#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fpm s GLN 45 N 0.00 3.06 -0.38 -0.52 2.00 -1.26 -5.10 119.66 117.46 3fpm s GLN 45 Ca 0.00 -0.87 0.01 0.00 -2.00 0.00 0.00 55.36 52.50 3fpm s GLN 45 Cb 0.00 -2.34 0.14 0.00 0.80 0.00 0.00 33.01 31.61 3fpm s GLN 45 CO 0.00 0.15 0.23 0.12 -0.50 0.00 0.00 175.29 175.29 3fpm s PHE 46 N 0.41 1.12 -0.14 1.67 2.19 -1.26 -5.11 117.98 116.86 3fpm s PHE 46 Ca -0.17 -1.90 -0.29 0.00 0.33 0.00 0.00 56.93 54.90 3fpm s PHE 46 Cb -0.18 -1.20 -0.02 0.00 -1.31 0.00 0.00 43.02 40.31 3fpm s PHE 46 CO 0.07 -0.81 1.30 -1.01 1.83 0.00 0.00 175.22 176.60 3fpm s HIS 47 N 0.79 2.78 -0.15 10.12 3.76 -1.26 -5.01 115.29 126.32 3fpm s HIS 47 Ca 0.19 0.93 -0.14 0.00 -0.15 0.00 0.00 55.06 55.89 3fpm s HIS 47 Cb -0.22 -3.54 0.04 0.00 1.11 0.00 0.00 32.58 29.97 3fpm s HIS 47 CO -0.01 -1.91 0.41 0.54 -0.85 0.00 0.00 174.74 172.93 3fpm s VAL 48 N 3.46 -0.00 0.44 -0.90 0.11 -1.26 -5.18 120.40 117.07 3fpm s VAL 48 Ca 0.57 0.00 0.07 0.00 -2.93 0.00 0.00 61.98 59.69 3fpm s VAL 48 Cb -0.23 -0.57 -0.02 0.00 -1.53 0.00 0.00 36.38 34.02 3fpm s VAL 48 CO 0.17 0.00 0.28 -0.54 -3.33 0.00 0.00 175.10 171.68 3fpm s LYS 49 N 0.26 2.33 0.56 1.54 -0.14 -1.26 -5.12 119.74 117.92 3fpm s LYS 49 Ca -0.00 -1.78 -0.17 0.00 -1.36 0.00 0.00 55.97 52.65 3fpm s LYS 49 Cb -0.03 -2.13 -0.05 0.00 -1.68 0.00 0.00 37.83 33.94 3fpm s LYS 49 CO 0.00 -0.24 1.06 -1.12 -0.76 0.00 0.00 175.35 174.29 3fpm s SER 50 N -4.05 5.94 0.79 2.83 0.01 -1.26 -5.07 113.70 112.89 3fpm s SER 50 Ca 0.41 1.87 -0.08 0.00 1.31 0.00 0.00 55.95 59.46 3fpm s SER 50 Cb 0.00 -2.54 0.12 0.00 0.21 0.00 0.00 66.02 63.81 3fpm s SER 50 CO 0.24 -1.06 1.11 -0.83 0.41 0.00 0.00 173.24 173.11 3fpm s GLY 51 N -2.51 1.73 -0.37 3.44 0.00 -1.26 -5.01 107.32 103.34 3fpm s GLY 51 Ca 0.65 -1.19 -0.29 0.00 0.00 0.00 0.00 44.72 43.89 3fpm s GLY 51 CO 0.32 -0.64 1.38 -2.27 0.00 0.00 0.00 173.10 171.89 3fpm s LEU 52 N -5.43 3.69 -0.45 0.66 2.96 -1.26 -4.98 118.68 113.87 3fpm s LEU 52 Ca 0.66 0.97 -0.16 0.00 -0.22 0.00 0.00 54.13 55.37 3fpm s LEU 52 Cb -0.07 -3.54 0.05 0.00 0.50 0.00 0.00 46.19 43.12 3fpm s LEU 52 CO 0.47 -1.32 0.43 -1.58 -1.32 0.00 0.00 176.35 173.03 3fpm s GLN 53 N 4.68 3.03 -0.63 1.98 2.00 -1.26 -5.03 119.66 124.43 3fpm s GLN 53 Ca 0.60 -1.05 -0.23 0.00 -2.00 0.00 0.00 55.36 52.68 3fpm s GLN 53 Cb -0.15 -4.05 0.06 0.00 0.80 0.00 0.00 33.01 29.67 3fpm s GLN 53 CO 0.30 -0.96 0.97 0.42 -0.50 0.00 0.00 175.29 175.52 3fpm s ILE 54 N 1.95 4.32 0.30 -2.34 1.01 -1.26 -4.33 121.20 120.85 3fpm s ILE 54 Ca 0.08 -0.15 -0.29 0.00 0.00 0.00 0.00 60.65 60.29 3fpm s ILE 54 Cb -0.20 -4.65 -0.10 0.00 0.01 0.00 0.00 42.46 37.52 3fpm s ILE 54 CO 0.10 -1.37 1.19 -0.54 0.00 0.00 0.00 174.94 174.32 3fpm s LYS 55 N 4.09 4.52 -0.03 2.79 1.02 0.25 -4.81 119.74 127.57 3fpm s LYS 55 Ca 0.25 1.98 0.18 0.00 0.02 0.00 0.00 55.97 58.40 3fpm s LYS 55 Cb -0.15 -3.14 -0.28 0.00 -0.52 0.00 0.00 37.83 33.74 3fpm s LYS 55 CO 0.13 0.04 0.39 1.63 -0.92 0.00 0.00 175.35 176.61 3fpm n LYS 56 N 1.05 0.56 -1.13 1.68 4.01 -1.26 -1.26 118.16 121.80 3fpm n LYS 56 Ca -0.01 -0.16 -0.31 0.00 -0.51 0.00 0.00 58.31 57.33 3fpm n LYS 56 Cb 0.43 -1.43 0.12 0.00 -0.51 0.00 0.00 35.03 33.64 3fpm n LYS 56 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 3fpm s ASN 57 N -4.09 3.94 0.28 4.39 4.22 -1.26 -4.74 114.94 117.68 3fpm s ASN 57 Ca -0.07 1.82 -0.30 0.00 -2.14 0.00 0.00 52.86 52.17 3fpm s ASN 57 Cb 0.11 -2.46 -0.11 0.00 1.28 0.00 0.00 41.25 40.08 3fpm s ASN 57 CO 0.75 -2.39 1.49 0.00 -2.04 0.00 0.00 177.10 174.90 3fpm s ALA 58 N -2.85 3.65 0.42 3.54 0.00 -1.26 -4.82 121.76 120.44 3fpm s ALA 58 Ca 0.63 1.43 0.22 0.00 0.00 0.00 0.00 51.96 54.25 3fpm s ALA 58 Cb -0.18 -3.59 1.26 0.00 0.00 0.00 0.00 23.12 20.61 3fpm s ALA 58 CO 0.57 -0.85 2.03 0.97 0.00 0.00 0.00 175.76 178.47 3fpm h ILE 59 N 3.39 0.78 0.00 0.00 2.10 -1.94 -2.63 117.51 119.22 3fpm h ILE 59 Ca -0.47 -0.62 0.00 0.00 1.08 0.00 0.00 64.86 64.85 3fpm h ILE 59 Cb 1.22 1.37 0.00 0.00 -1.09 0.00 0.00 36.82 38.32 3fpm h ILE 59 CO 0.76 0.16 0.00 0.16 -1.08 0.00 0.00 178.15 178.15 3fpm h ILE 60 N 0.00 0.00 -0.47 2.19 3.07 -1.91 0.12 117.51 120.51 3fpm h ILE 60 Ca -0.00 -0.18 -0.08 0.00 1.55 0.00 0.00 64.86 66.15 3fpm h ILE 60 Cb 0.36 1.12 -0.02 0.00 -0.27 0.00 0.00 36.82 38.02 3fpm h ILE 60 CO 0.02 0.00 -0.04 0.44 -1.05 0.00 0.00 178.15 177.53 3fpm h ASP 61 N 0.00 0.85 0.00 2.16 3.45 -1.85 -3.36 116.42 117.66 3fpm h ASP 61 Ca 0.00 -0.33 -0.09 0.00 0.43 0.00 0.00 57.03 57.04 3fpm h ASP 61 Cb 0.18 -0.23 -0.02 0.00 -0.56 0.00 0.00 39.33 38.71 3fpm h ASP 61 CO 0.00 0.97 -2.06 0.47 -1.57 0.00 0.00 179.24 177.05 3fpm n ASP 62 N -4.32 0.20 -3.98 6.45 8.00 -0.61 -4.93 116.55 117.36 3fpm n ASP 62 Ca 0.00 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.36 3fpm n ASP 62 Cb 0.33 1.70 -0.14 0.00 -0.02 0.00 0.00 41.12 43.00 3fpm n ASP 62 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3fpm s TYR 63 N -3.20 0.48 -0.21 1.24 2.02 0.32 -1.94 117.35 116.05 3fpm s TYR 63 Ca -0.08 -0.19 -0.22 0.00 -0.37 0.00 0.00 57.07 56.21 3fpm s TYR 63 Cb 0.11 -0.30 -0.02 0.00 -0.40 0.00 0.00 41.96 41.35 3fpm s TYR 63 CO 0.85 -0.03 0.70 0.21 -1.57 0.00 0.00 175.55 175.72 3fpm s LYS 64 N -0.49 4.20 -0.27 -0.62 2.47 0.64 -4.15 119.74 121.52 3fpm s LYS 64 Ca -0.01 0.74 -0.09 0.00 -1.56 0.00 0.00 55.97 55.04 3fpm s LYS 64 Cb -0.04 -3.60 -0.04 0.00 -1.46 0.00 0.00 37.83 32.69 3fpm s LYS 64 CO -0.00 -0.34 0.13 0.08 0.16 0.00 0.00 175.35 175.39 3fpm s VAL 65 N 2.23 4.82 0.75 4.02 1.01 -1.26 -1.10 120.40 130.87 3fpm s VAL 65 Ca 0.31 -0.02 -0.05 0.00 0.00 0.00 0.00 61.98 62.22 3fpm s VAL 65 Cb -0.16 -3.29 0.12 0.00 0.00 0.00 0.00 36.38 33.05 3fpm s VAL 65 CO 0.10 0.28 1.05 0.42 0.00 0.00 0.00 175.10 176.94 3fpm s THR 66 N 1.69 2.19 -0.38 3.92 -4.23 -1.12 -5.00 115.64 112.71 3fpm s THR 66 Ca 0.07 -0.40 0.15 0.00 -1.18 0.00 0.00 61.69 60.33 3fpm s THR 66 Cb -0.16 -2.80 0.71 0.00 1.34 0.00 0.00 72.50 71.60 3fpm s THR 66 CO 0.07 0.00 1.63 -1.54 -0.54 0.00 0.00 174.62 174.25 3fpm n SER 67 N -3.00 5.02 -4.71 3.99 3.41 -1.26 -4.77 113.62 112.29 3fpm n SER 67 Ca 0.13 -2.86 -0.39 0.00 -0.26 0.00 0.00 58.87 55.49 3fpm n SER 67 Cb 0.60 -0.62 -0.05 0.00 -0.26 0.00 0.00 64.21 63.88 3fpm n SER 67 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 3fpm s GLN 68 N -2.60 4.39 -0.02 4.33 0.74 -1.26 -5.04 119.66 120.20 3fpm s GLN 68 Ca 0.50 0.71 -0.10 0.00 0.05 0.00 0.00 55.36 56.52 3fpm s GLN 68 Cb 0.38 -3.45 -0.05 0.00 1.10 0.00 0.00 33.01 30.98 3fpm s GLN 68 CO 0.15 0.08 0.30 0.08 -0.55 0.00 0.00 175.29 175.35 3fpm s VAL 69 N 0.81 5.23 0.00 1.34 1.01 -1.26 -1.93 120.40 125.60 3fpm s VAL 69 Ca 0.33 0.46 0.00 0.00 0.00 0.00 0.00 61.98 62.77 3fpm s VAL 69 Cb -0.17 -3.58 0.00 0.00 0.00 0.00 0.00 36.38 32.63 3fpm s VAL 69 CO 0.15 0.50 0.16 0.18 0.00 0.00 0.00 175.10 176.08 3fpm n LEU 70 N 1.57 0.31 -3.64 3.92 4.77 0.89 -4.90 117.00 119.93 3fpm n LEU 70 Ca -0.14 -0.53 -0.09 0.00 -0.03 0.00 0.00 56.01 55.22 3fpm n LEU 70 Cb 0.53 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.55 3fpm n LEU 70 CO 0.37 0.08 0.74 -0.83 -1.33 0.00 0.00 177.39 176.42 3fpm s GLY 71 N -0.44 -0.15 0.05 -0.72 0.00 -1.04 -4.95 107.32 100.06 3fpm s GLY 71 Ca 0.00 2.67 0.05 0.00 0.00 0.00 0.00 44.72 47.44 3fpm s GLY 71 CO 0.00 1.82 -0.14 1.08 0.00 0.00 0.00 173.10 175.86 3fpm s LEU 72 N 0.21 2.19 0.00 0.66 1.43 -1.26 -0.17 118.68 121.74 3fpm s LEU 72 Ca 0.03 -0.49 -0.09 0.00 -1.03 0.00 0.00 54.13 52.55 3fpm s LEU 72 Cb -0.05 -0.58 0.04 0.00 0.03 0.00 0.00 46.19 45.63 3fpm s LEU 72 CO -0.06 0.01 0.57 0.61 0.23 0.00 0.00 176.35 177.71 3fpm n GLY 73 N 1.78 1.50 0.12 -3.19 0.00 -0.92 -5.01 105.19 99.46 3fpm n GLY 73 Ca -0.19 -1.32 -0.01 0.00 0.00 0.00 0.00 46.02 44.51 3fpm n GLY 73 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3fpm h ILE 74 N 1.81 1.27 0.00 -0.61 2.10 -2.03 -3.32 117.51 116.73 3fpm h ILE 74 Ca -0.26 -2.53 0.00 0.00 1.08 0.00 0.00 64.86 63.15 3fpm h ILE 74 Cb 0.99 2.45 0.00 0.00 -1.09 0.00 0.00 36.82 39.18 3fpm h ILE 74 CO 0.33 0.67 -0.61 -0.55 -1.08 0.00 0.00 178.15 176.90 3fpm h ASN 75 N 0.00 0.00 0.00 2.19 -1.07 -1.96 -3.50 115.58 111.24 3fpm h ASN 75 Ca -0.01 -0.01 0.00 0.00 0.07 0.00 0.00 56.30 56.35 3fpm h ASN 75 Cb 1.40 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.65 3fpm h ASN 75 CO 0.09 0.00 0.00 0.61 0.07 0.00 0.00 177.43 178.20 3fpm n GLY 76 N 1.16 -0.54 3.34 9.14 0.00 -1.25 -4.44 105.19 112.60 3fpm n GLY 76 Ca 0.02 -0.83 -0.19 0.00 0.00 0.00 0.00 46.02 45.02 3fpm n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fpm s LYS 77 N -1.16 1.31 -0.21 1.61 -0.14 -1.25 -2.16 119.74 117.74 3fpm s LYS 77 Ca 0.00 -1.56 0.02 0.00 -1.36 0.00 0.00 55.97 53.06 3fpm s LYS 77 Cb 0.00 -1.13 0.03 0.00 -1.68 0.00 0.00 37.83 35.05 3fpm s LYS 77 CO 0.00 0.19 -0.17 0.08 -0.76 0.00 0.00 175.35 174.70 3fpm s VAL 78 N -2.87 2.12 0.25 3.17 1.01 0.76 -2.00 120.40 122.85 3fpm s VAL 78 Ca 0.21 -1.18 0.08 0.00 0.00 0.00 0.00 61.98 61.10 3fpm s VAL 78 Cb -0.01 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 3fpm s VAL 78 CO 0.07 0.34 0.07 -0.76 0.00 0.00 0.00 175.10 174.81 3fpm s LEU 79 N 1.23 3.42 -0.12 3.92 1.43 -0.15 -0.08 118.68 128.34 3fpm s LEU 79 Ca 0.00 -0.48 -0.19 0.00 -1.03 0.00 0.00 54.13 52.43 3fpm s LEU 79 Cb -0.15 -1.96 -0.04 0.00 0.03 0.00 0.00 46.19 44.07 3fpm s LEU 79 CO -0.10 -0.00 0.51 -1.58 0.23 0.00 0.00 176.35 175.40 3fpm s GLN 80 N -3.66 4.35 0.14 1.70 0.74 -0.81 0.09 119.66 122.20 3fpm s GLN 80 Ca 0.32 0.50 0.06 0.00 0.05 0.00 0.00 55.36 56.29 3fpm s GLN 80 Cb -0.07 -3.44 -0.04 0.00 1.10 0.00 0.00 