#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bue n THR 27 N 0.00 1.10 -1.62 -0.44 -1.04 -1.26 -4.85 114.28 106.17 1bue n THR 27 Ca 0.00 -0.27 -0.56 0.00 -2.04 0.00 0.00 64.05 61.17 1bue n THR 27 Cb 0.00 -1.62 -0.07 0.00 -1.82 0.00 0.00 70.33 66.82 1bue n THR 27 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 1bue n LYS 28 N 1.88 0.85 0.00 -2.82 0.00 -1.26 -2.35 118.16 114.46 1bue n LYS 28 Ca 0.10 0.31 0.00 0.00 -0.00 0.00 0.00 58.31 58.72 1bue n LYS 28 Cb 0.33 -1.93 0.00 0.00 -0.00 0.00 0.00 35.03 33.44 1bue n LYS 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1bue n GLY 29 N 2.94 2.88 0.11 2.58 0.00 -1.26 -4.90 105.19 107.54 1bue n GLY 29 Ca 0.22 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.13 1bue n GLY 29 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1bue h ILE 30 N 0.00 1.14 -0.37 -0.61 2.04 -1.83 -1.44 117.51 116.43 1bue h ILE 30 Ca 0.00 -0.40 -0.05 0.00 1.00 0.00 0.00 64.86 65.42 1bue h ILE 30 Cb 0.00 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 1bue h ILE 30 CO 0.00 0.13 0.04 0.44 0.00 0.00 0.00 178.15 178.76 1bue h ASP 31 N 0.14 0.53 -0.51 1.72 3.32 -1.91 -0.79 116.42 118.92 1bue h ASP 31 Ca 0.06 -0.09 -0.08 0.00 0.02 0.00 0.00 57.03 56.94 1bue h ASP 31 Cb 0.13 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 1bue h ASP 31 CO -0.01 0.57 0.00 -0.08 -1.72 0.00 0.00 179.24 178.01 1bue h GLU 32 N 0.55 0.91 -0.07 3.56 4.81 -1.87 -1.49 114.58 120.97 1bue h GLU 32 Ca 0.12 -0.29 -0.16 0.00 -0.13 0.00 0.00 59.36 58.91 1bue h GLU 32 Cb 0.29 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 1bue h GLU 32 CO 0.00 0.93 -0.65 0.97 -0.73 0.00 0.00 179.01 179.54 1bue h ILE 33 N 0.77 1.39 -0.76 2.32 6.09 -0.89 -1.91 117.51 124.53 1bue h ILE 33 Ca 0.15 -2.06 -0.05 0.00 -1.37 0.00 0.00 64.86 61.53 1bue h ILE 33 Cb 0.52 2.05 -0.03 0.00 0.47 0.00 0.00 36.82 39.82 1bue h ILE 33 CO 0.03 0.61 0.29 0.11 -3.07 0.00 0.00 178.15 176.12 1bue h LYS 34 N 0.21 1.15 -0.24 2.19 1.57 -0.93 -0.40 116.57 120.10 1bue h LYS 34 Ca -0.01 -0.22 -0.14 0.00 -1.87 0.00 0.00 60.65 58.41 1bue h LYS 34 Cb 1.18 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 1bue h LYS 34 CO 0.10 0.94 -0.44 -0.91 -0.57 0.00 0.00 179.45 178.58 1bue h ASN 35 N 1.11 0.65 -0.43 0.86 2.35 -1.15 -1.43 115.58 117.54 1bue h ASN 35 Ca 0.25 -0.30 -0.03 0.00 -0.55 0.00 0.00 56.30 55.67 1bue h ASN 35 Cb 0.23 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 1bue h ASN 35 CO -0.02 1.00 0.16 0.25 -1.65 0.00 0.00 177.43 177.17 1bue h LEU 36 N 0.49 0.60 -0.73 1.61 5.85 -0.93 -1.55 115.31 120.66 1bue h LEU 36 Ca 0.03 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.55 1bue h LEU 36 Cb 0.96 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.80 1bue h LEU 36 CO 0.09 0.62 0.36 -0.08 -0.34 0.00 0.00 178.44 179.09 1bue h GLU 37 N 0.55 1.04 -0.49 1.25 4.81 -0.93 -0.57 114.58 120.23 1bue h GLU 37 Ca 0.14 -0.14 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1bue h GLU 37 Cb 0.22 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 1bue h GLU 37 CO -0.01 0.80 0.19 1.15 -0.73 0.00 0.00 179.01 180.42 1bue h THR 38 N 1.01 1.21 -0.06 0.32 2.02 -1.00 -0.19 112.91 116.23 1bue h THR 38 Ca 0.25 -0.66 -0.10 0.00 0.77 0.00 0.00 66.41 66.67 1bue h THR 38 Cb 0.09 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 1bue h THR 38 CO -0.03 0.25 -0.45 0.44 0.37 0.00 0.00 175.52 176.10 1bue h ASP 39 N 0.65 0.13 0.99 4.18 3.32 -1.01 -2.63 116.42 122.06 1bue h ASP 39 Ca 0.16 -0.06 -0.11 0.00 0.02 0.00 0.00 57.03 57.05 1bue h ASP 39 Cb 0.20 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 1bue h ASP 39 CO -0.01 0.57 -0.51 0.15 -1.72 0.00 0.00 179.24 177.71 1bue h PHE 40 N 0.11 0.00 -5.62 4.55 3.57 -0.81 -3.48 116.94 115.27 1bue h PHE 40 Ca 0.01 0.00 -0.35 0.00 3.53 0.00 0.00 57.97 61.16 1bue h PHE 40 Cb 0.83 0.00 0.15 0.00 2.79 0.00 0.00 35.95 39.73 1bue h PHE 40 CO 0.01 0.51 -0.71 -1.71 -2.23 0.00 0.00 178.31 174.18 1bue n ASN 41 N -3.47 -3.88 0.00 0.41 4.05 -0.11 -4.97 115.26 107.29 1bue n ASN 41 Ca 0.00 -0.57 0.00 0.00 0.45 0.00 0.00 54.58 54.46 1bue n ASN 41 Cb 0.63 -4.96 0.00 0.00 1.23 0.00 0.00 39.78 36.68 1bue n ASN 41 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1bue n GLY 42 N -1.49 4.00 3.15 8.20 0.00 -1.18 -4.64 105.19 113.22 1bue n GLY 42 Ca -0.16 -0.88 -0.29 0.00 0.00 0.00 0.00 46.02 44.70 1bue n GLY 42 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1bue s ARG 43 N 1.47 2.55 -0.09 1.61 3.52 -0.15 -4.80 118.95 123.06 1bue s ARG 43 Ca 0.00 -0.71 0.05 0.00 -0.13 0.00 0.00 55.73 54.94 1bue s ARG 43 Cb 0.00 -1.97 -0.00 0.00 -1.56 0.00 0.00 34.95 31.42 1bue s ARG 43 CO 0.00 0.12 -0.24 0.42 -0.81 0.00 0.00 175.30 174.79 1bue s ILE 44 N 0.47 2.06 -0.09 4.11 1.01 -1.26 -1.91 121.20 125.58 1bue s ILE 44 Ca -0.17 -1.03 0.03 0.00 0.00 0.00 0.00 60.65 59.48 1bue s ILE 44 Cb -0.17 -1.77 0.00 0.00 0.01 0.00 0.00 42.46 40.54 1bue s ILE 44 CO 0.07 0.56 -0.20 -0.83 0.00 0.00 0.00 174.94 174.54 1bue s GLY 45 N 0.19 1.14 -0.02 6.18 0.00 0.81 -4.60 107.32 111.02 1bue s GLY 45 Ca -0.14 -0.78 -0.02 0.00 0.00 0.00 0.00 44.72 43.78 1bue s GLY 45 CO 0.07 -0.18 0.05 0.14 0.00 0.00 0.00 173.10 173.18 1bue s VAL 46 N 0.44 0.01 -0.07 1.40 1.01 -0.14 -0.60 120.40 122.45 1bue s VAL 46 Ca -0.17 -0.05 -0.03 0.00 0.00 0.00 0.00 61.98 61.73 1bue s VAL 46 Cb -0.17 -0.10 0.04 0.00 0.00 0.00 0.00 36.38 36.15 1bue s VAL 46 CO 0.07 -0.03 0.14 -0.47 0.00 0.00 0.00 175.10 174.81 1bue s TYR 47 N -0.06 -0.14 0.01 5.22 6.14 -0.42 -1.36 117.35 126.74 1bue s TYR 47 Ca -0.01 0.49 0.02 0.00 0.64 0.00 0.00 57.07 58.21 1bue s TYR 47 Cb -0.01 -0.18 -0.01 0.00 0.42 0.00 0.00 41.96 42.17 1bue s TYR 47 CO 0.00 -0.20 -0.07 0.00 0.64 0.00 0.00 175.55 175.92 1bue s ALA 48 N 1.64 0.60 -0.03 3.97 0.00 -0.09 -0.64 121.76 127.20 1bue s ALA 48 Ca -0.04 -0.45 -0.01 0.00 0.00 0.00 0.00 51.96 51.46 1bue s ALA 48 Cb -0.12 -0.09 0.02 0.00 0.00 0.00 0.00 23.12 22.93 1bue s ALA 48 CO -0.05 0.10 0.05 -1.17 0.00 0.00 0.00 175.76 174.69 1bue s LEU 49 N -0.60 1.35 -0.41 0.00 2.96 0.18 -1.36 118.68 120.79 1bue s LEU 49 Ca -0.01 0.10 -0.17 0.00 -0.22 0.00 0.00 54.13 53.83 1bue s LEU 49 Cb -0.05 0.09 0.02 0.00 0.50 0.00 0.00 46.19 46.75 1bue s LEU 49 CO 0.00 -0.08 0.42 -0.62 -1.32 0.00 0.00 176.35 174.75 1bue s ASP 50 N 0.64 6.19 0.21 3.68 -1.08 0.05 -0.73 116.67 125.64 1bue s ASP 50 Ca -0.05 -0.65 0.21 0.00 -0.52 0.00 0.00 52.55 51.54 1bue s ASP 50 Cb -0.07 -2.22 0.91 0.00 -1.46 0.00 0.00 42.92 40.08 1bue s ASP 50 CO -0.02 -0.55 1.64 0.35 0.52 0.00 0.00 175.17 177.11 1bue n THR 51 N 5.41 0.91 -0.04 1.71 -2.24 -0.87 -0.39 114.28 118.76 1bue n THR 51 Ca -0.08 0.29 -0.18 0.00 -2.27 0.00 0.00 64.05 61.81 1bue n THR 51 Cb 0.47 -1.20 -0.13 0.00 -2.10 0.00 0.00 70.33 67.38 1bue n THR 51 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1bue h GLY 52 N 2.02 0.11 0.16 3.38 0.00 -1.84 -3.39 103.07 103.51 1bue h GLY 52 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.05 1bue h GLY 52 CO 0.00 0.25 -1.71 -1.14 0.00 0.00 0.00 176.54 173.94 1bue n SER 53 N -4.36 0.25 0.00 0.19 3.41 -1.22 -4.98 113.62 106.91 1bue n SER 53 Ca -0.18 -0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.35 1bue n SER 53 Cb 0.66 1.62 0.00 0.00 -0.26 0.00 0.00 64.21 66.23 1bue n SER 53 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bue n GLY 54 N 1.28 0.86 3.77 5.00 0.00 0.47 -5.03 105.19 111.55 1bue n GLY 54 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 1bue n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bue s LYS 55 N -0.26 3.96 0.18 1.61 1.02 -1.24 -4.78 119.74 120.23 1bue s LYS 55 Ca 0.00 1.72 -0.03 0.00 0.02 0.00 0.00 55.97 57.69 1bue s LYS 55 Cb 0.00 -2.53 -0.03 0.00 -0.52 0.00 0.00 37.83 34.75 1bue s LYS 55 CO 0.00 -0.37 0.16 -1.54 -0.92 0.00 0.00 175.35 172.68 1bue s SER 56 N -1.34 0.16 -0.05 2.83 1.04 -0.86 -0.77 113.70 114.71 1bue s SER 56 Ca 0.60 -1.25 -0.02 0.00 0.48 0.00 0.00 55.95 55.76 1bue s SER 56 Cb -0.27 0.38 0.03 0.00 0.10 0.00 0.00 66.02 66.26 1bue s SER 56 CO 0.34 -0.85 0.10 0.12 0.98 0.00 0.00 173.24 173.94 1bue s PHE 57 N -4.10 -0.10 0.01 5.02 5.36 -0.46 -2.81 117.98 120.90 1bue s PHE 57 Ca 0.32 0.34 -0.02 0.00 -0.96 0.00 0.00 56.93 56.61 1bue s PHE 57 Cb 0.06 -0.11 -0.01 0.00 -0.34 0.00 0.00 43.02 42.62 1bue s PHE 57 CO 0.08 -0.13 0.02 -1.54 -1.46 0.00 0.00 175.22 172.19 1bue s SER 59 N 0.97 0.13 -0.24 6.13 1.04 -1.26 -0.91 113.70 119.56 1bue s SER 59 Ca -0.08 -0.30 -0.04 0.00 0.48 0.00 0.00 55.95 56.01 1bue s SER 59 Cb -0.10 0.11 0.13 0.00 0.10 0.00 0.00 66.02 66.26 1bue s SER 59 CO -0.04 -0.24 0.43 -0.47 0.98 0.00 0.00 173.24 173.90 1bue s TYR 60 N -1.07 -0.94 -1.39 5.02 5.04 -0.46 -4.86 117.35 118.69 1bue s TYR 60 Ca -0.12 1.25 -0.01 0.00 -2.44 0.00 0.00 57.07 55.75 1bue s TYR 60 Cb -0.07 0.22 0.01 0.00 0.35 0.00 0.00 41.96 42.47 1bue s TYR 60 CO -0.00 -0.65 0.12 0.54 -1.34 0.00 0.00 175.55 174.21 1bue n ARG 61 N 5.39 -2.47 0.25 4.97 1.74 -1.26 -0.97 116.66 124.32 1bue n ARG 61 Ca -0.05 0.77 0.17 0.00 -0.77 0.00 0.00 57.85 57.97 1bue n ARG 61 Cb 0.50 -5.43 0.78 0.00 -1.02 0.00 0.00 32.46 27.29 1bue n ARG 61 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1bue h ALA 62 N 1.00 1.00 -0.44 7.54 0.00 -1.90 -2.57 119.26 123.90 1bue h ALA 62 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1bue h ALA 62 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1bue h ALA 62 CO 0.47 0.00 0.00 0.27 0.00 0.00 0.00 179.25 179.99 1bue n ASN 63 N -2.84 3.36 -4.91 0.00 6.94 -1.26 -1.43 115.26 115.11 1bue n ASN 63 Ca -0.00 -1.95 -0.30 0.00 -0.02 0.00 0.00 54.58 52.31 1bue n ASN 63 Cb 0.20 -0.29 -0.04 0.00 -2.36 0.00 0.00 39.78 37.30 1bue n ASN 63 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1bue s GLU 64 N -1.21 3.58 0.22 -3.83 2.02 -0.97 -4.97 118.70 113.54 1bue s GLU 64 Ca 0.36 -0.18 -0.25 0.00 0.02 0.00 0.00 54.97 54.92 1bue s GLU 64 Cb 0.20 -2.83 -0.09 0.00 0.10 0.00 0.00 34.13 31.52 1bue s GLU 64 CO 0.27 0.42 0.82 1.03 0.02 0.00 0.00 175.26 177.82 1bue s ARG 65 N -3.00 4.54 0.01 1.61 0.52 -1.26 -4.17 118.95 117.20 1bue s ARG 65 Ca 0.40 1.17 -0.01 0.00 -0.52 0.00 0.00 55.73 56.77 1bue s ARG 65 Cb -0.12 -3.09 -0.01 0.00 0.52 0.00 0.00 34.95 32.25 1bue s ARG 65 CO 0.27 0.47 0.01 -0.06 0.02 0.00 0.00 175.30 176.01 1bue s PHE 66 N -1.33 0.19 0.34 -0.53 0.40 -0.45 -4.96 117.98 111.65 1bue s PHE 66 Ca 0.41 -0.40 -0.29 0.00 -0.60 0.00 0.00 56.93 56.06 1bue s PHE 66 Cb -0.21 -0.14 -0.11 0.00 0.51 0.00 0.00 43.02 43.07 1bue s PHE 66 CO 0.25 -0.19 1.40 -2.14 0.70 0.00 0.00 175.22 175.24 1bue s PRO 67 N -1.31 4.24 0.11 0.24 0.02 -1.26 -2.30 135.00 134.74 1bue s PRO 67 Ca -0.14 2.38 -0.09 0.00 0.02 0.00 0.00 61.00 63.16 1bue s PRO 67 Cb -0.09 -3.03 -0.15 0.00 0.02 0.00 0.00 34.50 31.26 1bue s PRO 67 CO -0.00 -0.36 1.27 -0.07 -0.33 0.00 0.00 177.00 177.51 1bue h LEU 68 N 3.35 0.75 0.00 -5.54 3.38 -1.43 -3.47 115.31 112.35 1bue h LEU 68 Ca -0.50 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 56.90 1bue h LEU 68 Cb 1.23 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1bue h LEU 68 CO 0.66 1.37 0.00 0.00 0.09 0.00 0.00 178.44 180.56 1bue n SER 70 N -0.28 0.00 0.19 0.00 7.64 -1.26 -3.77 113.62 116.14 1bue n SER 70 Ca 0.00 0.21 0.15 0.00 1.01 0.00 0.00 58.87 60.23 1bue n SER 70 Cb 0.00 -0.36 0.76 0.00 -1.01 0.00 0.00 64.21 63.60 1bue n SER 70 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1bue h SER 71 N 0.00 0.00 0.43 6.43 4.64 -1.35 -1.42 113.55 122.28 1bue h SER 71 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1bue h SER 71 Cb 0.21 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1bue h SER 71 CO 0.00 0.00 -0.07 2.19 -0.87 0.00 0.00 176.83 178.08 1bue h PHE 72 N 0.00 0.00 -0.11 4.77 -0.00 -1.76 -2.65 116.94 117.19 1bue h PHE 72 Ca 0.08 0.00 0.03 0.00 -0.00 0.00 0.00 57.97 58.08 1bue h PHE 72 Cb 0.38 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.32 1bue h PHE 72 CO 0.00 0.07 0.12 0.87 -0.00 0.00 0.00 178.31 179.37 1bue h LYS 73 N 0.00 0.00 -0.04 6.09 1.57 -1.55 0.55 116.57 123.19 1bue h LYS 73 Ca -0.00 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.66 1bue h LYS 73 Cb 0.31 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 1bue h LYS 73 CO 0.01 0.00 -0.55 0.78 -0.57 0.00 0.00 179.45 179.12 1bue h GLY 74 N 0.00 0.11 1.77 3.86 0.00 -1.67 -2.60 103.07 104.55 1bue h GLY 74 Ca 0.05 -0.13 -0.22 0.00 0.00 0.00 0.00 47.33 47.03 1bue h GLY 74 CO -0.00 0.12 -1.12 0.74 0.00 0.00 0.00 176.54 176.27 1bue h PHE 75 N 0.08 0.00 -0.77 5.60 0.04 -1.11 -3.22 116.94 117.56 1bue h PHE 75 Ca -0.00 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.74 1bue h PHE 75 Cb 0.99 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.11 1bue h PHE 75 CO 0.01 0.96 0.39 1.25 -0.60 0.00 0.00 178.31 180.32 1bue h LEU 76 N 0.00 0.99 -0.94 1.54 5.85 -1.10 -1.58 115.31 120.06 1bue h LEU 76 Ca -0.07 -0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.49 1bue h LEU 76 Cb 1.79 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 42.54 1bue h LEU 76 CO 0.11 0.83 0.31 0.00 -0.34 0.00 0.00 178.44 179.35 1bue h ALA 77 N 1.20 1.16 -0.24 1.25 0.00 -1.52 -2.21 119.26 118.90 1bue h ALA 77 Ca 0.27 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 1bue h ALA 77 Cb 0.09 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1bue h ALA 77 CO -0.04 0.61 -0.28 0.00 0.00 0.00 0.00 179.25 179.55 1bue h ALA 78 N 1.28 1.07 -0.64 0.00 0.00 -1.46 -2.07 119.26 117.45 1bue h ALA 78 Ca 0.25 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1bue h ALA 78 Cb 0.17 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1bue h ALA 78 CO -0.02 0.57 0.14 0.00 0.00 0.00 0.00 179.25 179.94 1bue h ALA 79 N 1.29 1.04 -0.51 0.00 0.00 -0.73 -0.02 119.26 120.32 1bue h ALA 79 Ca 0.06 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 1bue h ALA 79 Cb 0.70 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1bue h ALA 79 CO 0.05 0.63 0.02 0.28 0.00 0.00 0.00 179.25 180.23 1bue h VAL 80 N 0.97 1.26 -0.74 0.00 2.07 -1.10 -1.12 116.25 117.58 1bue h VAL 80 Ca 0.20 -1.06 -0.05 0.00 0.82 0.00 0.00 66.70 66.61 1bue h VAL 80 Cb 0.36 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1bue h VAL 80 CO 0.00 0.38 0.26 -0.07 0.02 0.00 0.00 177.57 178.15 1bue h LEU 81 N 0.76 1.06 -0.70 2.57 3.38 -0.99 -0.87 115.31 120.52 1bue h LEU 81 Ca 0.15 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 1bue h LEU 81 Cb 0.50 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 1bue h LEU 81 CO 0.02 0.96 0.13 0.50 0.09 0.00 0.00 178.44 180.15 1bue h LYS 82 N 1.10 1.13 -0.41 1.13 1.63 -0.79 -0.87 116.57 119.49 1bue h LYS 82 Ca 0.24 -0.29 -0.07 0.00 -0.85 0.00 0.00 60.65 59.68 1bue h LYS 82 Cb 0.27 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 31.74 1bue h LYS 82 CO -0.01 1.02 -0.03 0.78 -3.45 0.00 0.00 179.45 177.75 1bue h GLY 83 N 1.07 0.73 1.01 5.01 0.00 -0.77 -1.37 103.07 108.75 1bue h GLY 83 Ca 0.21 -0.48 -0.10 0.00 0.00 0.00 0.00 47.33 46.96 1bue h GLY 83 CO 0.01 0.45 -0.14 0.23 0.00 0.00 0.00 176.54 177.08 1bue h SER 84 N 0.63 0.85 -0.78 0.19 0.87 -0.76 -0.80 113.55 113.75 1bue h SER 84 Ca 0.12 -0.38 -0.05 0.00 -1.23 0.00 0.00 61.79 60.26 1bue h SER 84 Cb 0.44 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 62.13 1bue h SER 84 CO 0.02 1.04 0.30 -0.61 -0.53 0.00 0.00 176.83 177.05 1bue h GLN 85 N 0.65 1.18 0.00 2.24 4.15 -0.86 -1.70 115.11 120.77 1bue h GLN 85 Ca 0.10 -0.22 0.00 0.00 0.77 0.00 0.00 58.65 59.30 1bue h GLN 85 Cb 0.69 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.19 1bue h GLN 85 CO 0.05 0.96 0.00 -0.25 -1.93 0.00 0.00 178.83 177.66 1bue n ASP 86 N -4.27 0.00 -1.92 -0.69 8.00 -0.54 -4.88 116.55 112.25 1bue n ASP 86 Ca 0.07 -0.12 -0.17 0.00 0.71 0.00 0.00 54.79 55.28 1bue n ASP 86 Cb 0.19 -0.26 -0.01 0.00 -0.02 0.00 0.00 41.12 41.03 1bue n ASP 86 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1bue n ASN 87 N -1.26 -4.98 -0.02 -2.24 3.02 -0.64 -4.87 115.26 104.26 1bue n ASN 87 Ca 0.12 -0.01 -0.08 0.00 -0.03 0.00 0.00 54.58 54.58 1bue n ASN 87 Cb 0.18 -4.08 -0.14 0.00 -0.61 0.00 0.00 39.78 35.13 1bue n ASN 87 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 1bue n ARG 88 N -2.62 0.63 -4.34 3.52 0.63 -0.37 -4.93 116.66 109.18 1bue n ARG 88 Ca -0.20 0.29 -0.18 0.00 -0.92 0.00 0.00 57.85 56.84 1bue n ARG 88 Cb 0.65 -1.78 -0.10 0.00 0.45 0.00 0.00 32.46 31.67 1bue n ARG 88 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1bue s LEU 89 N -6.06 2.44 -0.12 6.15 1.43 -0.78 -4.99 118.68 116.75 1bue s LEU 89 Ca -0.05 -1.11 -0.01 0.00 -1.03 0.00 0.00 54.13 51.93 1bue s LEU 89 Cb 0.08 -0.49 0.03 0.00 0.03 0.00 0.00 46.19 45.84 1bue s LEU 89 CO 0.83 -0.34 -0.05 0.21 0.23 0.00 0.00 176.35 177.23 1bue s ASN 90 N -3.31 2.23 0.64 2.29 3.84 -1.26 -4.16 114.94 115.20 1bue s ASN 90 Ca 0.25 -0.36 0.39 0.00 0.21 0.00 0.00 52.86 53.35 1bue s ASN 90 Cb 0.03 -0.76 2.12 0.00 -0.55 0.00 0.00 41.25 42.09 1bue s ASN 90 CO 0.07 -0.16 2.19 -0.07 -2.79 0.00 0.00 177.10 176.35 1bue h LEU 91 N 8.20 0.00 -0.13 3.21 3.38 -1.94 -1.47 115.31 126.56 1bue h LEU 91 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1bue h LEU 91 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1bue h LEU 91 CO 0.37 0.00 -0.24 0.59 0.09 0.00 0.00 178.44 179.25 1bue n ASN 92 N -2.96 0.45 -4.71 -0.43 3.02 -1.26 -1.11 115.26 108.26 1bue n ASN 92 Ca -0.03 -0.27 -0.42 0.00 -0.03 0.00 0.00 54.58 53.84 1bue n ASN 92 Cb 0.16 -0.03 -0.03 0.00 -0.61 0.00 0.00 39.78 39.27 1bue n ASN 92 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1bue s GLN 93 N -2.78 4.13 -0.12 3.52 2.00 -0.55 -4.71 119.66 121.14 1bue s GLN 93 Ca 0.19 2.60 -0.28 0.00 -2.00 0.00 0.00 55.36 55.86 1bue s GLN 93 Cb 0.19 -3.29 -0.01 0.00 0.80 0.00 0.00 33.01 30.70 1bue s GLN 93 CO 0.57 -0.79 0.94 0.42 -0.50 0.00 0.00 175.29 175.94 1bue s ILE 94 N 1.81 4.82 -0.32 -2.34 -1.09 -1.26 -0.45 121.20 122.37 1bue s ILE 94 Ca 0.77 1.90 -0.14 0.00 -2.23 0.00 0.00 60.65 60.95 1bue s ILE 94 Cb -0.48 -4.25 -0.02 0.00 -1.58 0.00 0.00 42.46 36.13 1bue s ILE 94 CO 0.34 0.02 0.33 -0.69 -1.23 0.00 0.00 174.94 173.71 1bue s VAL 95 N 1.99 5.20 -0.16 2.92 1.01 0.10 -4.94 120.40 126.53 1bue s VAL 95 Ca 0.45 0.11 -0.12 0.00 0.00 0.00 0.00 61.98 62.42 1bue s VAL 95 Cb -0.18 -3.75 -0.05 0.00 0.00 0.00 0.00 36.38 32.40 1bue s VAL 95 CO 0.16 -0.00 0.22 0.20 0.00 0.00 0.00 175.10 175.69 1bue s ASN 96 N 1.72 6.38 -0.03 3.32 -0.87 -1.26 -2.59 114.94 121.62 1bue s ASN 96 Ca 0.11 0.44 0.14 0.00 -1.57 0.00 0.00 52.86 51.99 1bue s ASN 96 Cb -0.16 -2.14 0.25 0.00 -0.02 0.00 0.00 41.25 39.18 1bue s ASN 96 CO 0.11 0.19 1.11 0.00 -2.57 0.00 0.00 177.10 175.94 1bue n TYR 97 N 3.20 -0.03 0.23 2.20 4.11 -1.26 -4.94 117.16 120.67 1bue n TYR 97 Ca -0.15 -0.64 0.11 0.00 -0.00 0.00 0.00 57.90 57.23 1bue n TYR 97 Cb 0.52 0.19 0.54 0.00 -0.00 0.00 0.00 39.34 40.59 1bue n TYR 97 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.86 177.13 1bue n ASN 98 N 0.15 0.57 -0.85 9.48 6.94 -1.24 -1.88 115.26 128.42 1bue n ASN 98 Ca -0.09 0.72 0.02 0.00 -0.02 0.00 0.00 54.58 55.21 1bue n ASN 98 Cb 0.93 -0.81 0.21 0.00 -2.36 0.00 0.00 39.78 37.75 1bue n ASN 98 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1bue n THR 99 N -2.22 2.34 -4.74 5.53 -2.24 -1.26 -4.97 114.28 106.72 1bue n THR 99 Ca -0.00 -2.53 -0.33 0.00 -2.27 0.00 0.00 64.05 58.92 1bue n THR 99 Cb 0.10 -0.28 -0.16 0.00 -2.10 0.00 0.00 70.33 67.88 1bue n THR 99 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1bue s ARG 100 N -3.09 3.11 0.11 -0.78 3.52 -0.79 -5.09 118.95 115.94 1bue s ARG 100 Ca 0.41 -0.81 -0.31 0.00 -0.13 0.00 0.00 55.73 54.89 1bue s ARG 100 Cb 0.37 -2.48 -0.08 0.00 -1.56 0.00 0.00 34.95 31.19 1bue s ARG 100 CO 0.02 0.05 1.42 0.45 -0.81 0.00 0.00 175.30 176.42 1bue s SER 101 N 0.70 6.79 0.18 -2.12 0.15 -1.26 -4.99 113.70 113.15 1bue s SER 101 Ca -0.09 2.34 -0.18 0.00 0.70 0.00 0.00 55.95 58.72 1bue s SER 101 Cb -0.16 -2.58 -0.08 0.00 -1.71 0.00 0.00 66.02 61.49 1bue s SER 101 CO 0.01 -0.69 0.66 -0.76 1.20 0.00 0.00 173.24 173.66 1bue s LEU 102 N 1.29 4.38 0.87 3.45 1.43 -1.26 -5.07 118.68 123.78 1bue s LEU 102 Ca 0.65 1.32 -0.11 0.00 -1.03 0.00 0.00 54.13 54.96 1bue s LEU 102 Cb -0.37 -3.39 0.12 0.00 0.03 0.00 0.00 46.19 42.58 1bue s LEU 102 CO 0.30 0.09 1.09 -1.61 0.23 0.00 0.00 176.35 176.46 1bue s GLU 103 N -1.81 1.42 0.34 1.70 8.01 -1.26 -4.96 118.70 122.14 1bue s GLU 103 Ca 0.39 1.03 -0.29 0.00 0.01 0.00 0.00 54.97 56.12 1bue s GLU 103 Cb -0.17 -1.81 -0.11 0.00 -4.31 0.00 0.00 34.13 27.73 1bue s GLU 103 CO 0.20 -2.19 1.52 0.34 0.01 0.00 0.00 175.26 175.15 1bue n PHE 104 N -3.88 2.88 -2.78 1.61 7.35 -1.26 -3.65 117.46 117.74 1bue n PHE 104 Ca 0.08 0.37 -0.02 0.00 -0.76 0.00 0.00 57.45 57.12 1bue n PHE 104 Cb 0.54 -2.55 0.00 0.00 0.35 0.00 0.00 39.48 37.82 1bue n PHE 104 CO 0.00 0.00 0.00 1.58 -0.76 0.00 0.00 176.76 177.58 1bue n HIS 105 N 1.16 -2.72 -3.15 -5.13 -0.00 -1.26 -4.55 115.22 99.58 1bue n HIS 105 Ca 0.05 1.06 -0.22 0.00 0.46 0.00 0.00 57.72 59.07 1bue n HIS 105 Cb 0.38 -3.74 -0.04 0.00 -0.12 0.00 0.00 29.99 26.46 1bue n HIS 105 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 1bue n SER 106 N -1.20 1.75 -0.26 0.26 7.64 -1.24 -1.56 113.62 119.01 1bue n SER 106 Ca 0.04 -3.14 0.05 0.00 1.01 0.00 0.00 58.87 56.82 1bue n SER 106 Cb 0.46 -0.61 0.28 0.00 -1.01 0.00 0.00 64.21 63.34 1bue n SER 106 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1bue h PRO 107 N 3.22 0.89 0.04 1.43 0.13 -1.93 -2.35 132.00 133.43 1bue h PRO 107 Ca 0.11 -0.05 -0.24 0.00 -0.87 0.00 0.00 66.00 64.94 1bue h PRO 107 Cb 0.83 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 31.74 1bue h PRO 107 CO 0.59 0.59 -1.29 0.82 -0.23 0.00 0.00 178.00 178.48 1bue h ILE 108 N 0.92 0.97 -0.14 -3.56 1.08 -1.95 -3.34 117.51 111.49 1bue h ILE 108 Ca 0.36 -2.26 -0.02 0.00 -0.39 0.00 0.00 64.86 62.55 1bue h ILE 108 Cb 0.24 2.46 -0.01 0.00 -3.07 0.00 0.00 36.82 36.43 1bue h ILE 108 CO -0.13 0.50 -0.01 0.71 -0.69 0.00 0.00 178.15 178.53 1bue h THR 109 N -0.71 1.10 -0.43 -0.27 1.35 -1.97 -1.95 112.91 110.02 1bue h THR 109 Ca -0.32 -0.39 -0.07 0.00 -0.55 0.00 0.00 66.41 65.08 1bue h THR 109 Cb 1.48 1.01 -0.02 0.00 -1.73 0.00 0.00 68.15 68.88 1bue h THR 109 CO -0.10 0.13 -0.03 0.71 -0.25 0.00 0.00 175.52 175.98 1bue h THR 110 N 0.20 1.24 -0.49 6.82 1.35 -1.60 -2.22 112.91 118.21 1bue h THR 110 Ca 0.05 -1.01 -0.05 0.00 -0.55 0.00 0.00 66.41 64.85 1bue h THR 110 Cb 0.15 0.94 -0.02 0.00 -1.73 0.00 0.00 68.15 67.49 1bue h THR 110 CO 0.00 0.35 0.10 0.11 -0.25 0.00 0.00 175.52 175.83 1bue h LYS 111 N 0.68 0.75 -0.38 4.72 1.57 -1.48 -3.15 116.57 119.27 1bue h LYS 111 Ca 0.13 -0.15 -0.08 0.00 -1.87 0.00 0.00 60.65 58.68 1bue h LYS 111 Cb 0.46 -0.11 -0.05 0.00 0.08 0.00 0.00 32.23 32.61 1bue h LYS 111 CO 0.02 0.70 0.04 0.66 -0.57 0.00 0.00 179.45 180.29 1bue n TYR 112 N -4.28 1.30 -0.15 -1.35 4.01 -1.11 -4.71 117.16 110.88 1bue n TYR 112 Ca 0.03 -1.09 0.03 0.00 -0.16 0.00 0.00 57.90 56.71 1bue n TYR 112 Cb 0.23 -0.43 0.32 0.00 -0.31 0.00 0.00 39.34 39.15 1bue n TYR 112 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1bue h LYS 113 N 1.85 0.81 0.05 -0.72 3.64 -1.36 0.16 116.57 120.99 1bue h LYS 113 Ca 0.10 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1bue h LYS 113 Cb 1.68 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 33.32 1bue h LYS 113 CO 0.37 0.53 -0.03 -0.44 -2.27 0.00 0.00 179.45 177.61 1bue h ASP 114 N 0.83 -0.06 0.87 4.20 3.32 -1.86 -3.30 116.42 120.42 1bue h ASP 114 Ca 0.25 -0.40 -0.05 0.00 0.02 0.00 0.00 57.03 56.84 1bue h