 Cb 0.00 -0.62 -0.04 0.00 0.03 0.00 0.00 46.19 45.55 3b8s s LEU 567 CO 0.00 -0.07 0.08 0.72 0.23 0.00 0.00 176.35 177.30 3b8s s PHE 568 N -1.62 1.15 0.02 0.29 -0.71 -0.38 -0.51 117.98 116.22 3b8s s PHE 568 Ca 0.05 -1.23 -0.03 0.00 -1.04 0.00 0.00 56.93 54.68 3b8s s PHE 568 Cb -0.08 -0.63 -0.01 0.00 -1.21 0.00 0.00 43.02 41.09 3b8s s PHE 568 CO 0.03 -0.46 0.04 -1.54 -1.34 0.00 0.00 175.22 171.95 3b8s s SER 569 N -3.16 0.18 -0.07 1.98 1.04 -0.34 -0.48 113.70 112.85 3b8s s SER 569 Ca 0.31 -0.45 -0.00 0.00 0.48 0.00 0.00 55.95 56.29 3b8s s SER 569 Cb 0.07 0.16 0.02 0.00 0.10 0.00 0.00 66.02 66.37 3b8s s SER 569 CO 0.08 -0.37 -0.04 0.86 0.98 0.00 0.00 173.24 174.74 3b8s s TRP 570 N -1.78 0.93 0.04 5.02 -0.11 -1.08 -1.80 118.94 120.16 3b8s s TRP 570 Ca -0.12 -0.33 0.06 0.00 1.22 0.00 0.00 56.10 56.92 3b8s s TRP 570 Cb -0.07 -0.88 -0.02 0.00 -1.50 0.00 0.00 33.47 31.00 3b8s s TRP 570 CO -0.01 -0.33 -0.16 -1.83 -4.62 0.00 0.00 176.95 169.99 3b8s s GLU 571 N 1.52 1.09 0.56 5.86 -1.05 -1.26 -0.83 118.70 124.60 3b8s s GLU 571 Ca -0.01 -0.83 0.25 0.00 -0.15 0.00 0.00 54.97 54.23 3b8s s GLU 571 Cb -0.13 -1.14 1.56 0.00 -0.44 0.00 0.00 34.13 33.98 3b8s s GLU 571 CO -0.04 0.28 2.13 -0.84 0.95 0.00 0.00 175.26 177.74 3b8s h ILE 572 N 4.44 0.65 0.00 1.83 -0.00 -1.71 -1.34 117.51 121.38 3b8s h ILE 572 Ca -0.40 0.00 -0.02 0.00 -0.00 0.00 0.00 64.86 64.44 3b8s h ILE 572 Cb 1.17 0.89 -0.00 0.00 -0.00 0.00 0.00 36.82 38.88 3b8s h ILE 572 CO 0.44 0.00 -0.09 -2.24 -0.00 0.00 0.00 178.15 176.25 3b8s h ASP 573 N 0.00 0.00 0.45 2.16 3.04 -1.97 -2.57 116.42 117.53 3b8s h ASP 573 Ca 0.07 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.86 3b8s h ASP 573 Cb 0.36 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.65 3b8s h ASP 573 CO -0.00 0.09 -0.40 0.00 -2.04 0.00 0.00 179.24 176.89 3b8s n ALA 574 N -2.25 3.34 -2.22 4.15 0.00 -0.50 -4.87 120.51 118.15 3b8s n ALA 574 Ca -0.02 -0.35 -0.32 0.00 0.00 0.00 0.00 53.44 52.76 3b8s n ALA 574 Cb 0.22 -1.15 -0.05 0.00 0.00 0.00 0.00 19.45 18.47 3b8s n ALA 574 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3b8s s ASP 575 N -2.85 6.67 0.00 0.00 2.15 -0.97 -1.26 116.67 120.41 3b8s s ASP 575 Ca 0.15 1.15 0.17 0.00 0.43 0.00 0.00 52.55 54.46 3b8s s ASP 575 Cb 0.18 -2.32 0.33 0.00 -0.30 0.00 0.00 42.92 40.80 3b8s s ASP 575 CO 0.64 -0.22 1.24 -0.46 -0.17 0.00 0.00 175.17 176.20 3b8s n ASN 576 N -0.55 3.00 0.00 -0.34 0.23 -1.26 -4.82 115.26 111.52 3b8s n ASN 576 Ca 0.02 -1.88 0.00 0.00 -0.53 0.00 0.00 54.58 52.20 3b8s n ASN 576 Cb 0.53 -0.20 0.00 0.00 -2.08 0.00 0.00 39.78 38.03 3b8s n ASN 576 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3b8s n GLY 577 N 1.03 1.33 0.21 4.83 0.00 -1.26 -4.44 105.19 106.89 3b8s n GLY 577 Ca 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.14 3b8s n GLY 577 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3b8s