33.01 30.55 3fpm s GLN 80 CO 0.22 0.13 -0.13 0.96 -0.55 0.00 0.00 175.29 175.92 3fpm s ILE 81 N 0.69 1.36 -0.06 -2.34 -4.36 0.54 -2.77 121.20 114.26 3fpm s ILE 81 Ca 0.27 -1.91 0.06 0.00 -0.26 0.00 0.00 60.65 58.82 3fpm s ILE 81 Cb -0.15 -1.71 -0.01 0.00 1.25 0.00 0.00 42.46 41.83 3fpm s ILE 81 CO 0.11 -0.54 -0.25 -0.36 0.24 0.00 0.00 174.94 174.14 3fpm s PHE 82 N -2.62 2.46 -0.15 1.37 0.08 -0.26 0.20 117.98 119.05 3fpm s PHE 82 Ca 0.14 -0.73 -0.29 0.00 0.12 0.00 0.00 56.93 56.16 3fpm s PHE 82 Cb -0.02 -1.61 -0.03 0.00 -0.57 0.00 0.00 43.02 40.79 3fpm s PHE 82 CO 0.03 -0.22 1.45 1.21 -0.10 0.00 0.00 175.22 177.59 3fpm s ASN 83 N -0.14 6.73 0.33 1.36 3.84 -0.83 -0.26 114.94 125.97 3fpm s ASN 83 Ca -0.04 1.81 0.05 0.00 0.21 0.00 0.00 52.86 54.89 3fpm s ASN 83 Cb -0.14 -2.54 0.68 0.00 -0.55 0.00 0.00 41.25 38.71 3fpm s ASN 83 CO 0.04 -0.93 1.90 0.11 -2.79 0.00 0.00 177.10 175.44 3fpm h LYS 84 N 9.17 0.82 0.04 0.43 1.57 -1.74 0.65 116.57 127.50 3fpm h LYS 84 Ca -0.32 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.41 3fpm h LYS 84 Cb 1.14 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.26 3fpm h LYS 84 CO 0.98 0.54 -0.02 -0.09 -0.57 0.00 0.00 179.45 180.29 3fpm h ARG 85 N 0.84 -0.05 0.00 3.15 2.43 -1.91 -3.38 114.38 115.46 3fpm h ARG 85 Ca 0.40 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.57 3fpm h ARG 85 Cb 0.41 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 3fpm h ARG 85 CO -0.16 0.43 -0.91 1.79 -1.51 0.00 0.00 179.97 179.61 3fpm h THR 86 N -0.98 0.00 -0.37 0.20 1.35 -1.95 -3.48 112.91 107.69 3fpm h THR 86 Ca -0.01 -0.96 -0.16 0.00 -0.55 0.00 0.00 66.41 64.73 3fpm h THR 86 Cb 0.50 1.50 -0.06 0.00 -1.73 0.00 0.00 68.15 68.35 3fpm h THR 86 CO 0.01 0.00 -0.15 1.67 -0.25 0.00 0.00 175.52 176.80 3fpm n GLN 87 N -2.66 -0.55 -3.87 4.72 -0.06 0.23 -5.00 117.38 110.18 3fpm n GLN 87 Ca 0.01 0.77 -0.21 0.00 -2.00 0.00 0.00 57.00 55.57 3fpm n GLN 87 Cb 0.54 -4.61 -0.03 0.00 -4.06 0.00 0.00 30.24 22.09 3fpm n GLN 87 CO 0.00 0.00 0.00 -1.83 -0.20 0.00 0.00 177.06 175.03 3fpm s GLU 88 N -2.65 2.98 0.26 3.69 -1.05 -1.25 -4.77 118.70 115.91 3fpm s GLU 88 Ca 0.00 -1.07 -0.30 0.00 -0.15 0.00 0.00 54.97 53.45 3fpm s GLU 88 Cb 0.00 -2.64 -0.09 0.00 -0.44 0.00 0.00 34.13 30.96 3fpm s GLU 88 CO 0.00 0.24 1.02 0.21 0.95 0.00 0.00 175.26 177.69 3fpm s LYS 89 N -3.98 4.73 0.13 -4.83 2.20 -1.26 -1.97 119.74 114.76 3fpm s LYS 89 Ca 0.38 1.65 -0.06 0.00 -0.36 0.00 0.00 55.97 57.58 3fpm s LYS 89 Cb -0.08 -3.21 -0.02 0.00 -1.51 0.00 0.00 37.83 33.01 3fpm s LYS 89 CO 0.27 0.35 0.17 -0.06 -0.36 0.00 0.00 175.35 175.72 3fpm s PHE 90 N -1.19 0.48 -0.07 4.03 0.40 0.13 -4.10 117.98 117.65 3fpm s PHE 90 Ca 0.43 -0.88 -0.00 0.00 -0.60 0.00 0.00 56.93 55.88 3fpm s PHE 90 Cb -0.29 -0.20 -0.03 0.00 0.51 0.00 0.00 43.02 43.01 3fpm s PHE 90 CO 0.36 -0.59 -0.05 0.00 0.70 0.00 0.00 175.22 175.64 3fpm s ALA 91 N -3.96 3.07 -0.24 5.36 0.00 0.98 -0.34 121.76 126.63 3fpm s ALA 91 Ca 0.15 -0.86 0.02 0.00 0.00 0.00 0.00 51.96 51.27 3fpm s ALA 91 Cb 0.05 -1.31 0.06 0.00 0.00 0.00 0.00 23.12 21.92 3fpm s ALA 91 CO -0.03 0.57 -0.10 -1.17 0.00 0.00 0.00 175.76 175.03 3fpm s LEU 92 N -0.82 2.99 -0.27 0.00 2.96 0.11 -0.29 118.68 123.36 3fpm s LEU 92 Ca 0.12 -1.23 -0.15 0.00 -0.22 0.00 0.00 54.13 52.65 3fpm s LEU 92 Cb -0.11 -1.40 -0.04 0.00 0.50 0.00 0.00 46.19 45.14 3fpm s LEU 92 CO 0.02 -0.19 0.37 -0.75 -1.32 0.00 0.00 176.35 174.48 3fpm s LYS 93 N 1.23 4.02 -0.23 1.98 2.20 -0.21 -0.98 119.74 127.74 3fpm s LYS 93 Ca -0.06 0.04 -0.09 0.00 -0.36 0.00 0.00 55.97 55.49 3fpm s LYS 93 Cb -0.19 -3.66 -0.04 0.00 -1.51 0.00 0.00 37.83 32.43 3fpm s LYS 93 CO -0.06 -0.27 0.12 -1.64 -0.36 0.00 0.00 175.35 173.14 3fpm s MET 94 N 2.06 3.96 0.07 4.03 -1.94 -0.85 -0.88 119.30 125.75 3fpm s MET 94 Ca 0.15 -0.33 0.05 0.00 -1.71 0.00 0.00 55.69 53.85 3fpm s MET 94 Cb -0.16 -3.44 -0.03 0.00 2.01 0.00 0.00 34.83 33.22 3fpm s MET 94 CO 0.10 0.04 -0.14 -0.51 -0.01 0.00 0.00 175.02 174.50 3fpm s LEU 95 N 1.07 2.26 0.14 -0.03 1.43 -0.25 -3.83 118.68 119.48 3fpm s LEU 95 Ca 0.06 -0.60 -0.31 0.00 -1.03 0.00 0.00 54.13 52.26 3fpm s LEU 95 Cb -0.14 -0.51 -0.08 0.00 0.03 0.00 0.00 46.19 45.49 3fpm s LEU 95 CO 0.04 -0.07 1.30 0.00 0.23 0.00 0.00 176.35 177.85 3fpm s GLN 96 N -1.66 4.39 -1.01 1.70 1.03 -1.26 0.30 119.66 123.15 3fpm s GLN 96 Ca -0.02 1.97 -0.23 0.00 0.04 0.00 0.00 55.36 57.12 3fpm s GLN 96 Cb -0.10 -3.25 0.01 0.00 0.03 0.00 0.00 33.01 29.70 3fpm s GLN 96 CO 0.02 -0.29 1.69 0.34 -2.54 0.00 0.00 175.29 174.51 3fpm s ASP 97 N 0.71 5.92 0.16 12.60 2.15 -1.11 -4.67 116.67 132.43 3fpm s ASP 97 Ca 0.59 -1.25 0.10 0.00 0.43 0.00 0.00 52.55 52.42 3fpm s ASP 97 Cb -0.35 -2.57 -0.04 0.00 -0.30 0.00 0.00 42.92 39.66 3fpm s ASP 97 CO 0.33 -2.04 -0.18 0.00 -0.17 0.00 0.00 175.17 173.11 3fpm h PRO 99 N 3.39 0.00 -0.41 0.00 0.11 -1.99 0.43 132.00 133.52 3fpm h PRO 99 Ca -0.48 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 3fpm h PRO 99 Cb 1.19 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 3fpm h PRO 99 CO 0.48 0.00 0.20 -0.22 -0.21 0.00 0.00 178.00 178.25 3fpm h LYS 100 N 0.00 0.59 -0.24 1.05 3.64 -1.96 -2.76 116.57 116.90 3fpm h LYS 100 Ca 0.37 -0.09 -0.05 0.00 -1.27 0.00 0.00 60.65 59.62 3fpm h LYS 100 Cb 1.57 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 33.27 3fpm h LYS 100 CO -0.00 0.51 -0.03 0.00 -2.27 0.00 0.00 179.45 177.66 3fpm h ALA 101 N 1.05 0.32 -0.57 5.00 0.00 -1.24 -2.41 119.26 121.41 3fpm h ALA 101 Ca 0.14 -0.24 0.13 0.00 0.00 0.00 0.00 54.91 54.94 3fpm h ALA 101 Cb 0.12 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3fpm h ALA 101 CO -0.02 0.09 0.39 0.00 0.00 0.00 0.00 179.25 179.71 3fpm h ARG 102 N 0.19 0.18 0.16 0.00 3.08 -1.40 0.28 114.38 116.88 3fpm h ARG 102 Ca 0.06 -0.01 -0.30 0.00 0.07 0.00 0.00 59.98 59.80 3fpm h ARG 102 Cb 0.47 -0.04 0.03 0.00 0.08 0.00 0.00 29.97 30.50 3fpm h ARG 102 CO 0.02 0.12 -1.31 0.00 -1.07 0.00 0.00 179.97 177.73 3fpm h ARG 103 N 0.18 0.53 -0.52 0.04 3.08 -1.38 -2.85 114.38 113.46 3fpm h ARG 103 Ca 0.27 -0.78 -0.04 0.00 0.07 0.00 0.00 59.98 59.50 3fpm h ARG 103 Cb 0.81 0.27 -0.02 0.00 0.08 0.00 0.00 29.97 31.11 3fpm h ARG 103 CO -0.04 1.36 0.15 0.93 -1.07 0.00 0.00 179.97 181.29 3fpm h GLU 104 N 0.20 0.78 -0.34 0.04 5.08 -0.66 -1.19 114.58 118.48 3fpm h GLU 104 Ca -0.20 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 57.97 3fpm h GLU 104 Cb 1.99 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 31.10 3fpm h GLU 104 CO 0.24 0.69 0.02 0.28 -1.00 0.00 0.00 179.01 179.24 3fpm h VAL 105 N 0.76 1.25 -0.58 3.13 2.07 -1.09 -1.93 116.25 119.86 3fpm h VAL 105 Ca 0.17 -0.93 0.03 0.00 0.82 0.00 0.00 66.70 66.79 3fpm h VAL 105 Cb 0.25 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.18 3fpm h VAL 105 CO -0.01 0.31 0.39 -0.33 0.02 0.00 0.00 177.57 177.95 3fpm h GLU 106 N 0.40 0.67 -0.16 1.57 5.08 -1.17 0.32 114.58 121.29 3fpm h GLU 106 Ca 0.10 -0.04 -0.20 0.00 -1.00 0.00 0.00 59.36 58.21 3fpm h GLU 106 Cb 0.42 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 29.53 3fpm h GLU 106 CO 0.01 0.45 -0.69 -0.07 -1.00 0.00 0.00 179.01 177.71 3fpm h LEU 107 N 0.69 0.89 -0.23 1.33 3.38 -1.11 -1.88 115.31 118.38 3fpm h LEU 107 Ca 0.23 -0.62 -0.03 0.00 0.09 0.00 0.00 57.88 57.55 3fpm h LEU 107 Cb 0.06 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3fpm h LEU 107 CO -0.06 1.36 0.03 -0.74 0.09 0.00 0.00 178.44 179.12 3fpm h HIS 108 N 0.47 0.41 -0.82 1.13 2.76 -0.77 -0.90 115.15 117.42 3fpm h HIS 108 Ca -0.04 -0.06 0.08 0.00 -2.20 0.00 0.00 60.37 58.15 3fpm h HIS 108 Cb 1.32 -0.11 -0.07 0.00 1.55 0.00 0.00 27.41 30.10 3fpm h HIS 108 CO 0.09 0.52 0.49 2.35 -1.30 0.00 0.00 177.93 180.08 3fpm h TRP 109 N 0.18 0.89 0.00 5.26 2.91 -0.41 0.16 115.95 124.94 3fpm h TRP 109 Ca 0.07 0.03 -0.07 0.00 1.13 0.00 0.00 58.89 60.05 3fpm h TRP 109 Cb 0.33 -0.28 -0.01 0.00 -0.51 0.00 0.00 29.16 28.70 3fpm h TRP 109 CO 0.02 0.40 -0.32 -0.09 -1.03 0.00 0.00 178.44 177.42 3fpm h ARG 110 N 0.85 0.00 0.00 2.65 2.43 -1.15 -2.92 114.38 116.23 3fpm h ARG 110 Ca 0.38 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.55 3fpm h ARG 110 Cb 0.29 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 3fpm h ARG 110 CO -0.22 0.32 -0.62 0.00 -1.51 0.00 0.00 179.97 177.94 3fpm h ALA 111 N 1.68 0.58 0.00 2.80 0.00 0.45 -3.38 119.26 121.40 3fpm h ALA 111 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3fpm h ALA 111 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3fpm h ALA 111 CO 0.04 0.00 0.00 0.77 0.00 0.00 0.00 179.25 180.06 3fpm h SER 112 N 0.00 0.00 0.37 0.00 0.02 -0.58 -1.85 113.55 111.51 3fpm h SER 112 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3fpm h SER 112 Cb 0.75 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.29 3fpm h SER 112 CO 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.69 3fpm n GLN 113 N -2.53 0.19 -3.32 3.45 1.13 -1.26 -4.68 117.38 110.37 3fpm n GLN 113 Ca -0.01 0.14 -0.39 0.00 -1.94 0.00 0.00 57.00 54.81 3fpm n GLN 113 Cb 0.11 -1.50 -0.07 0.00 0.11 0.00 0.00 30.24 28.88 3fpm n GLN 113 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3fpm h PRO 115 N 7.62 0.00 -0.66 0.00 0.13 -1.90 -1.29 132.00 135.91 3fpm h PRO 115 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 3fpm h PRO 115 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3fpm h PRO 115 CO 0.71 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.20 3fpm n HIS 116 N -3.86 1.00 -4.78 1.56 8.25 -1.26 -4.86 115.22 111.26 3fpm n HIS 116 Ca 0.12 -0.53 -0.33 0.00 -0.26 0.00 0.00 57.72 56.72 3fpm n HIS 116 Cb 0.79 -0.05 -0.14 0.00 1.12 