ASP 114 Cb -0.02 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 1bue h ASP 114 CO -0.06 0.38 -1.17 0.59 -1.72 0.00 0.00 179.24 177.26 1bue n ASN 115 N -4.91 0.83 0.00 6.45 5.03 -1.20 -4.86 115.26 116.59 1bue n ASN 115 Ca -0.08 0.33 0.00 0.00 0.87 0.00 0.00 54.58 55.70 1bue n ASN 115 Cb 0.24 0.40 0.00 0.00 -1.02 0.00 0.00 39.78 39.40 1bue n ASN 115 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1bue n GLY 116 N 1.25 0.10 3.03 7.41 0.00 0.54 -4.94 105.19 112.58 1bue n GLY 116 Ca -0.03 -1.94 -0.09 0.00 0.00 0.00 0.00 46.02 43.96 1bue n GLY 116 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1bue s MET 117 N -1.27 0.42 0.61 1.61 1.00 -1.07 -4.85 119.30 115.76 1bue s MET 117 Ca 0.00 -0.69 -0.17 0.00 0.00 0.00 0.00 55.69 54.83 1bue s MET 117 Cb 0.00 0.16 -0.03 0.00 0.00 0.00 0.00 34.83 34.96 1bue s MET 117 CO 0.00 -0.08 1.11 -1.54 0.00 0.00 0.00 175.02 174.51 1bue s SER 118 N -1.77 5.40 0.36 3.03 1.04 -1.26 0.02 113.70 120.53 1bue s SER 118 Ca -0.11 2.04 0.04 0.00 0.48 0.00 0.00 55.95 58.41 1bue s SER 118 Cb -0.06 -2.56 0.70 0.00 0.10 0.00 0.00 66.02 64.21 1bue s SER 118 CO -0.03 -1.43 2.01 0.25 0.98 0.00 0.00 173.24 175.02 1bue h LEU 119 N 0.50 0.67 -0.25 2.42 5.85 -0.50 -1.42 115.31 122.57 1bue h LEU 119 Ca -0.48 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.20 1bue h LEU 119 Cb 1.25 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.11 1bue h LEU 119 CO 0.55 0.47 0.05 1.23 -0.34 0.00 0.00 178.44 180.41 1bue h GLY 120 N 0.78 0.44 1.61 3.75 0.00 -1.40 -1.47 103.07 106.78 1bue h GLY 120 Ca 0.24 -0.28 -0.07 0.00 0.00 0.00 0.00 47.33 47.22 1bue h GLY 120 CO -0.06 0.26 -0.14 -0.55 0.00 0.00 0.00 176.54 176.06 1bue h ASP 121 N 0.23 0.45 -0.45 0.19 3.32 -1.72 -1.88 116.42 116.56 1bue h ASP 121 Ca 0.08 -0.12 -0.13 0.00 0.02 0.00 0.00 57.03 56.88 1bue h ASP 121 Cb 0.30 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1bue h ASP 121 CO 0.00 0.62 -0.21 -0.03 -1.72 0.00 0.00 179.24 177.91 1bue h MET 122 N 0.43 0.94 -0.60 3.56 4.05 -1.09 -1.51 114.93 120.72 1bue h MET 122 Ca 0.08 -0.41 -0.07 0.00 -0.28 0.00 0.00 59.70 59.02 1bue h MET 122 Cb 0.50 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.24 1bue h MET 122 CO 0.03 1.07 0.08 0.00 0.23 0.00 0.00 176.91 178.32 1bue h ALA 123 N 0.85 0.80 -0.82 0.39 0.00 -1.04 -1.81 119.26 117.62 1bue h ALA 123 Ca 0.10 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1bue h ALA 123 Cb 0.78 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 1bue h ALA 123 CO 0.06 0.56 0.36 0.00 0.00 0.00 0.00 179.25 180.24 1bue h ALA 124 N 1.01 1.10 -0.45 0.00 0.00 -1.22 -2.67 119.26 117.03 1bue h ALA 124 Ca 0.18 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1bue h ALA 124 Cb 0.44 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1bue h ALA 124 CO 0.01 0.66 -0.14 0.00 0.00 0.00 0.00 179.25 179.78 1bue h ALA 125 N 1.22 0.91 -0.70 0.00 0.00 -0.98 0.16 119.26 119.87 1bue h ALA 125 Ca 0.28 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1bue h ALA 125 Cb 0.16 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1bue h ALA 125 CO -0.03 0.63 0.43 0.00 0.00 0.00 0.00 179.25 180.28 1bue h ALA 126 N 1.09 1.45 0.00 0.00 0.00 -1.02 -1.00 119.26 119.78 1bue h ALA 126 Ca 0.12 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1bue h ALA 126 Cb 0.65 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1bue h ALA 126 CO 0.05 0.49 -0.06 1.25 0.00 0.00 0.00 179.25 180.97 1bue h LEU 127 N 0.95 0.00 -1.54 0.00 6.46 -1.18 -2.77 115.31 117.23 1bue h LEU 127 Ca 0.25 0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.97 1bue h LEU 127 Cb -0.06 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 39.86 1bue h LEU 127 CO -0.05 0.53 -0.17 1.56 -0.62 0.00 0.00 178.44 179.69 1bue h GLN 128 N -1.00 0.08 0.00 1.25 4.20 -0.71 -3.16 115.11 115.77 1bue h GLN 128 Ca 0.00 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1bue h GLN 128 Cb 0.06 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.83 1bue h GLN 128 CO 0.00 0.26 0.00 0.66 -0.67 0.00 0.00 178.83 179.08 1bue n TYR 129 N -4.30 0.00 -2.82 2.96 4.02 -0.40 -2.16 117.16 114.46 1bue n TYR 129 Ca -0.02 -0.16 -0.20 0.00 -0.01 0.00 0.00 57.90 57.51 1bue n TYR 129 Cb 0.26 -0.02 0.01 0.00 -0.02 0.00 0.00 39.34 39.57 1bue n TYR 129 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1bue n SER 130 N -0.16 -5.24 -4.63 7.72 2.88 -1.05 -4.86 113.62 108.29 1bue n SER 130 Ca 0.00 -0.15 -0.43 0.00 -1.33 0.00 0.00 58.87 56.96 1bue n SER 130 Cb 0.08 -4.31 -0.03 0.00 -0.75 0.00 0.00 64.21 59.19 1bue n SER 130 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1bue n ASP 131 N -2.23 3.70 0.02 -3.46 -0.08 -1.10 -4.89 116.55 108.51 1bue n ASP 131 Ca -0.14 0.63 -0.09 0.00 -1.51 0.00 0.00 54.79 53.69 1bue n ASP 131 Cb 0.62 -1.52 0.07 0.00 2.34 0.00 0.00 41.12 42.63 1bue n ASP 131 CO 0.00 0.00 0.00 0.78 0.12 0.00 0.00 177.20 178.10 1bue h ASN 132 N 12.24 0.54 -0.24 1.67 2.35 -1.53 -1.79 115.58 128.83 1bue h ASN 132 Ca -0.46 -0.29 -0.02 0.00 -0.55 0.00 0.00 56.30 54.98 1bue h ASN 132 Cb 1.25 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 39.45 1bue h ASN 132 CO 0.95 0.99 0.07 1.23 -1.65 0.00 0.00 177.43 179.02 1bue h GLY 133 N 1.14 0.40 1.00 2.83 0.00 -1.83 -0.93 103.07 105.70 1bue h GLY 133 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.09 1bue h GLY 133 CO 0.10 0.23 0.42 0.00 0.00 0.00 0.00 176.54 177.29 1bue h ALA 134 N 0.89 0.84 0.30 3.60 0.00 -1.88 -0.58 119.26 122.43 1bue h ALA 134 Ca 0.08 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1bue h ALA 134 Cb 0.26 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1bue h ALA 134 CO -0.00 0.29 -0.14 1.15 0.00 0.00 0.00 179.25 180.55 1bue h THR 135 N 0.90 0.71 -0.30 0.00 2.02 -1.13 -1.79 112.91 113.33 1bue h THR 135 Ca 0.24 -0.07 -0.11 0.00 0.77 0.00 0.00 66.41 67.24 1bue h THR 135 Cb -0.07 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 1bue h THR 135 CO -0.05 0.02 -0.27 0.78 0.37 0.00 0.00 175.52 176.37 1bue h ASN 136 N -0.44 0.61 -0.31 4.18 2.35 -1.03 -1.40 115.58 119.54 1bue h ASN 136 Ca -0.04 -0.22 -0.02 0.00 -0.55 0.00 0.00 56.30 55.46 1bue h ASN 136 Cb 0.34 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 1bue h ASN 136 CO 0.07 0.86 0.10 0.40 -1.65 0.00 0.00 177.43 177.20 1bue h ILE 137 N 0.52 1.20 -0.69 2.81 2.04 -1.07 -0.28 117.51 122.04 1bue h ILE 137 Ca 0.07 -0.64 -0.06 0.00 1.00 0.00 0.00 64.86 65.23 1bue h ILE 137 Cb 0.74 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.83 1bue h ILE 137 CO 0.06 0.22 0.18 0.40 0.00 0.00 0.00 178.15 179.00 1bue h ILE 138 N 0.34 1.26 -0.54 -0.67 2.04 -1.21 -0.95 117.51 117.79 1bue h ILE 138 Ca 0.10 -0.94 -0.05 0.00 1.00 0.00 0.00 64.86 64.97 1bue h ILE 138 Cb 0.23 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 1bue h ILE 138 CO -0.00 0.36 0.16 -0.07 0.00 0.00 0.00 178.15 178.60 1bue h LEU 139 N 1.03 0.80 -0.30 1.44 3.38 -1.08 -0.78 115.31 119.80 1bue h LEU 139 Ca 0.22 -0.21 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1bue h LEU 139 Cb 0.35 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1bue h LEU 139 CO 0.00 0.80 -0.09 -0.33 0.09 0.00 0.00 178.44 178.91 1bue h GLU 140 N 0.75 0.59 0.00 1.13 5.08 -0.80 0.35 114.58 121.68 1bue h GLU 140 Ca 0.17 -0.24 -0.29 0.00 -1.00 0.00 0.00 59.36 58.01 1bue h GLU 140 Cb 0.30 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.47 1bue h GLU 140 CO -0.00 0.79 -1.97 0.54 -1.00 0.00 0.00 179.01 177.37 1bue n ARG 140 N -4.46 0.66 0.00 2.33 1.74 -0.38 -4.63 116.66 111.91 1bue n ARG 140 Ca -0.03 0.13 0.00 0.00 -0.77 0.00 0.00 57.85 57.18 1bue n ARG 140 Cb 0.34 -1.66 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 1bue n ARG 140 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1bue n TYR 141 N -2.85 0.00 0.01 -1.55 4.01 -0.36 -4.84 117.16 111.58 1bue n TYR 141 Ca -0.22 