h ASP 578 N 1.29 0.22 -0.01 1.61 3.32 -1.92 0.14 116.42 121.06 3b8s h ASP 578 Ca 0.00 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 3b8s h ASP 578 Cb 0.00 0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.59 3b8s h ASP 578 CO 0.00 0.15 -0.02 0.40 -1.72 0.00 0.00 179.24 178.05 3b8s h ILE 579 N 0.39 1.43 -0.43 0.35 1.08 -1.95 -1.00 117.51 117.39 3b8s h ILE 579 Ca 0.26 -1.29 -0.06 0.00 -0.39 0.00 0.00 64.86 63.38 3b8s h ILE 579 Cb 0.28 2.28 -0.02 0.00 -3.07 0.00 0.00 36.82 36.29 3b8s h ILE 579 CO -0.25 0.34 0.04 0.25 -0.69 0.00 0.00 178.15 177.83 3b8s h LEU 580 N -0.50 0.64 -0.10 1.44 5.85 -1.99 0.21 115.31 120.86 3b8s h LEU 580 Ca 0.00 -0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.63 3b8s h LEU 580 Cb 0.56 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.39 3b8s h LEU 580 CO 0.00 0.69 -0.12 0.78 -0.34 0.00 0.00 178.44 179.45 3b8s h ASN 581 N 0.65 -0.37 -0.32 1.25 2.35 -0.92 -2.31 115.58 115.91 3b8s h ASN 581 Ca 0.14 0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.93 3b8s h ASN 581 Cb 0.35 0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.88 3b8s h ASN 581 CO 0.01 -0.16 0.11 0.00 -1.65 0.00 0.00 177.43 175.74 3b8s h ALA 582 N 0.90 1.47 -0.18 -0.83 0.00 -0.70 -1.24 119.26 118.68 3b8s h ALA 582 Ca 0.08 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.87 3b8s h ALA 582 Cb 0.27 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3b8s h ALA 582 CO -0.19 0.39 0.06 0.52 0.00 0.00 0.00 179.25 180.03 3b8s h MET 583 N 0.56 0.14 -0.45 0.00 2.86 -0.64 -0.33 114.93 117.07 3b8s h MET 583 Ca 0.13 -0.01 -0.11 0.00 -2.06 0.00 0.00 59.70 57.66 3b8s h MET 583 Cb 0.18 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 3b8s h MET 583 CO -0.01 0.09 -0.14 0.45 1.06 0.00 0.00 176.91 178.37 3b8s h HIS 584 N 0.14 1.00 -0.21 -0.22 -0.00 -1.08 -2.66 115.15 112.12 3b8s h HIS 584 Ca 0.08 -0.23 -0.07 0.00 -0.00 0.00 0.00 60.37 60.15 3b8s h HIS 584 Cb 0.05 -0.24 -0.01 0.00 -0.00 0.00 0.00 27.41 27.20 3b8s h HIS 584 CO -0.11 1.00 -0.18 0.93 -0.00 0.00 0.00 177.93 179.56 3b8s h GLU 585 N 0.72 0.36 0.00 2.45 5.08 -1.08 -2.45 114.58 119.67 3b8s h GLU 585 Ca 0.11 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 3b8s h GLU 585 Cb 0.69 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 3b8s h GLU 585 CO 0.05 0.54 -0.27 0.78 -1.00 0.00 0.00 179.01 179.11 3b8s h GLY 586 N 0.92 0.00 -0.19 -3.84 0.00 -1.02 -3.19 103.07 95.75 3b8s h GLY 586 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 3b8s h GLY 586 CO 0.03 0.00 -0.19 1.03 0.00 0.00 0.00 176.54 177.42 3b8s n MET 587 N -3.23 1.19 0.00 4.80 2.81 -0.96 -3.44 117.12 118.28 3b8s n MET 587 Ca 0.02 -0.75 0.08 0.00 -1.81 0.00 0.00 57.70 55.24 3b8s n MET 587 Cb 0.57 -1.48 0.48 0.00 -0.71 0.00 0.00 33.22 32.08 3b8s n MET 587 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48