0.00 0.00 29.99 31.71 3fpm n HIS 116 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3fpm s ILE 117 N -1.18 3.08 0.01 1.59 1.01 -0.49 -0.69 121.20 124.53 3fpm s ILE 117 Ca 0.46 -0.66 -0.36 0.00 0.00 0.00 0.00 60.65 60.08 3fpm s ILE 117 Cb 0.25 -2.28 -0.15 0.00 0.01 0.00 0.00 42.46 40.29 3fpm s ILE 117 CO 0.29 0.53 1.56 0.55 0.00 0.00 0.00 174.94 177.87 3fpm n VAL 118 N 3.38 0.15 -3.09 2.92 3.14 -1.07 -4.78 118.33 118.97 3fpm n VAL 118 Ca -0.18 -0.03 -0.39 0.00 -2.96 0.00 0.00 64.34 60.78 3fpm n VAL 118 Cb 0.53 -1.24 -0.05 0.00 -1.06 0.00 0.00 33.84 32.01 3fpm n VAL 118 CO 0.00 0.00 0.00 -0.60 -6.46 0.00 0.00 176.83 169.77 3fpm s ARG 119 N 1.73 4.41 0.05 1.45 3.52 -1.26 -4.76 118.95 124.09 3fpm s ARG 119 Ca 0.87 0.86 -0.25 0.00 -0.13 0.00 0.00 55.73 57.08 3fpm s ARG 119 Cb -0.87 -3.40 -0.06 0.00 -1.56 0.00 0.00 34.95 29.07 3fpm s ARG 119 CO 0.49 0.21 0.77 0.42 -0.81 0.00 0.00 175.30 176.38 3fpm s ILE 120 N 0.31 4.71 -0.16 4.11 1.01 -1.26 -2.51 121.20 127.41 3fpm s ILE 120 Ca 0.35 1.65 -0.08 0.00 0.00 0.00 0.00 60.65 62.57 3fpm s ILE 120 Cb -0.18 -4.12 -0.07 0.00 0.01 0.00 0.00 42.46 38.09 3fpm s ILE 120 CO 0.19 0.37 -0.21 0.52 0.00 0.00 0.00 174.94 175.80 3fpm n VAL 121 N 2.78 0.94 -4.05 2.92 0.31 0.13 -4.99 118.33 116.37 3fpm n VAL 121 Ca -0.02 -0.21 -0.11 0.00 -0.01 0.00 0.00 64.34 63.99 3fpm n VAL 121 Cb 0.50 -1.74 -0.11 0.00 -0.91 0.00 0.00 33.84 31.58 3fpm n VAL 121 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 3fpm s ASP 122 N -6.47 0.64 -0.09 4.52 -0.00 -1.18 -5.01 116.67 109.09 3fpm s ASP 122 Ca -0.23 -0.62 -0.01 0.00 -0.00 0.00 0.00 52.55 51.70 3fpm s ASP 122 Cb 0.09 0.08 0.03 0.00 -0.00 0.00 0.00 42.92 43.11 3fpm s ASP 122 CO 0.29 -0.30 -0.04 -0.69 -0.00 0.00 0.00 175.17 174.43 3fpm s VAL 123 N -1.84 0.70 -0.06 -1.27 1.01 -1.26 0.16 120.40 117.82 3fpm s VAL 123 Ca -0.09 -0.10 0.02 0.00 0.00 0.00 0.00 61.98 61.82 3fpm s VAL 123 Cb -0.07 -0.77 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 3fpm s VAL 123 CO -0.01 0.31 -0.11 -0.31 0.00 0.00 0.00 175.10 174.97 3fpm s TYR 124 N 1.70 2.81 -0.36 5.22 1.51 0.74 -0.58 117.35 128.38 3fpm s TYR 124 Ca 0.02 -0.12 -0.05 0.00 -1.01 0.00 0.00 57.07 55.91 3fpm s TYR 124 Cb -0.13 -1.68 0.07 0.00 -0.11 0.00 0.00 41.96 40.10 3fpm s TYR 124 CO -0.06 0.21 0.13 -2.00 -1.11 0.00 0.00 175.55 172.73 3fpm s GLU 125 N -0.66 2.43 0.36 -0.62 2.12 -0.39 0.66 118.70 122.60 3fpm s GLU 125 Ca 0.10 -1.40 0.05 0.00 0.36 0.00 0.00 54.97 54.08 3fpm s GLU 125 Cb -0.11 -3.49 -0.07 0.00 0.26 0.00 0.00 34.13 30.72 3fpm s GLU 125 CO 0.01 -0.80 0.04 -0.80 -0.54 0.00 0.00 175.26 173.17 3fpm s ASN 126 N 1.61 2.87 -0.46 -1.70 0.02 -0.72 -4.58 114.94 111.98 3fpm s ASN 126 Ca 0.01 -1.38 -0.16 0.00 -1.02 0.00 0.00 52.86 50.31 3fpm s ASN 126 Cb -0.21 -0.17 0.06 0.00 0.02 0.00 0.00 41.25 40.95 3fpm s ASN 126 CO 0.00 -0.57 0.39 -0.76 0.02 0.00 0.00 177.10 176.18 3fpm s LEU 127 N -3.56 5.47 -0.06 0.60 1.02 -1.26 -1.45 118.68 119.43 3fpm s LEU 127 Ca 0.36 -1.20 0.04 0.00 0.02 0.00 0.00 54.13 53.34 3fpm s LEU 127 Cb 0.09 -2.20 -0.02 0.00 0.02 0.00 0.00 46.19 44.08 3fpm s LEU 127 CO 0.16 -0.62 -0.18 -0.47 0.02 0.00 0.00 176.35 175.27 3fpm s TYR 128 N 1.71 2.62 0.00 0.29 5.04 -0.98 -4.94 117.35 121.09 3fpm s TYR 128 Ca 0.05 -0.40 0.00 0.00 -2.44 0.00 0.00 57.07 54.28 3fpm s TYR 128 Cb -0.23 -1.65 0.00 0.00 0.35 0.00 0.00 41.96 40.43 3fpm s TYR 128 CO 0.08 0.00 0.00 0.00 -1.34 0.00 0.00 175.55 174.29 3fpm n ALA 129 N 2.69 0.00 -0.02 3.97 0.00 -1.26 -2.50 120.51 123.39 3fpm n ALA 129 Ca -0.17 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.31 3fpm n ALA 129 Cb 0.52 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.86 3fpm n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fpm n GLY 130 N 0.00 -0.64 3.83 0.00 0.00 -1.26 -5.03 105.19 102.09 3fpm n GLY 130 Ca 0.00 -0.31 -0.32 0.00 0.00 0.00 0.00 46.02 45.39 3fpm n GLY 130 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3fpm s ARG 131 N -2.82 3.78 0.60 1.61 3.03 -1.04 -5.06 118.95 119.05 3fpm s ARG 131 Ca -0.05 1.02 -0.16 0.00 2.03 0.00 0.00 55.73 58.57 3fpm s ARG 131 Cb 0.08 -2.11 -0.03 0.00 -1.03 0.00 0.00 34.95 31.86 3fpm s ARG 131 CO 0.57 -0.42 1.07 0.21 -1.13 0.00 0.00 175.30 175.61 3fpm s LYS 132 N -4.07 3.23 -0.02 3.89 2.20 -1.26 -2.31 119.74 121.40 3fpm s LYS 132 Ca 0.60 1.27 -0.28 0.00 -0.36 0.00 0.00 55.97 57.20 3fpm s LYS 132 Cb -0.12 -2.02 0.07 0.00 -1.51 0.00 0.00 37.83 34.25 3fpm s LYS 132 CO 0.33 -0.89 0.63 0.00 -0.36 0.00 0.00 175.35 175.06 3fpm s LEU 134 N -1.44 4.42 -0.25 0.00 1.02 0.15 -1.76 118.68 120.82 3fpm s LEU 134 Ca -0.09 0.78 0.01 0.00 0.02 0.00 0.00 54.13 54.84 3fpm s LEU 134 Cb -0.01 -2.43 0.07 0.00 0.02 0.00 0.00 46.19 43.84 3fpm s LEU 134 CO 0.06 0.31 -0.04 -0.76 0.02 0.00 0.00 176.35 175.94 3fpm s LEU 135 N -0.82 2.78 -0.23 1.79 1.43 0.21 -1.09 118.68 122.76 3fpm s LEU 135 Ca 0.21 -1.30 -0.12 0.00 -1.03 0.00 0.00 54.13 51.88 3fpm s LEU 135 Cb -0.15 -1.22 -0.05 0.00 0.03 0.00 0.00 46.19 44.80 3fpm s LEU 135 CO 0.10 -0.25 0.25 -0.63 0.23 0.00 0.00 176.35 176.04 3fpm s ILE 136 N 1.35 5.30 -0.27 -0.59 1.09 -0.06 -0.19 121.20 127.83 3fpm s ILE 136 Ca -0.04 0.37 -0.10 0.00 -1.10 0.00 0.00 60.65 59.78 3fpm s ILE 136 Cb -0.19 -3.58 -0.05 0.00 -1.06 0.00 0.00 42.46 37.58 3fpm s ILE 136 CO -0.07 0.31 0.17 -0.69 -0.10 0.00 0.00 174.94 174.55 3fpm s VAL 137 N 1.17 5.15 0.22 2.92 1.01 0.12 -1.05 120.40 129.93 3fpm s VAL 137 Ca 0.12 0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.28 3fpm s VAL 137 Cb -0.14 -3.44 -0.05 0.00 0.00 0.00 0.00 36.38 32.75 3fpm s VAL 137 CO 0.06 0.27 -0.11 -0.04 0.00 0.00 0.00 175.10 175.28 3fpm s MET 138 N 1.69 1.35 0.06 2.72 -1.94 0.60 0.19 119.30 123.97 3fpm s MET 138 Ca 0.07 -1.62 -0.31 0.00 -1.71 0.00 0.00 55.69 52.12 3fpm s MET 138 Cb -0.16 -1.03 -0.09 0.00 2.01 0.00 0.00 34.83 35.57 3fpm s MET 138 CO 0.09 0.12 1.74 -1.83 -0.01 0.00 0.00 175.02 175.13 3fpm s GLU 139 N -3.69 4.17 -0.32 2.03 -1.05 -1.04 -0.01 118.70 118.78 3fpm s GLU 139 Ca 0.24 2.42 -0.28 0.00 -0.15 0.00 0.00 54.97 57.20 3fpm s GLU 139 Cb 0.01 -3.72 -0.02 0.00 -0.44 0.00 0.00 34.13 29.95 3fpm s GLU 139 CO 0.07 -0.81 1.86 0.00 0.95 0.00 0.00 175.26 177.33 3fpm s LEU 141 N 7.13 5.77 -0.25 0.00 1.43 -1.26 -4.87 118.68 126.63 3fpm s LEU 141 Ca 0.82 -1.87 0.13 0.00 -1.03 0.00 0.00 54.13 52.19 3fpm s LEU 141 Cb -0.24 -2.28 0.69 0.00 0.03 0.00 0.00 46.19 44.39 3fpm s LEU 141 CO 0.34 -0.95 1.65 -0.90 0.23 0.00 0.00 176.35 176.71 3fpm n ASP 142 N 5.67 4.69 -0.31 2.29 5.68 -0.24 -4.44 116.55 129.89 3fpm n ASP 142 Ca 0.01 -3.10 0.06 0.00 -0.50 0.00 0.00 54.79 51.26 3fpm n ASP 142 Cb 0.44 -0.66 0.27 0.00 -1.14 0.00 0.00 41.12 40.04 3fpm n ASP 142 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3fpm n GLY 143 N -0.08 -0.26 0.72 6.12 0.00 -0.41 -4.51 105.19 106.79 3fpm n GLY 143 Ca 0.30 -0.23 0.09 0.00 0.00 0.00 0.00 46.02 46.18 3fpm n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fpm n GLY 144 N 0.87 -2.08 3.72 -0.02 0.00 -1.26 -4.29 105.19 102.14 3fpm n GLY 144 Ca 0.11 -1.31 -0.33 0.00 0.00 0.00 0.00 46.02 44.48 3fpm n GLY 144 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fpm s GLU 145 N -2.32 1.95 0.10 1.61 2.02 -1.26 -1.89 118.70 118.90 3fpm s GLU 145 Ca 0.00 1.56 -0.30 0.00 0.02 0.00 0.00 54.97 56.25 3fpm s GLU 145 Cb 0.00 -1.83 -0.12 0.00 0.10 0.00 0.00 34.13 32.28 3fpm s GLU 145 CO 0.00 -1.94 1.62 1.25 0.02 0.00 0.00 175.26 176.21 3fpm h LEU 146 N -0.80 -0.89 -1.26 1.80 5.85 -1.19 -2.83 115.31 115.99 3fpm h LEU 146 Ca -0.46 0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.30 3fpm h LEU 146 Cb 1.27 0.31 -0.01 0.00 0.37 0.00 0.00 40.66 42.60 3fpm h LEU 146 CO 0.48 -0.45 -0.24 -0.26 -0.34 0.00 0.00 178.44 177.63 3fpm h PHE 147 N -0.66 0.00 -0.43 1.25 0.05 -1.87 -2.84 116.94 112.44 3fpm h PHE 147 Ca -0.01 0.00 -0.02 0.00 3.82 0.00 0.00 57.97 61.76 3fpm h PHE 147 Cb 0.61 0.00 -0.02 0.00 2.00 0.00 0.00 35.95 38.54 3fpm h PHE 147 CO -0.21 0.24 0.18 0.77 -0.18 0.00 0.00 178.31 179.11 3fpm h SER 148 N 0.00 0.59 1.08 2.17 0.02 -1.89 -1.83 113.55 113.69 3fpm h SER 148 Ca -0.00 -0.16 -0.08 0.00 -0.84 0.00 0.00 61.79 60.71 3fpm h SER 148 Cb 0.68 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 3fpm h SER 148 CO 0.03 0.59 -0.38 0.03 -1.14 0.00 0.00 176.83 175.96 3fpm h ARG 149 N 0.55 0.00 -0.10 3.45 2.47 -1.28 0.56 114.38 120.03 3fpm h ARG 149 Ca 0.14 0.00 -0.17 0.00 -1.26 0.00 0.00 59.98 58.69 3fpm h ARG 149 Cb 0.18 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.49 3fpm h ARG 149 CO -0.01 0.38 -0.66 0.82 0.56 0.00 0.00 179.97 181.06 3fpm h ILE 150 N 0.00 1.36 0.21 2.04 5.03 -1.44 -3.32 117.51 121.38 3fpm h ILE 150 Ca -0.00 -2.02 -0.34 0.00 -0.12 0.00 0.00 64.86 62.38 3fpm h ILE 150 Cb 1.03 2.01 0.02 0.00 -3.03 0.00 0.00 36.82 36.84 3fpm h ILE 150 CO 0.05 0.61 -1.59 -0.61 -0.68 0.00 0.00 178.15 175.93 3fpm h GLN 151 N 0.30 0.43 -1.89 2.37 4.15 -0.98 -3.35 115.11 116.15 3fpm h GLN 151 Ca -0.02 -0.74 -0.30 0.00 0.77 0.00 0.00 58.65 58.36 3fpm h GLN 151 Cb 1.22 0.28 -0.11 0.00 0.21 0.00 0.00 27.48 29.07 3fpm h GLN 151 CO 0.11 1.34 0.12 -0.25 -1.93 0.00 0.00 178.83 178.23 3fpm n ASP 152 N -3.62 5.97 0.01 -0.69 8.00 0.19 -4.07 116.55 122.33 3fpm n ASP 152 Ca -0.20 -2.86 0.11 0.00 0.71 0.00 0.00 54.79 52.56 3fpm n ASP 152 Cb 1.08 -1.23 -0.14 0.00 -0.02 0.00 0.00 41.12 40.81 3fpm n ASP 152 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 3fpm n ARG 153 N 1.30 0.65 -3.46 -1.24 0.63 -1.25 -4.91 116.66 108.38 3fpm n ARG 153 Ca 0.36 -0.15 -0.18 0.00 -0.92 0.00 0.00 57.85 56.96 3fpm n ARG 153 Cb 0.65 -1.57 0.07 