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.57 1bue n TYR 141 Cb 1.04 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.96 1bue n TYR 141 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 1bue n ILE 142 N -1.97 0.71 -0.77 -0.72 2.08 -0.83 -5.01 119.36 112.86 1bue n ILE 142 Ca 0.00 -0.62 0.00 0.00 0.56 0.00 0.00 62.75 62.69 1bue n ILE 142 Cb 0.47 -0.37 0.00 0.00 -0.75 0.00 0.00 39.64 38.99 1bue n ILE 142 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1bue n GLY 143 N 1.36 1.34 7.00 7.39 0.00 -0.80 -4.07 105.19 117.41 1bue n GLY 143 Ca -0.09 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1bue n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bue n GLY 144 N -0.88 -1.05 0.37 -0.02 0.00 0.12 -1.82 105.19 101.90 1bue n GLY 144 Ca 0.00 -1.11 0.14 0.00 0.00 0.00 0.00 46.02 45.06 1bue n GLY 144 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1bue h PRO 145 N 0.00 0.67 -0.41 1.61 0.11 -1.88 -0.94 132.00 131.16 1bue h PRO 145 Ca 0.00 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.04 1bue h PRO 145 Cb 0.00 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 30.94 1bue h PRO 145 CO 0.00 0.44 0.15 0.93 -0.21 0.00 0.00 178.00 179.32 1bue h GLU 146 N 0.69 0.62 -0.54 1.05 5.08 -1.77 -1.09 114.58 118.63 1bue h GLU 146 Ca 0.55 -0.12 -0.11 0.00 -1.00 0.00 0.00 59.36 58.68 1bue h GLU 146 Cb 0.96 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.09 1bue h GLU 146 CO -0.33 0.60 -0.10 0.78 -1.00 0.00 0.00 179.01 178.96 1bue h GLY 147 N 0.52 1.09 0.95 -3.84 0.00 -0.51 -0.16 103.07 101.11 1bue h GLY 147 Ca 0.14 -0.86 -0.02 0.00 0.00 0.00 0.00 47.33 46.58 1bue h GLY 147 CO -0.01 0.79 0.18 1.98 0.00 0.00 0.00 176.54 179.48 1bue h MET 148 N 0.90 0.60 -0.69 4.80 1.85 -1.07 -1.02 114.93 120.30 1bue h MET 148 Ca 0.14 -0.10 -0.06 0.00 -0.61 0.00 0.00 59.70 59.07 1bue h MET 148 Cb 0.65 -0.10 -0.03 0.00 0.43 0.00 0.00 31.60 32.55 1bue h MET 148 CO 0.05 0.54 0.19 1.15 -0.40 0.00 0.00 176.91 178.44 1bue h THR 149 N 0.52 1.26 -0.85 -0.77 2.02 -1.09 -2.37 112.91 111.63 1bue h THR 149 Ca 0.14 -0.93 -0.02 0.00 0.77 0.00 0.00 66.41 66.37 1bue h THR 149 Cb 0.15 0.54 -0.04 0.00 -1.74 0.00 0.00 68.15 67.06 1bue h THR 149 CO -0.01 0.36 0.44 0.11 0.37 0.00 0.00 175.52 176.79 1bue h LYS 150 N 1.03 1.21 -0.55 6.66 1.57 -0.69 -1.47 116.57 124.33 1bue h LYS 150 Ca 0.22 -0.16 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 1bue h LYS 150 Cb 0.34 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 1bue h LYS 150 CO -0.00 0.91 0.25 0.35 -0.57 0.00 0.00 179.45 180.39 1bue h PHE 151 N 1.20 0.81 -0.58 -1.35 3.57 -0.85 -1.67 116.94 118.07 1bue h PHE 151 Ca 0.30 -0.05 -0.07 0.00 3.53 0.00 0.00 57.97 61.68 1bue h PHE 151 Cb 0.07 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.54 1bue h PHE 151 CO 0.01 0.63 0.09 0.52 -2.23 0.00 0.00 178.31 177.33 1bue h MET 152 N 0.75 0.94 -0.67 1.11 2.86 -1.05 -2.40 114.93 116.47 1bue h MET 152 Ca 0.19 -0.24 -0.04 0.00 -2.06 0.00 0.00 59.70 57.56 1bue h MET 152 Cb 0.14 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.65 1bue h MET 152 CO -0.02 0.88 0.27 0.00 1.06 0.00 0.00 176.91 179.10 1bue h ARG 153 N 0.89 0.98 0.00 1.72 2.47 -0.95 -1.70 114.38 117.79 1bue h ARG 153 Ca 0.18 -0.16 -0.03 0.00 -1.26 0.00 0.00 59.98 58.72 1bue h ARG 153 Cb 0.40 -0.17 -0.00 0.00 -1.65 0.00 0.00 29.97 28.55 1bue h ARG 153 CO 0.01 0.80 -0.12 0.66 0.56 0.00 0.00 179.97 181.87 1bue h SER 154 N 0.97 0.00 -0.51 7.04 4.64 -0.80 -2.10 113.55 122.78 1bue h SER 154 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1bue h SER 154 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1bue h SER 154 CO -0.02 0.12 0.00 2.30 -0.87 0.00 0.00 176.83 178.36 1bue n ILE 155 N -3.60 0.68 -0.08 0.95 -5.35 -0.92 -4.93 119.36 106.10 1bue n ILE 155 Ca -0.02 -0.73 0.00 0.00 -0.27 0.00 0.00 62.75 61.73 1bue n ILE 155 Cb 0.25 0.48 0.00 0.00 -1.74 0.00 0.00 39.64 38.63 1bue n ILE 155 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1bue n GLY 156 N 1.41 0.70 3.54 3.28 0.00 -0.79 -4.99 105.19 108.35 1bue n GLY 156 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 1bue n GLY 156 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bue s ASP 157 N -2.61 6.42 0.04 1.61 -1.08 -0.69 -4.90 116.67 115.47 1bue s ASP 157 Ca 0.00 -0.09 0.23 0.00 -0.52 0.00 0.00 52.55 52.17 1bue s ASP 157 Cb 0.00 -2.41 0.15 0.00 -1.46 0.00 0.00 42.92 39.20 1bue s ASP 157 CO 0.00 -0.99 1.12 -0.62 0.52 0.00 0.00 175.17 175.21 1bue n GLU 158 N 6.91 0.19 -0.05 4.34 -0.58 -1.26 -3.59 120.64 126.60 1bue n GLU 158 Ca 0.03 0.00 -0.15 0.00 -0.42 0.00 0.00 57.16 56.62 1bue n GLU 158 Cb 0.48 -1.57 -0.14 0.00 -0.57 0.00 0.00 31.44 29.64 1bue n GLU 158 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1bue n ASP 159 N -1.82 1.39 -4.75 1.62 8.00 -1.26 -4.98 116.55 114.76 1bue n ASP 159 Ca 0.03 0.15 -0.42 0.00 0.71 0.00 0.00 54.79 55.27 1bue n ASP 159 Cb 0.40 -0.23 -0.01 0.00 -0.02 0.00 0.00 41.12 41.26 1bue n ASP 159 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1bue n PHE 160 N -3.19 2.84 -3.66 1.24 -0.00 -1.26 -4.53 117.46 108.89 1bue n PHE 160 Ca -0.31 0.37 -0.08 0.00 -0.00 0.00 0.00 57.45 57.43 1bue n PHE 160 Cb 1.06 -2.55 -0.09 0.00 -0.00 0.00 0.00 39.48 37.90 1bue n PHE 160 CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 176.76 175.78 1bue s ARG 161 N -1.34 0.37 -0.22 -4.13 1.70 -0.89 -4.95 118.95 109.48 1bue s ARG 161 Ca 0.59 1.07 -0.04 0.00 -0.47 0.00 0.00 55.73 56.87 1bue s ARG 161 Cb -0.50 0.36 -0.01 0.00 -0.57 0.00 0.00 34.95 34.23 1bue s ARG 161 CO 0.57 -0.23 -0.02 -1.17 -1.08 0.00 0.00 175.30 173.36 1bue s LEU 162 N 2.50 3.01 -0.04 -1.89 2.96 -1.26 -2.63 118.68 121.33 1bue s LEU 162 Ca -0.03 -0.35 0.08 0.00 -0.22 0.00 0.00 54.13 53.61 1bue s LEU 162 Cb -0.11 -1.77 -0.12 0.00 0.50 0.00 0.00 46.19 44.68 1bue s LEU 162 CO -0.14 -0.02 0.12 0.47 -1.32 0.00 0.00 176.35 175.46 1bue n ASP 163 N 4.78 3.03 -4.45 3.68 8.00 -1.26 -4.39 116.55 125.94 1bue n ASP 163 Ca -0.18 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.11 1bue n ASP 163 Cb 0.51 1.08 -0.11 0.00 -0.02 0.00 0.00 41.12 42.58 1bue n ASP 163 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1bue s ARG 164 N -2.42 1.63 0.60 -1.24 0.52 -1.26 -4.90 118.95 111.89 1bue s ARG 164 Ca -0.04 -1.90 0.03 0.00 -0.52 0.00 0.00 55.73 53.31 1bue s ARG 164 Cb 0.04 -0.89 0.07 0.00 0.52 0.00 0.00 34.95 34.69 1bue s ARG 164 CO 0.34 -0.16 0.83 -1.58 0.02 0.00 0.00 175.30 174.75 1bue s TRP 165 N -3.27 2.14 0.26 -0.53 0.52 -1.26 -4.68 118.94 112.12 1bue s TRP 165 Ca 0.36 -0.28 -0.29 0.00 0.02 0.00 0.00 56.10 55.90 1bue s TRP 165 Cb 0.08 -2.69 -0.09 0.00 -1.15 0.00 0.00 33.47 29.62 1bue s TRP 165 CO 0.15 -1.17 1.01 -1.21 0.02 0.00 0.00 176.95 175.75 1bue s GLU 166 N -4.83 4.75 -0.05 4.98 0.41 -1.26 -1.61 118.70 121.09 1bue s GLU 166 Ca 0.61 1.61 0.17 0.00 -0.41 0.00 0.00 54.97 56.95 1bue s GLU 166 Cb -0.08 -3.21 0.55 0.00 -1.78 0.00 0.00 34.13 29.62 1bue s GLU 166 CO 0.40 0.37 1.47 1.28 -0.49 0.00 0.00 175.26 178.29 1bue n LEU 167 N 1.30 3.87 0.26 1.80 4.32 -1.26 -4.92 117.00 122.36 1bue n LEU 167 Ca -0.01 -2.21 0.09 0.00 -0.02 0.00 0.00 56.01 53.86 1bue n LEU 167 Cb 0.46 -0.44 0.68 0.00 -1.62 0.00 0.00 43.42 42.50 1bue n LEU 167 CO 0.51 0.84 1.02 0.44 -1.22 0.00 0.00 177.39 178.98 1bue h ASP 168 N 3.34 0.00 0.26 -1.43 3.32 -1.69 -2.78 116.42 117.44 1bue h ASP 168 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1bue h ASP 168 Cb 1.