0.00 0.45 0.00 0.00 32.46 32.07 3fpm n ARG 153 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3fpm n GLY 154 N 1.25 -0.53 3.59 5.14 0.00 -1.26 -4.72 105.19 108.66 3fpm n GLY 154 Ca -0.03 0.22 -0.46 0.00 0.00 0.00 0.00 46.02 45.74 3fpm n GLY 154 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3fpm n ASP 155 N -3.12 1.40 -2.21 1.61 3.85 -1.26 -4.90 116.55 111.92 3fpm n ASP 155 Ca -0.24 1.16 -0.29 0.00 -0.71 0.00 0.00 54.79 54.71 3fpm n ASP 155 Cb 0.66 -1.27 0.11 0.00 -1.35 0.00 0.00 41.12 39.27 3fpm n ASP 155 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3fpm n GLN 156 N 1.15 2.59 -0.57 0.11 3.00 -1.26 -5.02 117.38 117.36 3fpm n GLN 156 Ca 0.11 -3.27 0.07 0.00 -0.01 0.00 0.00 57.00 53.90 3fpm n GLN 156 Cb 0.30 -2.23 -0.04 0.00 0.00 0.00 0.00 30.24 28.27 3fpm n GLN 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3fpm n ALA 157 N -0.98 -1.51 -3.85 -1.58 0.00 -1.26 -5.00 120.51 106.33 3fpm n ALA 157 Ca 0.59 0.36 -0.26 0.00 0.00 0.00 0.00 53.44 54.13 3fpm n ALA 157 Cb 0.99 -0.62 -0.17 0.00 0.00 0.00 0.00 19.45 19.65 3fpm n ALA 157 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3fpm s PHE 158 N -3.33 1.23 0.68 0.00 5.36 -1.23 -4.95 117.98 115.73 3fpm s PHE 158 Ca 0.00 -0.61 -0.11 0.00 -0.96 0.00 0.00 56.93 55.25 3fpm s PHE 158 Cb 0.00 -1.10 -0.00 0.00 -0.34 0.00 0.00 43.02 41.58 3fpm s PHE 158 CO 0.00 -0.47 1.06 0.95 -1.46 0.00 0.00 175.22 175.29 3fpm s THR 159 N 1.79 4.04 0.27 0.12 -4.23 -1.26 -0.35 115.64 116.01 3fpm s THR 159 Ca 0.04 0.70 -0.01 0.00 -1.18 0.00 0.00 61.69 61.24 3fpm s THR 159 Cb -0.13 -3.42 0.11 0.00 1.34 0.00 0.00 72.50 70.39 3fpm s THR 159 CO -0.07 -0.83 1.76 -0.08 -0.54 0.00 0.00 174.62 174.86 3fpm h GLU 160 N -0.55 0.72 -0.45 3.99 4.81 -1.11 -3.10 114.58 118.90 3fpm h GLU 160 Ca -0.44 -0.21 -0.03 0.00 -0.13 0.00 0.00 59.36 58.55 3fpm h GLU 160 Cb 1.21 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.49 3fpm h GLU 160 CO 0.57 0.77 0.15 -0.09 -0.73 0.00 0.00 179.01 179.68 3fpm h ARG 161 N 0.66 0.68 -0.15 1.92 2.43 -1.82 -2.81 114.38 115.29 3fpm h ARG 161 Ca 0.12 -0.14 -0.06 0.00 -0.81 0.00 0.00 59.98 59.09 3fpm h ARG 161 Cb 0.49 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 3fpm h ARG 161 CO 0.03 0.65 -0.18 0.93 -1.51 0.00 0.00 179.97 179.88 3fpm h GLU 162 N 0.58 0.26 -0.25 0.20 5.08 -1.89 -2.12 114.58 116.43 3fpm h GLU 162 Ca 0.15 -0.07 -0.09 0.00 -1.00 0.00 0.00 59.36 58.35 3fpm h GLU 162 Cb 0.24 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 3fpm h GLU 162 CO -0.01 0.44 -0.21 0.00 -1.00 0.00 0.00 179.01 178.23 3fpm h ALA 163 N 1.58 1.17 -0.33 3.43 0.00 -1.45 -2.43 119.26 121.22 3fpm h ALA 163 Ca 0.04 -0.32 -0.14 0.00 0.00 0.00 0.00 54.91 54.50 3fpm h ALA 163 Cb 0.47 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3fpm h ALA 163 CO 0.03 0.53 -0.36 1.03 0.00 0.00 0.00 179.25 180.48 3fpm h SER 164 N 0.42 0.80 -0.69 0.00 0.87 -1.15 -1.39 113.55 112.41 3fpm h SER 164 Ca 0.07 -0.35 -0.03 0.00 -1.23 0.00 0.00 61.79 60.25 3fpm h SER 164 Cb 0.60 -0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 62.31 3fpm h SER 164 CO 0.04 1.08 0.31 -0.33 -0.53 0.00 0.00 176.83 177.40 3fpm h GLU 165 N 0.63 1.01 -0.36 2.24 5.08 -1.29 -0.78 114.58 121.12 3fpm h GLU 165 Ca 0.06 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 3fpm h GLU 165 Cb 0.90 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 3fpm h GLU 165 CO 0.08 0.81 0.20 0.82 -1.00 0.00 0.00 179.01 179.93 3fpm h ILE 166 N 0.97 1.14 -0.58 3.13 2.04 -1.31 -2.82 117.51 120.09 3fpm h ILE 166 Ca 0.24 -0.35 -0.05 0.00 1.00 0.00 0.00 64.86 65.70 3fpm h ILE 166 Cb 0.15 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 3fpm h ILE 166 CO -0.03 0.14 0.16 0.24 0.00 0.00 0.00 178.15 178.66 3fpm h MET 167 N 0.46 0.92 -0.89 2.37 2.86 -0.91 -2.51 114.93 117.22 3fpm h MET 167 Ca 0.13 -0.21 -0.02 0.00 -2.06 0.00 0.00 59.70 57.53 3fpm h MET 167 Cb 0.05 -0.12 -0.04 0.00 0.06 0.00 0.00 31.60 31.54 3fpm h MET 167 CO -0.02 0.84 0.48 -0.22 1.06 0.00 0.00 176.91 179.05 3fpm h LYS 168 N 0.83 1.25 -0.34 1.72 3.64 -1.13 0.26 116.57 122.80 3fpm h LYS 168 Ca 0.18 -0.15 -0.03 0.00 -1.27 0.00 0.00 60.65 59.38 3fpm h LYS 168 Cb 0.32 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 3fpm h LYS 168 CO -0.00 0.92 0.09 0.66 -2.27 0.00 0.00 179.45 178.85 3fpm h SER 169 N 1.25 0.50 0.18 4.20 4.64 -1.32 -0.77 113.55 122.24 3fpm h SER 169 Ca 0.31 -0.22 -0.07 0.00 -0.47 0.00 0.00 61.79 61.35 3fpm h SER 169 Cb 0.04 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 3fpm h SER 169 CO -0.05 0.59 -0.26 0.40 -0.87 0.00 0.00 176.83 176.65 3fpm h ILE 170 N 0.39 1.22 0.72 0.95 2.04 -1.23 -2.67 117.51 118.93 3fpm h ILE 170 Ca 0.11 -1.02 -0.03 0.00 1.00 0.00 0.00 64.86 64.91 3fpm h ILE 170 Cb 0.28 1.45 0.01 0.00 -0.74 0.00 0.00 36.82 37.81 3fpm h ILE 170 CO -0.00 0.30 -0.36 1.23 0.00 0.00 0.00 178.15 179.33 3fpm h GLY 171 N 0.90 -1.03 2.00 5.37 0.00 0.21 -2.34 103.07 108.18 3fpm h GLY 171 Ca 0.02 0.39 0.00 0.00 0.00 0.00 0.00 47.33 47.74 3fpm h GLY 171 CO 0.04 -0.37 0.00 1.05 0.00 0.00 0.00 176.54 177.25 3fpm h GLU 172 N -0.98 0.00 -0.51 4.80 4.11 -1.15 0.31 114.58 121.16 3fpm h GLU 172 Ca -0.10 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 59.21 3fpm h GLU 172 Cb 0.76 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 3fpm h GLU 172 CO 0.16 0.00 -0.17 0.00 0.07 0.00 0.00 179.01 179.06 3fpm h ALA 173 N 2.01 0.73 -0.00 1.06 0.00 -1.33 -1.30 119.26 120.42 3fpm h ALA 173 Ca 0.00 -0.38 -0.26 0.00 0.00 0.00 0.00 54.91 54.27 3fpm h ALA 173 Cb 0.40 -0.18 0.02 0.00 0.00 0.00 0.00 17.79 18.03 3fpm h ALA 173 CO 0.00 0.67 -1.02 0.82 0.00 0.00 0.00 179.25 179.72 3fpm h ILE 174 N 0.88 1.30 -0.43 0.00 1.08 -0.66 -3.11 117.51 116.57 3fpm h ILE 174 Ca 0.12 -2.28 0.03 0.00 -0.39 0.00 0.00 64.86 62.34 3fpm h ILE 174 Cb 0.75 2.38 -0.03 0.00 -3.07 0.00 0.00 36.82 36.84 3fpm h ILE 174 CO 0.06 0.70 0.23 -0.61 -0.69 0.00 0.00 178.15 177.84 3fpm h GLN 175 N 0.37 0.45 -0.32 2.37 4.15 -0.38 0.14 115.11 121.88 3fpm h GLN 175 Ca -0.12 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.28 3fpm h GLN 175 Cb 1.67 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 29.24 3fpm h GLN 175 CO 0.20 0.30 0.21 -0.92 -1.93 0.00 0.00 178.83 176.69 3fpm h TYR 176 N 0.47 0.41 -0.04 3.99 3.20 -1.34 -0.29 116.97 123.37 3fpm h TYR 176 Ca 0.18 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.08 3fpm h TYR 176 Cb 0.06 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.18 3fpm h TYR 176 CO -0.09 0.26 -0.05 -0.07 -1.64 0.00 0.00 178.16 176.57 3fpm h LEU 177 N 0.44 -0.15 -1.04 2.82 3.38 -1.34 -2.78 115.31 116.64 3fpm h LEU 177 Ca 0.12 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 3fpm h LEU 177 Cb -0.05 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 3fpm h LEU 177 CO -0.03 -0.07 -0.07 0.45 0.09 0.00 0.00 178.44 178.81 3fpm h HIS 178 N -0.07 0.65 0.00 1.13 3.86 -0.63 0.11 115.15 120.20 3fpm h HIS 178 Ca 0.03 -0.09 -0.01 0.00 -1.16 0.00 0.00 60.37 59.14 3fpm h HIS 178 Cb 0.12 -0.18 -0.00 0.00 1.06 0.00 0.00 27.41 28.41 3fpm h HIS 178 CO -0.14 0.66 -0.03 0.66 0.86 0.00 0.00 177.93 179.94 3fpm h SER 179 N 0.56 0.00 -0.29 2.45 4.64 -0.79 -2.28 113.55 117.85 3fpm h SER 179 Ca 0.11 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.32 3fpm h SER 179 Cb 0.47 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.49 3fpm h SER 179 CO 0.02 0.03 -0.05 2.30 -0.87 0.00 0.00 176.83 178.26 3fpm n ILE 180 N -3.19 2.41 -3.18 0.95 -5.35 -1.03 -4.98 119.36 105.00 3fpm n ILE 180 Ca -0.01 -2.44 -0.19 0.00 -0.27 0.00 0.00 62.75 59.84 3fpm n ILE 180 Cb 0.25 -0.29 0.05 0.00 -1.74 0.00 0.00 39.64 37.91 3fpm n ILE 180 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 3fpm n ASN 181 N -0.95 -5.53 -4.09 7.28 5.03 -0.86 -4.96 115.26 111.18 3fpm n ASN 181 Ca 0.28 -0.36 -0.31 0.00 0.87 0.00 0.00 54.58 55.07 3fpm n ASN 181 Cb 0.95 -4.24 -0.16 0.00 -1.02 0.00 0.00 39.78 35.31 3fpm n ASN 181 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3fpm s ILE 182 N -3.18 1.75 -0.16 2.41 1.01 0.35 -0.58 121.20 122.80 3fpm s ILE 182 Ca 0.39 -0.78 -0.10 0.00 0.00 0.00 0.00 60.65 60.16 3fpm s ILE 182 Cb -0.17 -1.59 -0.05 0.00 0.01 0.00 0.00 42.46 40.66 3fpm s ILE 182 CO 0.48 0.49 0.17 0.00 0.00 0.00 0.00 174.94 176.08 3fpm s ALA 183 N 1.10 3.73 -0.04 9.38 0.00 -0.62 -3.12 121.76 132.21 3fpm s ALA 183 Ca -0.02 -0.62 -0.22 0.00 0.00 0.00 0.00 51.96 51.10 3fpm s ALA 183 Cb -0.14 -2.15 -0.26 0.00 0.00 0.00 0.00 23.12 20.56 3fpm s ALA 183 CO -0.06 0.30 0.99 1.25 0.00 0.00 0.00 175.76 178.24 3fpm h HIS 184 N 6.10 0.47 -0.61 0.00 2.76 -1.88 -1.30 115.15 120.69 3fpm h HIS 184 Ca -0.46 -0.29 -0.26 0.00 -2.20 0.00 0.00 60.37 57.16 3fpm h HIS 184 Cb 1.18 -0.04 -0.10 0.00 1.55 0.00 0.00 27.41 29.99 3fpm h HIS 184 CO 0.64 1.15 -0.24 0.54 -1.30 0.00 0.00 177.93 178.72 3fpm n ARG 185 N -4.27 -1.33 -2.19 5.26 1.74 -1.26 -2.69 116.66 111.92 3fpm n ARG 185 Ca -0.11 0.93 -0.02 0.00 -0.77 0.00 0.00 57.85 57.87 3fpm n ARG 185 Cb 0.68 -5.17 0.06 0.00 -1.02 0.00 0.00 32.46 27.00 3fpm n ARG 185 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3fpm n ASP 186 N -0.82 -0.68 -4.56 0.55 2.03 -1.26 -4.93 116.55 106.88 3fpm n ASP 186 Ca -0.13 -2.12 -0.38 0.00 0.52 0.00 0.00 54.79 52.69 3fpm n ASP 186 Cb 0.53 0.33 -0.03 0.00 -0.72 0.00 0.00 41.12 41.23 3fpm n ASP 186 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3fpm s VAL 187 N -0.53 3.75 0.23 5.18 1.01 -1.26 -4.84 120.40 123.93 3fpm s VAL 187 Ca 0.12 -0.41 0.07 0.00 0.00 0.00 0.00 61.98 61.75 3fpm s VAL 187 Cb 0.31 -4.73 -0.05 0.00 0.00 0.00 0.00 36.38 31.91 3fpm s VAL 