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.63 1bue h ASP 168 CO 0.08 0.07 0.00 0.00 -1.72 0.00 0.00 179.24 177.67 1bue n LEU 169 N -4.20 0.00 -0.60 1.55 -0.00 -0.71 -3.29 117.00 109.74 1bue n LEU 169 Ca -0.03 0.35 0.08 0.00 -0.00 0.00 0.00 56.01 56.41 1bue n LEU 169 Cb 0.15 -0.35 0.26 0.00 -0.00 0.00 0.00 43.42 43.48 1bue n LEU 169 CO 0.33 -0.22 0.70 0.59 -0.00 0.00 0.00 177.39 178.79 1bue n ASN 170 N -1.35 1.77 -0.09 1.45 3.02 -1.05 -4.48 115.26 114.53 1bue n ASN 170 Ca 0.05 -1.86 0.10 0.00 -0.03 0.00 0.00 54.58 52.84 1bue n ASN 170 Cb 0.10 -0.17 0.46 0.00 -0.61 0.00 0.00 39.78 39.56 1bue n ASN 170 CO 0.00 0.00 0.00 0.71 -2.62 0.00 0.00 177.26 175.35 1bue h THR 171 N 2.12 0.94 -6.23 3.41 1.35 -1.81 -3.42 112.91 109.27 1bue h THR 171 Ca 0.00 -0.17 -0.48 0.00 -0.55 0.00 0.00 66.41 65.21 1bue h THR 171 Cb 0.48 0.41 -0.12 0.00 -1.73 0.00 0.00 68.15 67.18 1bue h THR 171 CO 0.00 0.09 -0.73 0.00 -0.25 0.00 0.00 175.52 174.63 1bue n ALA 172 N -2.50 -1.20 -2.20 6.62 0.00 -1.26 -4.77 120.51 115.20 1bue n ALA 172 Ca 0.09 0.09 -0.42 0.00 0.00 0.00 0.00 53.44 53.20 1bue n ALA 172 Cb 0.32 -3.62 -0.03 0.00 0.00 0.00 0.00 19.45 16.12 1bue n ALA 172 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1bue s ILE 173 N -3.18 3.43 0.23 0.00 1.01 -1.26 -4.76 121.20 116.66 1bue s ILE 173 Ca 0.63 1.00 -0.32 0.00 0.00 0.00 0.00 60.65 61.96 1bue s ILE 173 Cb -0.33 -3.64 -0.13 0.00 0.01 0.00 0.00 42.46 38.37 1bue s ILE 173 CO 0.77 0.07 1.57 -2.65 0.00 0.00 0.00 174.94 174.70 1bue n PRO 174 N 4.14 2.41 0.00 2.79 -0.02 -1.26 -2.02 135.00 141.04 1bue n PRO 174 Ca 0.11 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.46 1bue n PRO 174 Cb 0.43 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.28 1bue n PRO 174 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bue n GLY 175 N 2.90 3.07 3.70 -1.23 0.00 -1.26 -5.01 105.19 107.36 1bue n GLY 175 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1bue n GLY 175 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bue s ASP 176 N -1.21 7.06 0.00 1.61 -1.08 -0.86 -4.94 116.67 117.26 1bue s ASP 176 Ca 0.00 1.95 0.26 0.00 -0.52 0.00 0.00 52.55 54.24 1bue s ASP 176 Cb 0.00 -2.57 0.70 0.00 -1.46 0.00 0.00 42.92 39.58 1bue s ASP 176 CO 0.00 -0.52 1.53 -0.62 0.52 0.00 0.00 175.17 176.08 1bue n GLU 177 N 4.43 0.84 -2.20 4.34 1.02 -1.26 -4.89 120.64 122.92 1bue n GLU 177 Ca 0.10 -0.52 -0.41 0.00 -0.02 0.00 0.00 57.16 56.32 1bue n GLU 177 Cb 0.46 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.37 1bue n GLU 177 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1bue s ARG 178 N -2.51 4.42 -1.31 3.49 0.52 -1.26 -3.66 118.95 118.64 1bue s ARG 178 Ca 0.24 2.11 -0.01 0.00 -0.52 0.00 0.00 55.73 57.55 1bue s ARG 178 Cb 0.19 -3.11 0.00 0.00 0.52 0.00 0.00 34.95 32.56 1bue s ARG 178 CO 0.53 -0.11 0.75 -0.25 0.02 0.00 0.00 175.30 176.24 1bue n ASP 179 N 1.06 -1.49 -4.21 0.23 8.00 -1.16 -4.91 116.55 114.08 1bue n ASP 179 Ca 0.00 -0.79 -0.17 0.00 0.71 0.00 0.00 54.79 54.54 1bue n ASP 179 Cb 0.42 -4.18 -0.10 0.00 -0.02 0.00 0.00 41.12 37.25 1bue n ASP 179 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1bue s THR 180 N -3.61 0.48 0.17 -3.53 -4.23 -1.08 -1.07 115.64 102.76 1bue s THR 180 Ca 0.04 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 58.47 1bue s THR 180 Cb -0.02 -2.59 0.03 0.00 1.34 0.00 0.00 72.50 71.27 1bue s THR 180 CO 0.80 0.00 0.44 -0.24 -0.54 0.00 0.00 174.62 175.09 1bue n SER 181 N -0.64 -1.10 -4.57 3.99 2.88 -0.97 -2.10 113.62 111.11 1bue n SER 181 Ca 0.00 -1.71 -0.27 0.00 -1.33 0.00 0.00 58.87 55.56 1bue n SER 181 Cb 0.66 1.81 -0.09 0.00 -0.75 0.00 0.00 64.21 65.84 1bue n SER 181 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1bue s THR 182 N -2.47 3.21 0.36 2.46 -4.23 -1.26 -1.34 115.64 112.37 1bue s THR 182 Ca 0.09 -1.58 0.06 0.00 -1.18 0.00 0.00 61.69 59.08 1bue s THR 182 Cb -0.02 -2.57 0.29 0.00 1.34 0.00 0.00 72.50 71.54 1bue s THR 182 CO 0.05 -0.06 1.96 -0.65 -0.54 0.00 0.00 174.62 175.38 1bue h PRO 183 N 3.06 0.72 -0.34 3.99 0.11 -1.70 -1.21 132.00 136.64 1bue h PRO 183 Ca -0.47 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.53 1bue h PRO 183 Cb 1.20 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1bue h PRO 183 CO 0.53 0.48 -0.04 0.00 -0.21 0.00 0.00 178.00 178.76 1bue h ALA 184 N 1.61 0.46 -0.66 -0.75 0.00 -1.59 -1.53 119.26 116.79 1bue h ALA 184 Ca 0.31 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1bue h ALA 184 Cb 0.26 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1bue h ALA 184 CO -0.10 0.26 0.09 0.00 0.00 0.00 0.00 179.25 179.50 1bue h ALA 185 N 0.83 0.88 -0.40 0.00 0.00 -1.67 -0.59 119.26 118.31 1bue h ALA 185 Ca 0.09 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 1bue h ALA 185 Cb 0.52 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1bue h ALA 185 CO 0.03 0.67 0.14 0.28 0.00 0.00 0.00 179.25 180.36 1bue h VAL 186 N 1.03 1.21 -0.56 0.00 2.07 -1.17 -1.21 116.25 117.62 1bue h VAL 186 Ca 0.20 -0.68 -0.03 0.00 0.82 0.00 0.00 66.70 67.01 1bue h VAL 186 Cb 0.47 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1bue h VAL 186 CO 0.02 0.24 0.24 0.00 0.02 0.00 0.00 177.57 178.09 1bue h ALA 187 N 0.98 0.72 -0.48 1.67 0.00 -1.02 -0.79 119.26 120.35 1bue h ALA 187 Ca 0.13 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1bue h ALA 187 Cb 0.24 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1bue h ALA 187 CO -0.01 0.32 0.10 1.57 0.00 0.00 0.00 179.25 181.23 1bue h LYS 188 N 0.76 0.78 -0.47 0.00 2.10 -1.00 -1.04 116.57 117.70 1bue h LYS 188 Ca 0.19 -0.20 -0.09 0.00 -2.00 0.00 0.00 60.65 58.55 1bue h LYS 188 Cb 0.17 -0.10 -0.02 0.00 -0.90 0.00 0.00 32.23 31.39 1bue h LYS 188 CO -0.02 0.77 -0.09 0.77 -2.00 0.00 0.00 179.45 178.88 1bue h SER 189 N 0.65 0.82 -0.50 7.07 0.02 -1.04 -0.67 113.55 119.91 1bue h SER 189 Ca 0.15 -0.24 -0.09 0.00 -0.84 0.00 0.00 61.79 60.76 1bue h SER 189 Cb 0.36 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.66 1bue h SER 189 CO 0.01 0.94 -0.05 0.25 -1.14 0.00 0.00 176.83 176.83 1bue h LEU 190 N 0.76 0.92 -0.47 5.07 5.85 -0.97 -1.02 115.31 125.44 1bue h LEU 190 Ca 0.13 -0.33 -0.05 0.00 0.84 0.00 0.00 57.88 58.46 1bue h LEU 190 Cb 0.59 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 1bue h LEU 190 CO 0.04 1.03 0.09 0.50 -0.34 0.00 0.00 178.44 179.76 1bue h LYS 191 N 0.79 0.77 -0.46 1.25 3.64 -0.96 0.37 116.57 121.97 1bue h LYS 191 Ca 0.14 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 1bue h LYS 191 Cb 0.59 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.30 1bue h LYS 191 CO 0.04 0.77 0.24 1.15 -2.27 0.00 0.00 179.45 179.38 1bue h THR 192 N 0.64 1.18 0.01 1.00 2.02 -0.98 -0.03 112.91 116.74 1bue h THR 192 Ca 0.14 -0.48 -0.10 0.00 0.77 0.00 0.00 66.41 66.74 1bue h THR 192 Cb 0.37 0.64 0.01 0.00 -1.74 0.00 0.00 68.15 67.43 1bue h THR 192 CO 0.01 0.19 -0.42 -0.07 0.37 0.00 0.00 175.52 175.60 1bue h LEU 193 N 0.61 0.34 0.03 2.58 3.38 -1.09 -1.99 115.31 119.18 1bue h LEU 193 Ca 0.16 -0.80 -0.23 0.00 0.09 0.00 0.00 57.88 57.10 1bue h LEU 193 Cb 0.09 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1bue h LEU 193 CO -0.02 1.10 -1.08 0.00 0.09 0.00 0.00 178.44 178.53 1bue h ALA 194 N 0.25 0.30 0.00 1.53 0.00 -0.97 -3.39 119.26 116.97 1bue h ALA 194 Ca -0.06 -0.92 0.00 0.00 0.00 0.00 0.00 54.91 53.93 1bue h ALA 194 Cb 1.17 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1bue h ALA 194 CO 0.08 1.19 0.00 1.28 0.00 0.00 0.00 179.25 181.80 1bue n LEU 195 N -3.39 0.85 0.00 0.00 4.77 -0.09 -4.94 117.00 114.20 1bue n LEU 195 Ca -0.03 -0.85 0.00 0.00 -0.03 0.00 0.00 56.01 55.11 1bue n LEU 195 Cb 0.96 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.05 1bue n LEU 195 CO 0.49 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.37 1bue n GLY 196 N -0.05 1.52 0.25 -0.72 0.00 -0.75 -4.95 105.19 100.49 1bue n GLY 196 Ca 0.00 -1.82 0.08 0.00 0.00 0.00 0.00 46.02 44.28 1bue n GLY 196 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1bue n ASN 197 N 0.00 2.63 0.01 1.61 4.05 -1.25 -4.66 115.26 117.65 1bue n ASN 197 Ca 0.00 -2.87 -0.12 0.00 0.45 0.00 0.00 54.58 52.04 1bue n ASN 197 Cb 0.00 -0.38 -0.09 0.00 1.23 0.00 0.00 39.78 40.54 1bue n ASN 197 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 177.26 174.61 1bue h ILE 198 N 0.44 1.18 -3.33 -1.44 1.08 -1.89 -3.44 117.51 110.11 1bue h ILE 198 Ca 0.00 -1.33 -0.56 0.00 -0.39 0.00 0.00 64.86 62.58 1bue h ILE 198 Cb 1.00 1.99 -0.04 0.00 -3.07 0.00 0.00 36.82 36.70 1bue h ILE 198 CO 0.04 0.31 -0.11 -0.76 -0.69 0.00 0.00 178.15 176.94 1bue s LEU 199 N -8.94 4.29 0.94 1.44 1.43 -1.26 -5.05 118.68 111.52 1bue s LEU 199 Ca -0.15 1.00 -0.12 0.00 -1.03 0.00 0.00 54.13 53.83 1bue s LEU 199 Cb 0.00 -3.36 0.16 0.00 0.03 0.00 0.00 46.19 43.02 1bue s LEU 199 CO 0.57 0.06 1.10 -0.44 0.23 0.00 0.00 176.35 177.88 1bue s SER 200 N -1.91 3.15 0.24 2.29 0.01 -1.26 -4.70 113.70 111.52 1bue s SER 200 Ca 0.40 1.19 -0.05 0.00 1.31 0.00 0.00 55.95 58.81 1bue s SER 200 Cb -0.14 -1.85 0.41 0.00 0.21 0.00 0.00 66.02 64.65 1bue s SER 200 CO 0.20 -2.80 1.77 -0.08 0.41 0.00 0.00 173.24 172.73 1bue h GLU 201 N -1.67 0.59 -0.26 12.44 4.81 -1.98 0.42 114.58 128.93 1bue h GLU 201 Ca -0.52 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 58.63 1bue h GLU 201 Cb 1.32 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.56 1bue h GLU 201 CO 0.58 0.39 -0.02 1.25 -0.73 0.00 0.00 179.01 180.48 1bue h HIS 202 N 0.60 0.52 -0.19 0.92 2.76 -2.00 -2.31 115.15 115.46 1bue h HIS 202 Ca 0.39 -0.10 -0.08 0.00 -2.20 0.00 0.00 60.37 58.39 1bue h HIS 202 Cb 0.48 -0.13 -0.01 0.00 1.55 0.00 0.00 27.41 29.29 1bue h HIS 202 CO -0.11 0.66 -0.23 0.93 -1.30 0.00 0.00 177.93 177.88 1bue h GLU 203 N 0.24 0.33 -0.46 5.26 3.07 -1.75 -2.18 114.58 119.09 1bue h GLU 203 Ca 0.07 -0.11 -0.12 0.00 -0.50 0.00 0.00 59.36 58.70 1bue h GLU 203 Cb 0.46 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.33 1bue h GLU 203 CO 0.02 0.55 -0.18 0.87 -1.40 0.00 0.00 179.01 178.86 1bue h LYS 204 N 0.30 0.90 -0.60 2.33 1.57 -0.85 0.36 116.57 120.58 1bue h LYS 204 Ca 0.05 -0.35 -0.04 0.00 -1.87 0.00 0.00 60.65 58.44 1bue h LYS 204 Cb 0.57 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.81 1bue h LYS 204 CO 0.04 1.00 0.23 1.49 -0.57 0.00 0.00 179.45 181.64 1bue h GLU 205 N 0.79 0.91 -0.44 3.15 4.81 -1.11 0.32 114.58 123.00 1bue h GLU 205 Ca 0.11 -0.17 -0.05 0.00 -0.13 0.00 0.00 59.36 59.12 1bue h GLU 205 Cb 0.72 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.94 1bue h GLU 205 CO 0.06 0.78 0.08 1.15 -0.73 0.00 0.00 179.01 180.35 1bue h THR 206 N 0.84 1.24 -0.52 0.32 2.02 -1.12 -0.98 112.91 114.72 1bue h THR 206 Ca 0.20 -0.88 -0.02 0.00 0.77 0.00 0.00 66.41 66.48 1bue h THR 206 Cb 0.23 0.96 -0.02 0.00 -1.74 0.00 0.00 68.15 67.58 1bue h THR 206 CO -0.01 0.31 0.25 0.22 0.37 0.00 0.00 175.52 176.65 1bue h TYR 207 N 0.59 0.74 -0.49 3.16 3.20 -0.68 -0.97 116.97 122.52 1bue h TYR 207 Ca 0.13 -0.04 -0.09 0.00 3.14 0.00 0.00 58.73 61.88 1bue h TYR 207 Cb 0.37 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.39 1bue h TYR 207 CO 0.03 0.58 -0.05 1.96 -1.64 0.00 0.00 178.16 179.04 1bue h GLN 208 N 0.69 0.85 -0.51 1.82 4.20 -0.81 -1.58 115.11 119.77 1bue h GLN 208 Ca 0.18 -0.26 -0.04 0.00 0.06 0.00 0.00 58.65 58.58 1bue h GLN 208 Cb 0.12 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 1bue h GLN 208 CO -0.02 0.89 0.15 1.15 -0.67 0.00 0.00 178.83 180.32 1bue h THR 209 N 0.78 1.23 -0.35 -0.54 2.02 -0.79 -0.98 112.91 114.29 1bue h THR 209 Ca 0.14 -0.80 -0.01 0.00 0.77 0.00 0.00 66.41 66.51 1bue h THR 209 Cb 0.54 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 67.72 1bue h THR 209 CO 0.03 0.29 0.19 -0.50 0.37 0.00 0.00 175.52 175.90 1bue h TRP 210 N 0.70 0.49 -0.56 3.16 6.55 -0.94 -1.92 115.95 123.42 1bue h TRP 210 Ca 0.16 -0.02 -0.00 0.00 0.95 0.00 0.00 58.89 59.98 1bue h TRP 210 Cb 0.29 -0.15 -0.03 0.00 -0.86 0.00 0.00 29.16 28.41 1bue h TRP 210 CO 0.02 0.39 0.34 -0.07 -1.05 0.00 0.00 178.44 178.07 1bue h LEU 211 N 0.44 0.68 -1.69 -4.49 3.38 -1.11 -2.39 115.31 110.13 1bue h LEU 211 Ca 0.12 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 1bue h LEU 211 Cb 0.07 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1bue h LEU 211 CO -0.02 0.54 -0.18 0.11 0.09 0.00 0.00 178.44 178.99 1bue h LYS 212 N 0.76 0.00 -0.26 1.13 1.57 -0.98 -2.27 116.57 116.52 1bue h LYS 212 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1bue h LYS 212 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1bue h LYS 212 CO -0.04 0.18 0.00 0.41 -0.57 0.00 0.00 179.45 179.43 1bue n GLY 213 N -0.93 0.29 3.75 3.86 0.00 -0.74 -4.84 105.19 106.58 1bue n GLY 213 Ca -0.02 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 1bue n GLY 213 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1bue n ASN 214 N 0.30 3.59 -0.58 1.61 5.15 -0.91 -4.87 115.26 119.55 1bue n ASN 214 Ca 0.11 1.19 0.09 0.00 -0.60 0.00 0.00 54.58 55.37 1bue n ASN 214 Cb 0.25 -1.58 0.04 0.00 -0.53 0.00 0.00 39.78 37.97 1bue n ASN 214 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1bue n THR 215 N 1.12 0.00 -0.15 -0.44 -2.24 -0.92 -4.60 114.28 107.05 1bue n THR 215 Ca 0.05 -0.42 0.07 0.00 -2.27 0.00 0.00 64.05 61.47 1bue n THR 215 Cb 0.37 1.30 0.17 0.00 -2.10 0.00 0.00 70.33 70.07 1bue n THR 215 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1bue n THR 216 N 0.53 0.93 -1.02 4.28 -2.24 -1.26 -4.71 114.28 110.79 1bue n THR 216 Ca 0.09 -0.96 0.08 0.00 -2.27 0.00 0.00 64.05 60.98 1bue n THR 216 Cb 0.41 0.56 0.26 0.00 -2.10 0.00 0.00 70.33 69.45 1bue n THR 216 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bue n GLY 217 N 0.69 4.10 0.37 3.38 0.00 -1.26 -4.74 105.19 107.72 1bue n GLY 217 Ca 0.13 -1.06 0.06 0.00 0.00 0.00 0.00 46.02 45.16 1bue n GLY 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bue h ALA 218 N 1.75 1.54 -0.08 4.61 0.00 -1.93 -2.64 119.26 122.50 1bue h ALA 218 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1bue h ALA 218 Cb 1.47 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1bue h ALA 218 CO 0.24 0.27 0.00 0.00 0.00 0.00 0.00 179.25 179.75 1bue n ALA 219 N -2.38 2.54 -2.27 0.00 0.00 -1.26 -3.20 120.51 113.94 1bue n ALA 219 Ca 0.17 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 53.08 1bue n ALA 219 Cb 0.29 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.65 1bue n ALA 219 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1bue n ARG 220 N 0.40 0.00 -0.23 0.00 1.74 -1.00 -4.46 116.66 113.11 1bue n ARG 220 Ca 0.18 0.00 0.07 0.00 -0.77 0.00 0.00 57.85 57.32 1bue n ARG 220 Cb 0.38 0.00 0.33 0.00 -1.02 0.00 0.00 32.46 32.15 1bue n ARG 220 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 1bue h ILE 221 N 0.00 1.00 0.00 0.55 2.04 -1.86 -1.36 117.51 117.89 1bue h ILE 221 Ca 0.00 -0.28 -0.01 0.00 1.00 0.00 0.00 64.86 65.57 1bue h ILE 221 Cb 0.00 0.11 -0.00 0.00 -0.74 0.00 0.00 36.82 36.19 1bue h ILE 221 CO 0.00 0.15 -0.03 0.03 0.00 0.00 0.00 178.15 178.30 1bue h ARG 222 N 0.82 0.00 -0.00 2.37 3.08 -1.80 -1.56 114.38 117.28 1bue h ARG 222 Ca 0.36 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.41 1bue h ARG 222 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.37 1bue h ARG 222 CO -0.13 0.03 -0.04 0.00 -1.07 0.00 0.00 179.97 178.76 1bue n ALA 223 N -2.44 2.43 1.06 0.04 0.00 -0.51 -3.75 120.51 117.33 1bue n ALA 223 Ca -0.03 -0.12 0.11 0.00 0.00 0.00 0.00 53.44 53.40 1bue n ALA 223 Cb 0.11 -1.45 0.09 0.00 0.00 0.00 0.00 19.45 18.21 1bue n ALA 223 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1bue n SER 224 N -1.49 1.29 -4.59 0.00 3.41 -0.59 -4.98 113.62 106.68 1bue n SER 224 Ca 0.07 -1.04 -0.23 0.00 -0.26 0.00 0.00 58.87 57.41 1bue n SER 224 Cb 0.34 0.50 -0.08 0.00 -0.26 0.00 0.00 64.21 64.70 1bue n SER 224 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1bue s VAL 225 N -2.70 3.16 0.75 -3.33 -7.23 -1.24 -4.66 120.40 105.14 1bue s VAL 225 Ca 0.16 -2.05 -0.15 0.00 -1.81 0.00 0.00 61.98 58.13 1bue s VAL 225 Cb 0.18 -2.68 0.03 0.00 0.56 0.00 0.00 36.38 34.47 1bue s VAL 225 CO 0.66 -0.37 1.06 -2.65 -0.31 