187 CO -0.09 -1.64 -0.10 -1.59 0.00 0.00 0.00 175.10 171.69 3fpm s LYS 188 N 5.69 1.38 0.42 2.72 -2.85 -1.26 -4.73 119.74 121.11 3fpm s LYS 188 Ca 0.51 -1.65 0.17 0.00 -1.00 0.00 0.00 55.97 53.99 3fpm s LYS 188 Cb -0.04 -1.04 1.07 0.00 -2.06 0.00 0.00 37.83 35.77 3fpm s LYS 188 CO -0.02 0.10 1.87 -1.35 0.10 0.00 0.00 175.35 176.05 3fpm h PRO 189 N 2.47 0.40 -0.72 1.78 0.11 -1.95 -0.77 132.00 133.32 3fpm h PRO 189 Ca -0.39 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.67 3fpm h PRO 189 Cb 1.22 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 3fpm h PRO 189 CO 0.64 0.27 0.34 1.49 -0.21 0.00 0.00 178.00 180.53 3fpm h GLU 190 N 0.42 1.04 -0.24 1.05 4.81 -1.96 -3.07 114.58 116.62 3fpm h GLU 190 Ca 0.45 -0.15 0.00 0.00 -0.13 0.00 0.00 59.36 59.53 3fpm h GLU 190 Cb 1.09 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.28 3fpm h GLU 190 CO -0.16 0.81 0.00 0.09 -0.73 0.00 0.00 179.01 179.01 3fpm n ASN 191 N -4.32 1.48 -4.24 1.04 5.03 -0.30 -4.67 115.26 109.28 3fpm n ASN 191 Ca 0.07 -1.88 -0.38 0.00 0.87 0.00 0.00 54.58 53.25 3fpm n ASN 191 Cb 0.14 -0.16 -0.12 0.00 -1.02 0.00 0.00 39.78 38.63 3fpm n ASN 191 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 3fpm s LEU 192 N -1.19 4.71 0.04 3.41 1.43 -1.16 -0.50 118.68 125.43 3fpm s LEU 192 Ca 0.23 -1.42 0.09 0.00 -1.03 0.00 0.00 54.13 52.01 3fpm s LEU 192 Cb 0.12 -1.89 -0.03 0.00 0.03 0.00 0.00 46.19 44.43 3fpm s LEU 192 CO 0.17 -0.43 -0.25 -0.76 0.23 0.00 0.00 176.35 175.32 3fpm s LEU 193 N 1.36 2.17 0.43 1.79 1.43 -0.82 -0.90 118.68 124.14 3fpm s LEU 193 Ca 0.01 -0.57 -0.09 0.00 -1.03 0.00 0.00 54.13 52.45 3fpm s LEU 193 Cb -0.21 -1.18 -0.06 0.00 0.03 0.00 0.00 46.19 44.77 3fpm s LEU 193 CO 0.01 0.23 0.78 -0.31 0.23 0.00 0.00 176.35 177.29 3fpm s TYR 194 N -0.80 3.50 0.00 0.29 2.02 -0.79 -1.21 117.35 120.36 3fpm s TYR 194 Ca 0.10 1.00 0.00 0.00 -0.37 0.00 0.00 57.07 57.80 3fpm s TYR 194 Cb -0.10 -2.42 0.00 0.00 -0.40 0.00 0.00 41.96 39.05 3fpm s TYR 194 CO 0.02 -0.17 0.63 0.25 -1.57 0.00 0.00 175.55 174.71 3fpm n THR 195 N -1.60 0.00 -4.41 -0.71 -2.24 -0.65 -1.28 114.28 103.38 3fpm n THR 195 Ca 0.02 1.11 -0.30 0.00 -2.27 0.00 0.00 64.05 62.61 3fpm n THR 195 Cb 0.54 -2.08 -0.05 0.00 -2.10 0.00 0.00 70.33 66.65 3fpm n THR 195 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3fpm s SER 196 N -2.25 4.33 0.00 3.42 1.04 -1.26 -1.08 113.70 117.90 3fpm s SER 196 Ca 0.00 -1.49 0.27 0.00 0.48 0.00 0.00 55.95 55.21 3fpm s SER 196 Cb 0.00 0.48 1.38 0.00 0.10 0.00 0.00 66.02 67.98 3fpm s SER 196 CO 0.00 -0.95 1.92 2.29 0.98 0.00 0.00 173.24 177.48 3fpm n LYS 197 N -1.46 0.42 -1.47 4.02 0.00 -1.26 -4.16 118.16 114.25 3fpm n LYS 197 Ca -0.12 0.03 -0.36 0.00 -0.00 0.00 0.00 58.31 57.86 3fpm n LYS 197 Cb 0.66 -1.50 0.09 0.00 -0.00 0.00 0.00 35.03 34.28 3fpm n LYS 197 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 3fpm n ARG 198 N -1.26 0.70 0.00 -1.58 1.74 -1.26 -4.91 116.66 110.09 3fpm n ARG 198 Ca 0.13 0.30 0.13 0.00 -0.77 0.00 0.00 57.85 57.64 3fpm n ARG 198 Cb 0.20 -2.41 0.72 0.00 -1.02 0.00 0.00 32.46 29.95 3fpm n ARG 198 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 3fpm n PRO 199 N -2.22 0.67 -0.23 5.56 -0.04 -1.26 -3.00 135.00 134.47 3fpm n PRO 199 Ca 0.15 0.02 0.09 0.00 -0.04 0.00 0.00 63.50 63.71 3fpm n PRO 199 Cb 0.49 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.67 3fpm n PRO 199 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3fpm n ASN 200 N -1.09 3.34 -4.74 3.54 4.13 -1.26 -5.04 115.26 114.14 3fpm n ASN 200 Ca 0.17 -1.95 -0.35 0.00 1.68 0.00 0.00 54.58 54.13 3fpm n ASN 200 Cb 0.12 -0.31 0.06 0.00 -1.54 0.00 0.00 39.78 38.12 3fpm n ASN 200 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3fpm s ALA 201 N -1.11 2.36 -0.14 5.41 0.00 -1.16 -5.03 121.76 122.09 3fpm s ALA 201 Ca 0.35 0.90 -0.08 0.00 0.00 0.00 0.00 51.96 53.13 3fpm s ALA 201 Cb 0.19 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.83 3fpm s ALA 201 CO 0.26 -1.47 0.13 0.42 0.00 0.00 0.00 175.76 175.10 3fpm s ILE 202 N -1.85 5.42 -0.09 0.00 1.01 -1.26 -4.88 121.20 119.54 3fpm s ILE 202 Ca 0.75 0.18 -0.24 0.00 0.00 0.00 0.00 60.65 61.33 3fpm s ILE 202 Cb -0.29 -3.39 -0.03 0.00 0.01 0.00 0.00 42.46 38.76 3fpm s ILE 202 CO 0.39 0.57 0.76 -0.22 0.00 0.00 0.00 174.94 176.44 3fpm s LEU 203 N -0.61 4.27 0.01 2.97 2.96 -1.26 -1.64 118.68 125.37 3fpm s LEU 203 Ca 0.13 1.21 0.05 0.00 -0.22 0.00 0.00 54.13 55.30 3fpm s LEU 203 Cb -0.12 -3.16 -0.02 0.00 0.50 0.00 0.00 46.19 43.39 3fpm s LEU 203 CO 0.02 -0.22 -0.15 -0.54 -1.32 0.00 0.00 176.35 174.15 3fpm s LYS 204 N 1.25 1.09 -0.14 1.98 1.02 -0.35 -4.69 119.74 119.90 3fpm s LYS 204 Ca 0.39 -0.63 -0.19 0.00 0.02 0.00 0.00 55.97 55.56 3fpm s LYS 204 Cb -0.18 -1.08 -0.04 0.00 -0.52 0.00 0.00 37.83 36.02 3fpm s LYS 204 CO 0.17 0.28 0.51 -1.17 -0.92 0.00 0.00 175.35 174.22 3fpm s LEU 205 N -0.69 4.24 0.00 3.17 2.96 0.14 -1.95 118.68 126.55 3fpm s LEU 205 Ca 0.04 0.81 0.04 0.00 -0.22 0.00 0.00 54.13 54.80 3fpm s LEU 205 Cb -0.07 -2.73 0.04 0.00 0.50 0.00 0.00 46.19 43.93 3fpm s LEU 205 CO 0.00 -0.06 0.32 0.35 -1.32 0.00 0.00 176.35 175.64 3fpm n THR 206 N 3.93 0.00 -2.21 3.68 -2.24 0.35 -2.61 114.28 115.19 3fpm n THR 206 Ca -0.06 -2.13 -0.01 0.00 -2.27 0.00 0.00 64.05 59.58 3fpm n THR 206 Cb 0.51 0.05 -0.01 0.00 -2.10 0.00 0.00 70.33 68.78 3fpm n THR 206 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3fpm n ASP 207 N -1.74 -4.15 -1.81 3.42 -0.08 -1.26 -4.90 116.55 106.03 3fpm n ASP 207 Ca -0.05 0.85 -0.15 0.00 -1.51 0.00 0.00 54.79 53.93 3fpm n ASP 207 Cb 0.60 -3.60 0.20 0.00 2.34 0.00 0.00 41.12 40.66 3fpm n ASP 207 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 3fpm n PHE 208 N 0.61 2.28 1.16 -0.67 3.01 -1.26 -4.57 117.46 118.02 3fpm n PHE 208 Ca -0.08 -1.68 0.12 0.00 1.01 0.00 0.00 57.45 56.82 3fpm n PHE 208 Cb 0.13 -0.75 0.61 0.00 -0.01 0.00 0.00 39.48 39.46 3fpm n PHE 208 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3fpm n GLY 209 N -1.03 -1.04 0.00 1.37 0.00 -1.26 -3.22 105.19 100.00 3fpm n GLY 209 Ca 0.48 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.38 3fpm n GLY 209 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3fpm n PHE 210 N -1.26 0.00 -2.08 1.61 3.72 -1.26 -5.07 117.46 113.11 3fpm n PHE 210 Ca 0.12 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.11 3fpm n PHE 210 Cb 0.18 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.70 3fpm n PHE 210 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3fpm s ALA 211 N -0.02 3.46 0.02 4.37 0.00 -1.10 -4.54 121.76 123.96 3fpm s ALA 211 Ca 0.00 1.28 -0.01 0.00 0.00 0.00 0.00 51.96 53.23 3fpm s ALA 211 Cb 0.00 -3.49 -0.02 0.00 0.00 0.00 0.00 23.12 19.61 3fpm s ALA 211 CO 0.00 -0.70 -0.01 0.15 0.00 0.00 0.00 175.76 175.20 3fpm s LYS 212 N -1.89 0.34 -0.18 0.00 1.02 -0.49 -4.89 119.74 113.65 3fpm s LYS 212 Ca 0.50 -0.59 -0.28 0.00 0.02 0.00 0.00 55.97 55.63 3fpm s LYS 212 Cb -0.40 0.12 -0.00 0.00 -0.52 0.00 0.00 37.83 37.03 3fpm s LYS 212 CO 0.53 -0.06 0.96 -2.00 -0.92 0.00 0.00 175.35 173.86 3fpm s GLU 213 N -1.48 4.31 0.00 1.68 2.12 -1.26 -1.58 118.70 122.49 3fpm s GLU 213 Ca -0.16 1.26 0.19 0.00 0.36 0.00 0.00 54.97 56.62 3fpm s GLU 213 Cb -0.10 -3.59 0.89 0.00 0.26 0.00 0.00 34.13 31.59 3fpm s GLU 213 CO -0.01 -0.45 1.60 0.25 -0.54 0.00 0.00 175.26 176.11 3fpm n THR 214 N 4.94 0.11 -4.16 -1.70 -2.24 0.25 -4.87 114.28 106.61 3fpm n THR 214 Ca 0.09 -0.18 -0.23 0.00 -2.27 0.00 0.00 64.05 61.46 3fpm n THR 214 Cb 0.48 0.05 -0.06 0.00 -2.10 0.00 0.00 70.33 68.70 3fpm n THR 214 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3fpm s THR 215 N -1.89 3.61 -0.02 4.28 -1.32 -1.26 -4.83 115.64 114.22 3fpm s THR 215 Ca 0.29 -1.68 -0.04 0.00 -1.21 0.00 0.00 61.69 59.06 3fpm s THR 215 Cb 0.15 -3.06 -0.02 0.00 -1.51 0.00 0.00 72.50 68.06 3fpm s THR 215 CO 0.23 -0.30 0.32 -1.28 -2.21 0.00 0.00 174.62 171.38 3fpm h SER 216 N 1.64 -0.12 0.00 8.08 0.87 -1.89 -3.53 113.55 118.59 3fpm h SER 216 Ca -0.45 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.11 3fpm h SER 216 Cb 1.25 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.24 3fpm h SER 216 CO 0.61 0.07 0.00 0.41 -0.53 0.00 0.00 176.83 177.38 3fpm n THR 226 N -3.24 0.00 -3.41 2.23 -1.04 -1.26 -5.22 114.28 102.33 3fpm n THR 226 Ca -0.02 0.00 -0.44 0.00 -2.04 0.00 0.00 64.05 61.55 3fpm n THR 226 Cb 0.06 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.50 3fpm n THR 226 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 3fpm s PRO 227 N 0.00 2.83 0.00 -2.82 0.04 -1.26 -5.09 135.00 128.71 3fpm s PRO 227 Ca 0.00 -1.62 0.20 0.00 0.04 0.00 0.00 61.00 59.62 3fpm s PRO 227 Cb 0.00 -4.13 0.54 0.00 0.04 0.00 0.00 34.50 30.95 3fpm s PRO 227 CO 0.00 -1.20 1.44 2.48 0.04 0.00 0.00 177.00 179.76 3fpm n TYR 228 N 5.13 0.50 0.19 0.56 0.18 -1.26 -3.99 117.16 118.47 3fpm n TYR 228 Ca -0.12 -0.25 0.07 0.00 1.88 0.00 0.00 57.90 59.48 3fpm n TYR 228 Cb 0.41 0.00 -0.10 0.00 -0.38 0.00 0.00 39.34 39.28 3fpm n TYR 228 CO 0.00 0.00 0.00 2.48 -2.08 0.00 0.00 176.86 177.26 3fpm n TYR 229 N 0.98 0.00 -1.69 -3.48 0.18 -1.26 -5.04 117.16 106.85 3fpm n TYR 229 Ca 0.18 0.00 -0.32 0.00 1.88 0.00 0.00 57.90 59.64 3fpm n TYR 229 Cb 0.46 -0.21 0.05 0.00 -0.38 0.00 0.00 39.34 39.26 3fpm n TYR 229 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 3fpm s VAL 230 N -2.72 3.66 0.33 -3.48 0.11 -1.26 -5.04 120.40 112.00 3fpm s VAL 230 Ca -0.02 0.66 -0.17 0.00 -2.93 0.00 0.00 61.98 59.52 3fpm s VAL 230 Cb 0.09 -3.23 -0.09 0.00 -1.53 0.00 0.00 36.38 31.61 3fpm s VAL 230 CO 0.55 -0.59 0.77 0.00 -3.33 0.00 0.00 175.10 172.51 3fpm s ALA 231 N -2.69 3.28 0.06 1.54 0.00 -1.26 -4.98 121.76 117.71 3fpm s ALA 231 Ca 0.62 0.12 0.32 0.00 0.00 0.00 0.00 51.96 53.03 3fpm s ALA 231 Cb -0.17 -2.85 1.53 0.00 0.00 0.00 0.00 23.12 21.64 3fpm s ALA 231 CO 0.47 0.29 1.97 -1.00 0.00 0.00 0.00 175.76 177.49 3fpm h PRO 232 N 2.33 0.00 -0.20 0.00 0.13 -1.96 -2.64 132.00 129.66 3fpm h PRO 232 Ca -0.48 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.48 3fpm h PRO 232 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3fpm h PRO 232 CO 0.65 0.00 -0.54 0.93 -0.23 0.00 0.00 178.00 178.80 3fpm h GLU 233 N 0.00 0.73 0.00 0.86 5.08 -1.94 -3.11 114.58 116.20 3fpm h GLU 233 Ca 0.00 -0.51 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 3fpm h GLU 233 Cb 0.26 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.59 3fpm h GLU 233 CO 0.00 1.13 0.00 0.28 -1.00 0.00 0.00 179.01 179.42 3fpm h VAL 234 N 0.45 0.00 -0.67 3.13 2.07 -1.88 -3.34 116.25 116.01 3fpm h VAL 234 Ca -0.01 -0.45 -0.71 0.00 0.82 0.00 0.00 66.70 66.34 3fpm h VAL 234 Cb 1.16 1.41 -0.06 0.00 -1.52 0.00 0.00 31.29 32.28 3fpm h VAL 234 CO 0.12 0.00 3.00 0.18 0.02 0.00 0.00 177.57 180.89 3fpm n LEU 235 N -2.95 8.24 -0.20 2.57 4.77 -1.18 -4.94 117.00 123.32 3fpm n LEU 235 Ca 0.01 -4.65 0.02 0.00 -0.03 0.00 0.00 56.01 51.36 3fpm n LEU 235 Cb 0.29 -1.46 -0.01 0.00 -2.33 0.00 0.00 43.42 39.91 3fpm n LEU 235 CO 0.26 2.00 -0.08 0.61 -1.33 0.00 0.00 177.39 178.85 3fpm n GLY 236 N 2.59 -2.78 3.87 -0.72 0.00 -1.25 -4.99 105.19 101.91 3fpm n GLY 236 Ca 0.68 -1.36 -0.31 0.00 0.00 0.00 0.00 46.02 45.03 3fpm n GLY 236 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3fpm s PRO 237 N -3.41 3.83 -0.19 1.61 0.05 -1.26 -4.84 135.00 130.79 3fpm s PRO 237 Ca 0.00 0.46 -0.17 0.00 0.05 0.00 0.00 61.00 61.34 3fpm s PRO 237 Cb 0.00 -2.46 0.05 0.00 0.05 0.00 0.00 34.50 32.15 3fpm s PRO 237 CO 0.00 0.09 0.51 -2.00 0.05 0.00 0.00 177.00 175.65 3fpm s GLU 238 N -3.44 0.58 0.00 4.56 2.12 -1.26 -4.80 118.70 116.46 3fpm s GLU 238 Ca 0.51 0.75 0.00 0.00 0.36 0.00 0.00 54.97 56.59 3fpm s GLU 238 Cb -0.10 0.25 0.00 0.00 0.26 0.00 0.00 34.13 34.54 3fpm s GLU 238 CO 0.26 -0.08 0.00 0.36 -0.54 0.00 0.00 175.26 175.25 3fpm n LYS 239 N 3.02 1.99 0.00 4.30 -0.00 -1.26 -5.05 118.16 121.16 3fpm n LYS 239 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.16 3fpm n LYS 239 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.59 3fpm n LYS 239 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.40 179.88 3fpm n TYR 240 N 0.00 0.00 0.00 5.58 0.18 -1.26 -4.79 117.16 116.87 3fpm n TYR 240 Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 3fpm n TYR 240 Cb 0.00 -0.32 0.00 0.00 -0.38 0.00 0.00 39.34 38.64 3fpm n TYR 240 CO 0.00 0.00 0.00 -0.25 -2.08 0.00 0.00 176.86 174.53 3fpm n ASP 241 N -1.46 0.00 -0.36 9.48 10.43 -1.26 -2.93 116.55 130.45 3fpm n ASP 241 Ca 0.00 0.00 0.34 0.00 2.57 0.00 0.00 54.79 57.70 3fpm n ASP 241 Cb 0.00 0.00 0.68 0.00 1.84 0.00 0.00 41.12 43.64 3fpm n ASP 241 CO 0.00 0.00 0.00 0.11 -1.07 0.00 0.00 177.20 176.24 3fpm h LYS 242 N 0.00 0.11 -0.24 -1.24 1.57 -1.95 0.20 116.57 115.02 3fpm h LYS 242 Ca 0.00 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.73 3fpm h LYS 242 Cb 0.00 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 3fpm h LYS 242 CO 0.00 0.07 -0.04 0.77 -0.57 0.00 0.00 179.45 179.68 3fpm h SER 243 N 0.11 0.35 0.91 0.86 0.02 -1.89 -2.66 113.55 111.25 3fpm h SER 243 Ca 0.63 -0.06 -0.07 0.00 -0.84 0.00 0.00 61.79 61.45 3fpm h SER 243 Cb 2.21 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 64.65 3fpm h SER 243 CO -0.13 0.44 -0.34 0.00 -1.14 0.00 0.00 176.83 175.67 3fpm h ASP 245 N 0.00 0.76 -0.16 0.00 3.32 -1.57 -2.31 116.42 116.47 3fpm h ASP 245 Ca -0.00 -0.22 -0.13 0.00 0.02 0.00 0.00 57.03 56.70 3fpm h ASP 245 Cb 0.88 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 3fpm h ASP 245 CO 0.04 0.89 -0.33 0.24 -1.72 0.00 0.00 179.24 178.37 3fpm h MET 246 N 0.71 0.66 0.25 3.56 2.86 -1.31 -1.32 114.93 120.33 3fpm h MET 246 Ca 0.12 -0.30 -0.01 0.00 -2.06 0.00 0.00 59.70 57.45 3fpm h MET 246 Cb 0.57 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.22 3fpm h MET 246 CO 0.04 0.90 -0.12 2.35 1.06 0.00 0.00 176.91 181.13 3fpm h TRP 247 N 0.56 -0.31 -0.79 -0.22 2.91 -1.28 -1.68 115.95 115.15 3fpm h TRP 247 Ca 0.06 -0.01 0.15 0.00 1.13 0.00 0.00 58.89 60.23 3fpm h TRP 247 Cb 0.83 0.10 -0.10 0.00 -0.51 0.00 0.00 29.16 29.49 3fpm h TRP 247 CO 0.04 -0.09 0.33 0.77 -1.03 0.00 0.00 178.44 178.46 3fpm h SER 248 N -0.47 0.33 -0.64 2.65 0.02 -1.33 0.31 113.55 114.41 3fpm h SER 248 Ca -0.03 0.11 0.02 0.00 -0.84 0.00 0.00 61.79 61.05 3fpm h SER 248 Cb 0.36 0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.94 3fpm h SER 248 CO 0.06 0.11 0.41 0.25 -1.14 0.00 0.00 176.83 176.52 3fpm h LEU 249 N 0.47 0.69 -0.42 5.07 5.85 -1.05 -0.37 115.31 125.55 3fpm h LEU 249 Ca 0.44 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 59.13 3fpm h LEU 249 Cb 0.69 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 3fpm h LEU 249 CO -0.41 0.49 0.16 1.23 -0.34 0.00 0.00 178.44 179.57 3fpm h GLY 250 N 0.82 0.68 0.53 3.75 0.00 -0.12 -2.21 103.07 106.52 3fpm h GLY 250 Ca 0.25 -0.37 0.05 0.00 0.00 0.00 0.00 47.33 47.26 3fpm h GLY 250 CO -0.08 0.35 -0.02 -2.08 0.00 0.00 0.00 176.54 174.71 3fpm h VAL 251 N 0.54 0.78 -0.80 4.60 2.07 -0.61 -2.41 116.25 120.41 3fpm h VAL 251 Ca 0.14 -0.02 0.03 0.00 0.82 0.00 0.00 66.70 67.67 3fpm h VAL 251 Cb 0.20 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 30.63 3fpm h VAL 251 CO -0.01 0.01 0.51 0.40 0.02 0.00 0.00 177.57 178.50 3fpm h ILE 252 N 0.06 1.13 -0.67 4.57 2.04 -0.91 -2.07 117.51 121.66 3fpm h ILE 252 Ca 0.13 -0.35 -0.04 0.00 1.00 0.00 0.00 64.86 65.60 3fpm h ILE 252 Cb 0.18 0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 36.27 3fpm h ILE 252 CO -0.24 0.18 0.25 -0.03 0.00 0.00 0.00 178.15 178.31 3fpm h MET 253 N 1.01 1.01 0.17 2.37 4.05 -1.15 0.49 114.93 122.87 3fpm h MET 253 Ca 0.32 -0.18 -0.01 0.00 -0.28 0.00 0.00 59.70 59.55 3fpm h MET 253 Cb -0.01 -0.16 0.00 0.00 -0.80 0.00 0.00 31.60 30.63 3fpm h MET 253 CO -0.11 0.84 -0.08 -0.92 0.23 0.00 0.00 176.91 176.87 3fpm h TYR 254 N 0.98 -0.21 -0.21 1.39 5.03 -0.90 -2.04 116.97 121.01 3fpm h TYR 254 Ca 0.23 -0.00 -0.04 0.00 2.58 0.00 0.00 58.73 61.49 3fpm h TYR 254 Cb 0.22 0.07 -0.01 0.00 1.55 0.00 0.00 36.73 38.56 3fpm h TYR 254 CO 0.02 -0.04 -0.03 0.82 -1.32 0.00 0.00 178.16 177.60 3fpm h ILE 255 N -0.34 1.15 -0.63 1.81 2.04 -1.22 -2.53 117.51 117.78 3fpm h ILE 255 Ca -0.02 -0.61 -0.03 0.00 1.00 0.00 0.00 64.86 65.20 3fpm h ILE 255 Cb 0.27 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.35 3fpm h ILE 255 CO 0.04 0.20 0.30 -0.07 0.00 0.00 0.00 178.15 178.62 3fpm h LEU 256 N 0.30 0.84 0.01 1.44 3.38 -0.66 -2.44 115.31 118.18 3fpm h LEU 256 Ca 0.07 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 3fpm h LEU 256 Cb 0.26 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.80 3fpm h LEU 256 CO 0.01 0.74 -0.00 -0.07 0.09 0.00 0.00 178.44 179.21 3fpm h LEU 257 N 0.88 -0.01 0.00 1.67 3.38 -0.97 -3.42 115.31 116.83 3fpm h LEU 257 Ca 0.22 -0.84 -0.10 0.00 0.09 0.00 0.00 57.88 57.25 3fpm h LEU 257 Cb 0.13 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 3fpm h LEU 257 CO -0.03 0.89 -0.91 0.00 0.09 0.00 0.00 178.44 178.48 3fpm n GLY 259 N 1.52 -0.07 3.04 0.00 0.00 -0.92 -3.47 105.19 105.30 3fpm n GLY 259 Ca -0.19 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 3fpm n GLY 259 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3fpm s TYR 260 N -0.88 0.53 0.60 1.61 -0.85 -1.26 -4.41 117.35 112.69 3fpm s TYR 260 Ca 0.00 -0.58 -0.19 0.00 -0.52 0.00 0.00 57.07 55.78 3fpm s TYR 260 Cb 0.00 -0.33 -0.03 0.00 0.38 0.00 0.00 41.96 41.98 3fpm s TYR 260 CO 0.00 -0.15 1.29 -1.25 -1.52 0.00 0.00 175.55 173.93 3fpm s PRO 261 N -1.85 2.83 0.57 -3.49 0.04 -1.26 -3.96 135.00 127.88 3fpm s PRO 261 Ca -0.10 2.07 0.35 0.00 0.04 0.00 0.00 61.00 63.36 3fpm s PRO 261 Cb -0.08 -1.99 1.67 0.00 0.04 0.00 0.00 34.50 34.13 3fpm s PRO 261 CO -0.01 -1.38 2.11 -1.00 0.04 0.00 0.00 177.00 176.76 3fpm h PRO 262 N 0.91 0.00 -5.03 0.56 0.13 -1.93 -3.49 132.00 123.15 3fpm h PRO 262 Ca -0.51 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.02 3fpm h PRO 262 Cb 1.32 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.32 3fpm h PRO 262 CO 0.55 0.05 -0.49 -0.06 -0.23 0.00 0.00 178.00 177.81 3fpm s PHE 263 N -3.94 1.77 0.00 1.56 0.40 -1.26 -4.74 117.98 111.78 3fpm s PHE 263 Ca -0.02 -1.31 0.00 0.00 -0.60 0.00 0.00 56.93 55.00 3fpm s PHE 263 Cb 0.11 -1.20 0.00 0.00 0.51 0.00 0.00 43.02 42.44 3fpm s PHE 263 CO 0.52 -0.29 0.00 0.41 0.70 0.00 0.00 175.22 176.57 3fpm n GLY 274 N -1.02 0.00 0.10 4.36 0.00 -1.26 -5.11 105.19 102.26 3fpm n GLY 274 Ca -0.09 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.90 3fpm n GLY 274 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 3fpm h MET 275 N 0.00 0.00 0.00 1.61 1.85 -2.06 -2.93 114.93 113.40 3fpm h MET 275 Ca 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.09 3fpm h MET 275 Cb 0.00 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.03 3fpm h MET 275 CO 0.00 0.78 0.00 0.87 -0.40 0.00 0.00 176.91 178.16 3fpm h LYS 276 N 0.00 0.00 0.12 0.39 1.79 -2.01 -2.66 116.57 114.21 3fpm h LYS 276 Ca -0.01 0.00 -0.33 0.00 -2.18 0.00 0.00 60.65 58.13 3fpm h LYS 276 Cb 1.46 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 32.10 3fpm h LYS 276 CO 0.10 0.00 -1.74 1.15 -1.08 0.00 0.00 179.45 177.88 3fpm h THR 277 N 0.00 0.81 0.00 -0.16 2.02 -1.95 -3.22 112.91 110.41 3fpm h THR 277 Ca 0.00 -2.37 -0.00 0.00 0.77 0.00 0.00 66.41 64.81 3fpm h THR 277 Cb 0.11 2.58 -0.00 0.00 -1.74 0.00 0.00 68.15 69.10 3fpm h THR 277 CO 0.00 0.79 -0.00 0.03 0.37 0.00 0.00 175.52 176.71 3fpm h ARG 278 N -0.12 0.00 -0.05 6.66 3.08 -1.41 0.26 114.38 122.81 3fpm h ARG 278 Ca -0.37 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.62 3fpm h ARG 278 Cb 1.91 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.96 3fpm h ARG 278 CO 0.07 0.00 -0.18 0.82 -1.07 0.00 0.00 179.97 179.61 3fpm h ILE 279 N 0.00 1.46 0.00 2.04 2.04 -1.66 -2.50 117.51 118.88 3fpm h ILE 279 Ca -0.00 -1.62 0.00 0.00 1.00 0.00 0.00 64.86 64.24 3fpm h ILE 279 Cb 0.00 2.39 0.00 0.00 -0.74 0.00 0.00 36.82 38.48 3fpm h ILE 279 CO 0.00 0.45 0.00 0.03 0.00 0.00 0.00 178.15 178.63 3fpm h ARG 280 N -0.35 0.00 0.08 2.37 3.08 -1.32 -2.28 114.38 115.97 3fpm h ARG 280 Ca -0.01 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.77 3fpm h ARG 280 Cb 0.82 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.86 3fpm h ARG 280 CO 0.04 0.00 -1.30 0.52 -1.07 0.00 0.00 179.97 178.16 3fpm h MET 281 N 0.00 0.18 -1.18 0.04 2.86 -0.55 -3.49 114.93 112.78 3fpm h MET 281 Ca 0.00 -0.30 -0.06 0.00 -2.06 0.00 0.00 59.70 57.28 3fpm h MET 281 Cb 0.38 0.11 0.01 0.00 0.06 0.00 0.00 31.60 32.16 3fpm h MET 281 CO 0.00 1.08 -0.09 0.41 1.06 0.00 0.00 176.91 179.37 3fpm n GLY 282 N 1.53 0.53 3.39 8.32 0.00 -0.86 -4.96 105.19 113.13 3fpm n GLY 282 Ca -0.09 -0.63 -0.37 0.00 0.00 0.00 0.00 46.02 44.93 3fpm n GLY 282 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3fpm s GLN 283 N -4.76 3.43 -0.19 1.61 -2.07 -0.98 -5.02 119.66 111.69 3fpm s GLN 283 Ca 0.05 -0.62 -0.13 0.00 -1.82 0.00 0.00 55.36 52.84 3fpm s GLN 283 Cb -0.02 -3.30 0.06 0.00 -1.09 0.00 0.00 33.01 28.65 3fpm s GLN 283 CO 0.06 -0.28 0.47 1.52 -1.32 0.00 0.00 175.29 175.75 3fpm s TYR 284 N 1.56 -0.63 0.65 9.60 1.13 -1.26 -4.81 117.35 123.59 3fpm s TYR 284 Ca 0.05 1.39 -0.10 0.00 -1.41 0.00 0.00 57.07 57.00 3fpm s TYR 284 Cb -0.16 0.28 -0.01 0.00 -1.10 0.00 0.00 41.96 40.97 3fpm s TYR 284 CO 0.02 -0.33 1.04 -1.21 -2.51 0.00 0.00 175.55 172.56 3fpm s GLU 285 N 1.00 3.20 -0.83 -3.49 8.01 -1.26 -5.01 118.70 120.31 3fpm s GLU 285 Ca -0.06 0.53 0.02 0.00 0.01 0.00 0.00 54.97 55.46 3fpm s GLU 285 Cb -0.06 -2.08 0.27 0.00 -4.31 0.00 0.00 34.13 27.95 3fpm s GLU 285 CO -0.09 -0.78 1.05 1.19 0.01 0.00 0.00 175.26 176.65 3fpm n PHE 286 N -2.83 3.09 -2.64 1.61 3.01 -1.26 -5.05 117.46 113.39 3fpm n PHE 286 Ca 0.06 -3.51 -0.39 0.00 1.01 0.00 0.00 57.45 54.63 3fpm n PHE 286 Cb 0.56 -0.86 -0.05 0.00 -0.01 0.00 0.00 39.48 39.11 3fpm n PHE 286 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 3fpm s PRO 287 N -2.58 4.60 0.67 -1.08 0.04 -1.26 -4.55 135.00 130.84 3fpm s PRO 287 Ca 0.36 1.54 -0.09 0.00 0.04 0.00 0.00 61.00 62.85 3fpm s PRO 287 Cb 0.10 -2.99 0.02 0.00 0.04 0.00 0.00 34.50 31.67 3fpm s PRO 287 CO 0.03 0.25 1.03 -0.80 0.04 0.00 0.00 177.00 177.55 3fpm s ASN 288 N -1.28 5.36 -0.18 6.66 0.01 -1.26 -3.06 114.94 121.20 3fpm s ASN 288 Ca 0.47 0.90 0.04 0.00 -0.71 0.00 0.00 52.86 53.56 3fpm s ASN 288 Cb -0.25 -1.72 0.37 0.00 0.41 0.00 0.00 41.25 40.05 3fpm s ASN 288 CO 0.32 -1.31 1.30 -0.81 -1.51 0.00 0.00 177.10 175.09 3fpm n PRO 289 N -2.88 2.23 -0.07 -0.60 -0.04 -1.26 -4.88 135.00 127.50 3fpm n PRO 289 Ca 0.06 -1.53 -0.10 0.00 -0.04 0.00 0.00 63.50 61.89 3fpm n PRO 289 Cb 0.58 -1.72 -0.08 0.00 -0.04 0.00 0.00 33.50 32.24 3fpm n PRO 289 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3fpm h GLU 290 N 1.18 0.00 -0.02 0.54 3.07 -1.93 -3.38 114.58 114.04 3fpm h GLU 290 Ca 0.17 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.03 3fpm h GLU 290 Cb 1.62 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.53 3fpm h GLU 290 CO 0.41 0.61 0.00 0.91 -1.40 0.00 0.00 179.01 179.54 3fpm n TRP 291 N -4.63 0.01 0.38 4.33 7.02 -1.17 -3.62 117.44 119.76 3fpm n TRP 291 Ca -0.11 -0.01 0.14 0.00 -1.02 0.00 0.00 57.50 56.50 3fpm n TRP 291 Cb 0.36 0.00 0.53 0.00 -2.42 0.00 0.00 31.31 29.77 3fpm n TRP 291 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 3fpm h SER 292 N 1.29 0.00 0.18 -0.99 4.64 -1.84 -3.17 113.55 113.66 3fpm h SER 292 Ca 0.00 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.17 3fpm h SER 292 Cb 0.28 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.34 3fpm h SER 292 CO 0.00 0.00 -1.97 -0.62 -0.87 0.00 0.00 176.83 173.37 3fpm n GLU 293 N -2.52 0.66 -2.66 4.77 4.71 -1.24 -4.96 120.64 119.40 3fpm n GLU 293 Ca 0.02 -0.05 -0.40 0.00 -0.01 0.00 0.00 57.16 56.72 3fpm n GLU 293 Cb 0.28 -1.59 -0.05 0.00 -1.01 0.00 0.00 31.44 29.08 3fpm n GLU 293 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 3fpm s VAL 294 N -3.07 4.00 0.83 2.62 1.01 -1.20 -5.03 120.40 119.57 3fpm s VAL 294 Ca -0.07 1.91 -0.11 0.00 0.00 0.00 0.00 61.98 63.70 3fpm s VAL 294 Cb 0.10 -4.21 0.09 0.00 0.00 0.00 0.00 36.38 32.36 3fpm s VAL 294 CO 0.86 0.41 1.09 -0.94 0.00 0.00 0.00 175.10 176.52 3fpm s SER 295 N -0.77 4.07 0.27 3.32 1.04 -1.26 -4.94 113.70 115.44 3fpm s SER 295 Ca 0.44 1.61 -0.01 0.00 0.48 0.00 0.00 55.95 58.46 3fpm s SER 295 Cb -0.27 -2.31 0.37 0.00 0.10 0.00 0.00 66.02 63.91 3fpm s SER 295 CO 0.34 -2.28 1.79 -0.08 0.98 0.00 0.00 173.24 173.99 3fpm h GLU 296 N -1.30 0.79 -0.39 4.02 4.57 -1.97 -3.04 114.58 117.26 3fpm h GLU 296 Ca -0.47 -0.19 0.06 0.00 -1.18 0.00 0.00 59.36 57.58 3fpm h GLU 296 Cb 1.26 -0.10 -0.05 0.00 -0.16 0.00 0.00 28.75 29.69 3fpm h GLU 296 CO 0.54 0.77 0.08 1.49 -1.18 0.00 0.00 179.01 180.70 3fpm h GLU 297 N 0.75 0.20 -0.37 1.92 4.81 -1.99 -1.17 114.58 118.73 3fpm h GLU 297 Ca 0.15 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.33 3fpm h GLU 297 Cb 0.39 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 3fpm h GLU 297 CO 0.01 0.13 0.08 0.28 -0.73 0.00 0.00 179.01 178.78 3fpm h VAL 298 N 0.20 1.23 -0.63 0.32 2.07 -1.92 -2.09 116.25 115.44 3fpm h VAL 298 Ca 0.19 -0.80 -0.04 0.00 0.82 0.00 0.00 66.70 66.87 3fpm h VAL 298 Cb 0.22 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 3fpm h VAL 298 CO -0.25 0.27 0.22 0.11 0.02 0.00 0.00 177.57 177.95 3fpm h LYS 299 N 0.45 0.93 -0.12 1.57 1.57 -1.43 -1.42 116.57 118.13 3fpm h LYS 299 Ca 0.12 -0.16 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 3fpm h LYS 299 Cb 0.33 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 3fpm h LYS 299 CO 0.00 0.78 -0.24 1.98 -0.57 0.00 0.00 179.45 181.40 3fpm h MET 300 N 0.91 0.20 -0.13 3.15 4.05 -1.00 0.17 114.93 122.27 3fpm h MET 300 Ca 0.21 -0.06 -0.05 0.00 -0.28 0.00 0.00 59.70 59.52 3fpm h MET 300 Cb 0.22 -0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 31.00 3fpm h MET 300 CO -0.01 0.44 -0.11 1.25 0.23 0.00 0.00 176.91 178.71 3fpm h LEU 301 N 0.19 0.33 -0.55 3.39 5.85 -0.74 -1.03 115.31 122.75 3fpm h LEU 301 Ca 0.03 -0.46 0.03 0.00 0.84 0.00 0.00 57.88 58.31 3fpm h LEU 301 Cb 0.54 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.44 3fpm h LEU 301 CO 0.04 0.72 0.33 0.40 -0.34 0.00 0.00 178.44 179.59 3fpm h ILE 302 N -0.06 1.06 -0.88 4.05 2.04 -1.01 -0.33 117.51 122.38 3fpm h ILE 302 Ca 0.02 -0.22 0.07 0.00 1.00 0.00 0.00 64.86 65.73 3fpm h ILE 302 Cb 0.62 0.35 -0.06 0.00 -0.74 0.00 0.00 36.82 36.98 3fpm h ILE 302 CO 0.03 0.12 0.54 0.03 0.00 0.00 0.00 178.15 178.87 3fpm h ARG 303 N 0.66 0.95 -0.06 2.37 3.08 -0.62 0.58 114.38 121.33 3fpm h ARG 303 Ca 0.22 -0.06 -0.09 0.00 0.07 0.00 0.00 59.98 60.12 3fpm h ARG 303 Cb 0.02 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.85 3fpm h ARG 303 CO -0.10 0.63 -0.40 -0.91 -1.07 0.00 0.00 179.97 178.12 3fpm h ASN 304 N 0.98 0.13 1.52 7.04 -0.26 -0.56 -2.80 115.58 121.63 3fpm h ASN 304 Ca 0.39 -0.05 0.00 0.00 -0.56 0.00 0.00 56.30 56.08 3fpm h ASN 304 Cb 0.21 -0.04 0.00 0.00 -1.06 0.00 0.00 38.32 37.43 3fpm h ASN 304 CO -0.19 0.52 -0.42 -0.07 -1.06 0.00 0.00 177.43 176.21 3fpm h LEU 305 N 0.11 0.00 -3.99 1.61 3.38 -0.09 -2.86 115.31 113.47 3fpm h LEU 305 Ca 0.01 -0.01 -0.64 0.00 0.09 0.00 0.00 57.88 57.33 3fpm h LEU 305 Cb 0.75 0.00 -0.33 0.00 0.09 0.00 0.00 40.66 41.17 3fpm h LEU 305 CO 0.06 0.01 0.33 0.18 0.09 0.00 0.00 178.44 179.10 3fpm n LEU 306 N -2.84 6.79 -4.72 1.67 4.77 0.19 -4.18 117.00 118.68 3fpm n LEU 306 Ca 0.02 -4.48 -0.41 0.00 -0.03 0.00 0.00 56.01 51.11 3fpm n LEU 306 Cb 0.53 -0.78 -0.04 0.00 -2.33 0.00 0.00 43.42 40.80 3fpm n LEU 306 CO 0.36 1.70 0.76 -0.54 -1.33 0.00 0.00 177.39 178.34 3fpm s LYS 307 N -3.77 4.57 0.12 3.23 -0.14 -1.17 -4.93 119.74 117.66 3fpm s LYS 307 Ca 0.60 1.61 -0.19 0.00 -1.36 0.00 0.00 55.97 56.62 3fpm s LYS 307 Cb 0.47 -3.35 -0.06 0.00 -1.68 0.00 0.00 37.83 33.21 3fpm s LYS 307 CO -0.02 0.00 1.75 1.15 -0.76 0.00 0.00 175.35 177.47 3fpm h THR 308 N 4.20 1.09 -2.97 2.17 2.02 -1.92 -3.41 112.91 114.09 3fpm h THR 308 Ca -0.43 -0.21 -0.57 0.00 0.77 0.00 0.00 66.41 65.97 3fpm h THR 308 Cb 1.21 0.81 -0.04 0.00 -1.74 0.00 0.00 68.15 68.39 3fpm h THR 308 CO 0.75 0.09 0.86 -0.70 0.37 0.00 0.00 175.52 176.88 3fpm s GLU 309 N -6.01 4.25 0.24 6.66 2.56 -1.26 -4.93 118.70 120.21 3fpm s GLU 309 Ca -0.13 1.59 -0.05 0.00 0.00 0.00 0.00 54.97 56.38 3fpm s GLU 309 Cb 0.08 -3.72 0.37 0.00 2.00 0.00 0.00 34.13 32.86 3fpm s GLU 309 CO 0.70 -0.66 1.83 -1.00 -0.56 0.00 0.00 175.26 175.57 3fpm h PRO 310 N 7.96 0.87 0.00 4.30 0.13 -1.96 -1.31 132.00 141.98 3fpm h PRO 310 Ca -0.25 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 3fpm h PRO 310 Cb 1.10 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 32.03 3fpm h PRO 310 CO 0.96 0.58 0.00 1.79 -0.23 0.00 0.00 178.00 181.10 3fpm h THR 311 N 0.90 0.00 0.00 1.56 1.35 -1.95 -2.02 112.91 112.74 3fpm h THR 311 Ca 0.39 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.95 3fpm h THR 311 Cb 0.26 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 67.78 3fpm h THR 311 CO -0.21 0.00 -1.00 0.00 -0.25 0.00 0.00 175.52 174.06 3fpm n GLN 312 N -2.44 0.33 -2.50 4.72 6.02 -0.54 -4.96 117.38 118.00 3fpm n GLN 312 Ca 0.02 0.01 -0.41 0.00 -0.01 0.00 0.00 57.00 56.61 3fpm n GLN 312 Cb 0.25 -1.62 -0.04 0.00 1.02 0.00 0.00 30.24 29.85 3fpm n GLN 312 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 3fpm s ARG 313 N -3.22 4.57 0.18 -1.09 3.52 -0.76 -4.94 118.95 117.21 3fpm s ARG 313 Ca 0.03 1.72 -0.32 0.00 -0.13 0.00 0.00 55.73 57.03 3fpm s ARG 313 Cb 0.14 -3.29 -0.16 0.00 -1.56 0.00 0.00 34.95 30.08 3fpm s ARG 313 CO 0.79 0.03 1.13 -0.12 -0.81 0.00 0.00 175.30 176.32 3fpm n MET 314 N 2.61 1.13 -2.43 5.12 0.00 -1.08 -4.98 117.12 117.48 3fpm n MET 314 Ca 0.04 0.40 -0.32 0.00 -0.00 0.00 0.00 57.70 57.82 3fpm n MET 314 Cb 0.46 -1.87 -0.03 0.00 0.00 0.00 0.00 33.22 31.78 3fpm n MET 314 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 3fpm s THR 315 N -0.29 4.61 0.37 1.12 -4.23 -1.26 -4.90 115.64 111.06 3fpm s THR 315 Ca 0.72 1.05 0.07 0.00 -1.18 0.00 0.00 61.69 62.35 3fpm s THR 315 Cb -0.85 -3.74 0.30 0.00 1.34 0.00 0.00 72.50 69.55 3fpm s THR 315 CO 0.53 -0.71 1.96 -0.29 -0.54 0.00 0.00 174.62 175.57 3fpm h ILE 316 N 0.80 0.99 -0.73 2.99 6.09 -1.94 -0.52 117.51 125.19 3fpm h ILE 316 Ca -0.47 -0.24 -0.07 0.00 -1.37 0.00 0.00 64.86 62.72 3fpm h ILE 316 Cb 1.19 0.25 -0.03 0.00 0.47 0.00 0.00 36.82 38.69 3fpm h ILE 316 CO 0.62 0.13 0.20 0.74 -3.07 0.00 0.00 178.15 176.77 3fpm h THR 317 N 0.69 1.26 -0.24 2.19 2.02 -1.98 -1.31 112.91 115.54 3fpm h THR 317 Ca 0.31 -0.95 -0.14 0.00 0.77 0.00 0.00 66.41 66.40 3fpm h THR 317 Cb 0.31 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 67.20 3fpm h THR 317 CO -0.10 0.37 -0.44 -0.33 0.37 0.00 0.00 175.52 175.39 3fpm h GLU 318 N 1.10 0.59 -0.14 6.66 5.08 -1.65 -2.71 114.58 123.51 3fpm h GLU 318 Ca 0.23 -0.32 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 3fpm h GLU 318 Cb 0.34 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 3fpm h GLU 318 CO -0.00 0.92 0.07 0.35 -1.00 0.00 0.00 179.01 179.35 3fpm h PHE 319 N 0.48 0.19 0.00 4.33 3.57 -0.69 -2.30 116.94 122.52 3fpm h PHE 319 Ca 0.03 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.46 3fpm h PHE 319 Cb 0.96 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.63 3fpm h PHE 319 CO 0.04 0.21 -0.31 0.52 -2.23 0.00 0.00 178.31 176.54 3fpm h MET 320 N 0.11 0.00 0.00 1.11 2.86 -1.28 -2.80 114.93 114.93 3fpm h MET 320 Ca 0.05 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.60 3fpm h MET 320 Cb 0.09 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.74 3fpm h MET 320 CO -0.01 0.31 -0.43 -0.91 1.06 0.00 0.00 176.91 176.93 3fpm h ASN 321 N 0.00 0.00 -2.99 1.22 2.35 -1.29 -3.32 115.58 111.54 3fpm h ASN 321 Ca -0.00 0.00 -0.54 0.00 -0.55 0.00 0.00 56.30 55.20 3fpm h ASN 321 Cb 0.76 0.00 0.08 0.00 0.05 0.00 0.00 38.32 39.21 3fpm h ASN 321 CO 0.04 0.43 0.85 1.57 -1.65 0.00 0.00 177.43 178.67 3fpm n HIS 322 N -3.34 2.67 -0.29 1.19 -0.00 -0.88 -4.68 115.22 109.89 3fpm n HIS 322 Ca 0.01 0.25 0.12 0.00 0.46 0.00 0.00 57.72 58.56 3fpm n HIS 322 Cb 0.63 -2.58 0.28 0.00 -0.12 0.00 0.00 29.99 28.19 3fpm n HIS 322 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 3fpm h PRO 323 N 5.09 0.29 -0.73 1.57 0.11 -1.89 0.15 132.00 136.59 3fpm h PRO 323 Ca -0.46 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 3fpm h PRO 323 Cb 1.23 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.24 3fpm h PRO 323 CO 0.82 0.20 0.42 2.35 -0.21 0.00 0.00 178.00 181.58 3fpm h TRP 324 N 0.30 0.97 0.03 0.65 7.01 -1.91 0.15 115.95 123.15 3fpm h TRP 324 Ca 0.53 -0.01 -0.08 0.00 2.11 0.00 0.00 58.89 61.45 3fpm h TRP 324 Cb 1.01 -0.32 -0.00 0.00 -2.10 0.00 0.00 29.16 27.75 3fpm h TRP 324 CO -0.21 0.66 -0.39 0.82 -2.79 0.00 0.00 178.44 176.53 3fpm h ILE 325 N 1.01 1.58 -0.71 2.65 1.08 -1.53 -3.34 117.51 118.24 3fpm h ILE 325 Ca 0.26 -2.35 -0.06 0.00 -0.39 0.00 0.00 64.86 62.32 3fpm h ILE 325 Cb -0.01 3.14 -0.03 0.00 -3.07 0.00 0.00 36.82 36.86 3fpm h ILE 325 CO -0.05 0.58 0.21 -0.03 -0.69 0.00 0.00 178.15 178.17 3fpm h MET 326 N -0.88 1.12 -2.88 2.37 4.05 -0.71 -3.21 114.93 114.79 3fpm h MET 326 Ca -0.09 -0.25 -0.79 0.00 -0.28 0.00 0.00 59.70 58.29 3fpm h MET 326 Cb 1.18 -0.16 -0.29 0.00 -0.80 0.00 0.00 31.60 31.52 3fpm h MET 326 CO -0.01 0.97 0.63 1.04 0.23 0.00 0.00 176.91 179.77 3fpm n GLN 327 N -4.27 4.24 0.23 0.39 1.13 0.53 -4.81 117.38 114.82 3fpm n GLN 327 Ca 0.05 -4.57 0.16 0.00 -1.94 0.00 0.00 57.00 50.71 3fpm n GLN 327 Cb 0.24 -2.49 0.70 0.00 0.11 0.00 0.00 30.24 28.80 3fpm n GLN 327 CO 0.00 0.00 0.00 0.77 -1.44 0.00 0.00 177.06 176.39 3fpm h SER 328 N 5.37 0.00 -0.67 1.08 0.02 -1.67 -3.00 113.55 114.68 3fpm h SER 328 Ca 0.20 0.00 -0.46 0.00 -0.84 0.00 0.00 61.79 60.69 3fpm h SER 328 Cb 0.63 0.00 -0.30 0.00 0.14 0.00 0.00 62.40 62.87 3fpm h SER 328 CO 1.27 0.00 -0.25 1.07 -1.14 0.00 0.00 176.83 177.78 3fpm n THR 329 N -2.72 2.77 0.00 -2.27 5.66 -1.26 -4.43 114.28 112.03 3fpm n THR 329 Ca 0.00 -3.52 0.00 0.00 -3.05 0.00 0.00 64.05 57.48 3fpm n THR 329 Cb 0.21 -0.90 0.00 0.00 -1.55 0.00 0.00 70.33 68.10 3fpm n THR 329 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 3fpm n LYS 330 N -0.88 3.13 -2.28 1.09 5.02 -1.13 -5.08 118.16 118.02 3fpm n LYS 330 Ca 0.44 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 56.32 3fpm n LYS 330 Cb 0.91 -0.27 -0.03 0.00 -0.02 0.00 0.00 35.03 35.62 3fpm n LYS 330 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3fpm s VAL 331 N -0.04 3.56 0.26 -0.18 0.11 -1.24 -4.98 120.40 117.89 3fpm s VAL 331 Ca 0.00 1.15 -0.27 0.00 -2.93 0.00 0.00 61.98 59.93 3fpm s VAL 331 Cb 0.00 -3.74 -0.15 0.00 -1.53 0.00 0.00 36.38 30.96 3fpm s VAL 331 CO 0.00 0.11 0.74 -2.65 -3.33 0.00 0.00 175.10 169.97 3fpm n PRO 332 N 3.65 0.67 -0.79 1.54 -0.02 -1.26 -4.62 135.00 134.18 3fpm n PRO 332 Ca 0.09 0.24 -0.15 0.00 -2.02 0.00 0.00 63.50 61.66 3fpm n PRO 332 Cb 0.44 -1.43 0.05 0.00 -0.02 0.00 0.00 33.50 32.54 3fpm n PRO 332 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 3fpm n GLN 333 N 0.84 1.73 -2.14 -0.52 7.27 -1.26 -3.79 117.38 119.51 3fpm n GLN 333 Ca 0.13 -1.51 -0.42 0.00 0.07 0.00 0.00 57.00 55.27 3fpm n GLN 333 Cb 0.30 -1.59 -0.03 0.00 2.41 0.00 0.00 30.24 31.32 3fpm n GLN 333 CO 0.00 0.00 0.00 -0.08 0.07 0.00 0.00 177.06 177.05 3fpm s THR 334 N -2.04 3.20 0.61 1.69 -1.32 -1.26 -4.67 115.64 111.85 3fpm s THR 334 Ca 0.29 0.87 -0.17 0.00 -1.21 0.00 0.00 61.69 61.47 3fpm s THR 334 Cb 0.24 -3.56 -0.03 0.00 -1.51 0.00 0.00 72.50 67.64 3fpm s THR 334 CO 0.01 0.07 1.15 -2.84 -2.21 0.00 0.00 174.62 170.81 3fpm s PRO 335 N 1.00 2.96 0.29 7.08 0.02 -1.26 -0.64 135.00 144.45 3fpm s PRO 335 Ca 0.65 1.62 0.11 0.00 0.02 0.00 0.00 61.00 63.39 3fpm s PRO 335 Cb -0.38 -1.95 -0.05 0.00 0.02 0.00 0.00 34.50 32.14 3fpm s PRO 335 CO 0.31 -1.17 -0.16 -0.51 -0.33 0.00 0.00 177.00 175.15 3fpm s LEU 336 N -4.33 2.62 0.00 -5.54 1.02 0.52 -4.81 118.68 108.17 3fpm s LEU 336 Ca 0.72 -1.09 0.21 0.00 0.02 0.00 0.00 54.13 54.00 3fpm s LEU 336 Cb -0.25 -1.02 0.55 0.00 0.02 0.00 0.00 46.19 45.50 3fpm s LEU 336 CO 0.35 -0.06 1.45 1.41 0.02 0.00 0.00 176.35 179.51 3fpm n HIS 337 N -0.65 0.43 -0.35 0.29 8.25 -1.26 -3.54 115.22 118.38 3fpm n HIS 337 Ca -0.05 -0.21 -0.06 0.00 -0.26 0.00 0.00 57.72 57.13 3fpm n HIS 337 Cb 0.61 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.69 3fpm n HIS 337 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 3fpm h THR 338 N 3.31 0.02 -0.63 1.59 2.02 -1.73 -2.14 112.91 115.35 3fpm h THR 338 Ca 0.00 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.24 3fpm h THR 338 Cb 0.73 0.02 -0.05 0.00 -1.74 0.00 0.00 68.15 67.11 3fpm h THR 338 CO 0.00 0.00 0.34 0.28 0.37 0.00 0.00 175.52 176.51 3fpm h SER 339 N -0.06 0.48 -0.79 4.18 0.02 -1.84 -1.85 113.55 113.69 3fpm h SER 339 Ca 0.24 0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.22 3fpm h SER 339 Cb 0.52 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 62.97 3fpm h SER 339 CO -0.90 0.31 0.49 0.03 -1.14 0.00 0.00 176.83 175.63 3fpm h ARG 340 N 0.62 1.07 -0.21 3.45 -0.00 -1.76 -3.04 114.38 114.52 3fpm h ARG 340 Ca 0.29 -0.09 -0.13 0.00 -0.50 0.00 0.00 59.98 59.55 3fpm h ARG 340 Cb 0.20 -0.23 -0.01 0.00 0.00 0.00 0.00 29.97 29.92 3fpm h ARG 340 CO -0.19 0.74 -0.40 0.28 0.00 0.00 0.00 179.97 180.40 3fpm h VAL 341 N 1.10 1.30 0.00 2.04 2.07 -1.17 -3.12 116.25 118.47 3fpm h VAL 341 Ca 0.29 -1.55 -0.06 0.00 0.82 0.00 0.00 66.70 66.19 3fpm h VAL 341 Cb -0.06 1.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 3fpm h VAL 341 CO -0.06 0.48 -0.31 -0.07 0.02 0.00 0.00 177.57 177.64 3fpm h LEU 342 N 0.40 0.00 -4.11 2.57 4.07 -1.37 -3.29 115.31 113.59 3fpm h LEU 342 Ca 0.04 0.00 -0.22 0.00 0.08 0.00 0.00 57.88 57.77 3fpm h LEU 342 Cb 0.88 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 42.56 3fpm h LEU 342 CO 0.07 0.31 -0.03 0.29 -1.08 0.00 0.00 178.44 178.01 3fpm n LYS 343 N -3.89 2.09 0.12 1.13 5.02 -1.18 -3.97 118.16 117.48 3fpm n LYS 343 Ca -0.02 -1.07 0.00 0.00 -2.02 0.00 0.00 58.31 55.20 3fpm n LYS 343 Cb 0.38 -2.05 0.00 0.00 -0.02 0.00 0.00 35.03 33.34 3fpm n LYS 343 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3fpm n GLU 344 N 2.60 0.00 0.00 1.97 4.71 -1.24 -5.10 120.64 123.59 3fpm n GLU 344 Ca 0.45 0.00 0.08 0.00 -0.01 0.00 0.00 57.16 57.68 3fpm n GLU 344 Cb 0.84 -0.16 0.50 0.00 -1.01 0.00 0.00 31.44 31.62 3fpm n GLU 344 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75