0.00 0.00 175.10 173.48 1bue n PRO 226 N -0.78 0.44 0.10 4.82 -0.02 -1.26 -4.91 135.00 133.40 1bue n PRO 226 Ca -0.06 0.21 0.13 0.00 -2.02 0.00 0.00 63.50 61.76 1bue n PRO 226 Cb 0.59 -2.31 0.63 0.00 -0.02 0.00 0.00 33.50 32.39 1bue n PRO 226 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1bue h SER 227 N -0.42 0.07 -0.13 2.55 0.87 -2.00 -2.47 113.55 112.02 1bue h SER 227 Ca -0.47 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 1bue h SER 227 Cb 1.32 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.27 1bue h SER 227 CO 0.47 0.04 0.00 -0.90 -0.53 0.00 0.00 176.83 175.91 1bue n ASP 228 N -4.46 1.71 -4.84 6.23 5.75 -1.26 -4.87 116.55 114.80 1bue n ASP 228 Ca 0.04 -1.67 -0.35 0.00 -0.01 0.00 0.00 54.79 52.80 1bue n ASP 228 Cb 0.33 -0.08 -0.06 0.00 -1.03 0.00 0.00 41.12 40.28 1bue n ASP 228 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 1bue s TRP 229 N -1.84 3.58 -0.15 2.11 0.52 -0.93 -4.52 118.94 117.71 1bue s TRP 229 Ca 0.34 1.18 -0.07 0.00 0.02 0.00 0.00 56.10 57.57 1bue s TRP 229 Cb 0.19 -2.47 -0.04 0.00 -1.15 0.00 0.00 33.47 29.99 1bue s TRP 229 CO 0.28 0.35 0.09 0.08 0.02 0.00 0.00 176.95 177.77 1bue s VAL 230 N -1.56 5.06 -0.03 4.03 1.01 -0.69 -4.95 120.40 123.27 1bue s VAL 230 Ca 0.42 0.05 0.06 0.00 0.00 0.00 0.00 61.98 62.51 1bue s VAL 230 Cb -0.15 -3.24 -0.01 0.00 0.00 0.00 0.00 36.38 32.98 1bue s VAL 230 CO 0.20 0.53 -0.19 -0.69 0.00 0.00 0.00 175.10 174.94 1bue s VAL 231 N -0.26 1.55 -0.14 2.92 1.01 -1.26 -0.46 120.40 123.76 1bue s VAL 231 Ca 0.09 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.26 1bue s VAL 231 Cb -0.12 -1.30 0.02 0.00 0.00 0.00 0.00 36.38 34.98 1bue s VAL 231 CO 0.01 0.44 -0.15 -0.83 0.00 0.00 0.00 175.10 174.57 1bue s GLY 232 N -0.30 1.12 0.29 4.51 0.00 -0.44 -4.35 107.32 108.15 1bue s GLY 232 Ca 0.04 -0.87 -0.05 0.00 0.00 0.00 0.00 44.72 43.84 1bue s GLY 232 CO 0.00 0.42 0.41 0.51 0.00 0.00 0.00 173.10 174.44 1bue s ASP 233 N 1.32 0.54 -0.10 1.64 -4.77 -0.90 -0.78 116.67 113.62 1bue s ASP 233 Ca 0.01 -1.33 -0.04 0.00 -3.30 0.00 0.00 52.55 47.90 1bue s ASP 233 Cb -0.13 0.59 0.05 0.00 -1.09 0.00 0.00 42.92 42.33 1bue s ASP 233 CO -0.08 -1.16 0.19 -0.75 0.70 0.00 0.00 175.17 174.07 1bue s LYS 234 N -3.54 0.09 0.51 2.11 2.47 -0.88 -4.65 119.74 115.85 1bue s LYS 234 Ca 0.30 0.58 0.01 0.00 -1.56 0.00 0.00 55.97 55.30 1bue s LYS 234 Cb 0.01 -0.18 0.02 0.00 -1.46 0.00 0.00 37.83 36.22 1bue s LYS 234 CO 0.16 -0.27 0.73 0.95 0.16 0.00 0.00 175.35 177.09 1bue s THR 235 N 2.06 3.24 -0.13 3.43 -4.23 -1.26 -2.51 115.64 116.25 1bue s THR 235 Ca -0.00 -0.59 -0.06 0.00 -1.18 0.00 0.00 61.69 59.86 1bue s THR 235 Cb -0.12 -3.21 0.05 0.00 1.34 0.00 0.00 72.50 70.57 1bue s THR 235 CO -0.07 -0.15 0.30 -0.83 -0.54 0.00 0.00 174.62 173.33 1bue s GLY 236 N -4.34 -0.20 -0.21 3.99 0.00 -0.83 -3.19 107.32 102.55 1bue s GLY 236 Ca 0.53 1.16 -0.05 0.00 0.00 0.00 0.00 44.72 46.37 1bue s GLY 236 CO 0.38 1.41 0.12 -0.56 0.00 0.00 0.00 173.10 174.45 1bue s SER 237 N 1.34 2.61 0.30 1.64 0.01 -1.26 -0.58 113.70 117.76 1bue s SER 237 Ca -0.09 -0.79 0.11 0.00 1.31 0.00 0.00 55.95 56.49 1bue s SER 237 Cb -0.10 -0.21 0.47 0.00 0.21 0.00 0.00 66.02 66.39 1bue s SER 237 CO -0.10 -0.38 1.68 0.00 0.41 0.00 0.00 173.24 174.86 1bue n GLY 239 N 0.02 0.50 3.36 0.00 0.00 -1.26 -4.81 105.19 103.00 1bue n GLY 239 Ca -0.01 -0.88 -0.15 0.00 0.00 0.00 0.00 46.02 44.99 1bue n GLY 239 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bue s ALA 240 N -2.04 -1.17 -1.30 4.61 0.00 -1.26 -4.94 121.76 115.66 1bue s ALA 240 Ca 0.00 0.90 -0.07 0.00 0.00 0.00 0.00 51.96 52.79 1bue s ALA 240 Cb 0.00 -0.21 0.05 0.00 0.00 0.00 0.00 23.12 22.96 1bue s ALA 240 CO 0.00 -0.28 0.43 0.66 0.00 0.00 0.00 175.76 176.57 1bue n TYR 241 N 1.65 -1.77 -2.70 0.00 4.01 -0.78 -1.82 117.16 115.75 1bue n TYR 241 Ca -0.18 0.40 -0.13 0.00 -0.16 0.00 0.00 57.90 57.83 1bue n TYR 241 Cb 0.56 -3.21 -0.01 0.00 -0.31 0.00 0.00 39.34 36.38 1bue n TYR 241 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1bue n GLY 242 N -1.18 -0.49 3.61 2.72 0.00 -0.26 -0.45 105.19 109.13 1bue n GLY 242 Ca -0.05 0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 1bue n GLY 242 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bue s THR 243 N -2.58 4.83 0.08 2.61 2.01 -0.76 -4.25 115.64 117.59 1bue s THR 243 Ca 0.11 1.13 -0.14 0.00 0.31 0.00 0.00 61.69 63.10 1bue s THR 243 Cb -0.06 -4.11 0.02 0.00 0.01 0.00 0.00 72.50 68.36 1bue s THR 243 CO 0.13 -0.22 0.32 0.00 -0.69 0.00 0.00 174.62 174.16 1bue s ALA 244 N 2.88 -0.69 0.39 7.40 0.00 -1.08 -1.86 121.76 128.80 1bue s ALA 244 Ca 0.31 -0.14 -0.14 0.00 0.00 0.00 0.00 51.96 51.99 1bue s ALA 244 Cb -0.14 0.49 0.05 0.00 0.00 0.00 0.00 23.12 23.52 1bue s ALA 244 CO 0.12 -0.52 0.76 0.54 0.00 0.00 0.00 175.76 176.66 1bue s ASN 245 N -2.51 0.12 -0.29 0.00 2.20 0.25 -1.48 114.94 113.24 1bue s ASN 245 Ca 0.00 -1.21 -0.25 0.00 -0.94 0.00 0.00 52.86 50.46 1bue s ASN 245 Cb 0.02 0.84 0.14 0.00 -2.00 0.00 0.00 41.25 40.25 1bue s ASN 245 CO -0.08 -1.67 1.16 -0.62 -2.94 0.00 0.00 177.10 172.94 1bue s ASP 246 N -3.10 -0.33 0.05 3.54 2.15 -0.56 -1.96 116.67 116.46 1bue s ASP 246 Ca 0.17 0.64 0.03 0.00 0.43 0.00 0.00 52.55 53.82 1bue s ASP 246 Cb -0.05 0.65 -0.03 0.00 -0.30 0.00 0.00 42.92 43.20 1bue s ASP 246 CO 0.13 -0.11 -0.10 -0.72 -0.17 0.00 0.00 175.17 174.20 1bue s TYR 247 N 0.17 0.86 0.13 -5.34 -0.85 -1.04 -1.08 117.35 110.21 1bue s TYR 247 Ca 0.04 -0.48 -0.21 0.00 -0.52 0.00 0.00 57.07 55.91 1bue s TYR 247 Cb -0.05 -0.50 0.06 0.00 0.38 0.00 0.00 41.96 41.84 1bue s TYR 247 CO -0.09 -0.03 0.52 0.00 -1.52 0.00 0.00 175.55 174.43 1bue s ALA 248 N -1.31 -1.34 -0.21 9.51 0.00 0.58 -2.07 121.76 126.91 1bue s ALA 248 Ca -0.07 0.32 -0.06 0.00 0.00 0.00 0.00 51.96 52.16 1bue s ALA 248 Cb -0.10 0.76 -0.03 0.00 0.00 0.00 0.00 23.12 23.75 1bue s ALA 248 CO 0.01 -0.69 0.03 0.08 0.00 0.00 0.00 175.76 175.18 1bue s VAL 249 N -3.61 4.18 -0.14 0.00 1.01 0.04 -1.27 120.40 120.62 1bue s VAL 249 Ca 0.01 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 61.76 1bue s VAL 249 Cb 0.00 -2.90 -0.00 0.00 0.00 0.00 0.00 36.38 33.47 1bue s VAL 249 CO -0.11 0.41 -0.17 -0.69 0.00 0.00 0.00 175.10 174.54 1bue s VAL 250 N 1.04 2.61 -0.54 2.92 1.01 0.18 -1.33 120.40 126.30 1bue s VAL 250 Ca 0.03 -0.80 -0.10 0.00 0.00 0.00 0.00 61.98 61.11 1bue s VAL 250 Cb -0.14 -2.08 0.14 0.00 0.00 0.00 0.00 36.38 34.29 1bue s VAL 250 CO 0.02 0.53 0.42 0.26 0.00 0.00 0.00 175.10 176.33 1bue s TRP 251 N 0.65 3.44 0.74 5.22 0.51 0.39 0.29 118.94 130.18 1bue s TRP 251 Ca -0.09 -1.90 -0.11 0.00 -2.12 0.00 0.00 56.10 51.88 1bue s TRP 251 Cb -0.16 -3.55 0.04 0.00 -0.81 0.00 0.00 33.47 28.99 1bue s TRP 251 CO 0.02 -0.98 1.09 -2.14 -0.51 0.00 0.00 176.95 174.43 1bue s PRO 252 N 1.11 2.49 0.06 4.98 0.02 -1.26 -1.70 135.00 140.70 1bue s PRO 252 Ca 0.08 1.17 -0.31 0.00 0.02 0.00 0.00 61.00 61.96 1bue s PRO 252 Cb -0.24 -1.92 -0.08 0.00 0.02 0.00 0.00 34.50 32.27 1bue s PRO 252 CO -0.01 -1.47 1.72 0.21 -0.33 0.00 0.00 177.00 177.11 1bue s LYS 253 N -4.77 4.18 -1.46 5.54 2.47 -1.26 -2.76 119.74 121.68 1bue s LYS 253 Ca 0.62 2.39 -0.10 0.00 -1.56 0.00 0.00 55.97 57.32 1bue s LYS 253 Cb -0.17 -3.70 0.05 0.00 -1.46 0.00 0.00 37.83 32.54 1bue s LYS 253 CO 0.53 -0.79 0.83 0.09 0.16 0.00 0.00 175.35 176.17 1bue n ASN 255 N 5.99 -5.31 -3.83 1.43 5.03 -1.26 -4.98 115.26 112.33 1bue n ASN 255 Ca 0.17 -0.52 -0.09 0.00 0.87 0.00 0.00 54.58 55.00 1bue n ASN 255 Cb 0.40 -4.26 -0.07 0.00 -1.02 0.00 0.00 39.78 34.83 1bue n ASN 255 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1bue s ARG 256 N -6.20 0.82 0.57 3.52 0.52 -1.11 -5.15 118.95 111.92 1bue s ARG 256 Ca 0.50 -0.84 -0.19 0.00 -0.52 0.00 0.00 55.73 54.69 1bue s ARG 256 Cb -0.24 0.34 -0.05 0.00 0.52 0.00 0.00 34.95 35.52 1bue s ARG 256 CO 0.62 -0.26 1.17 0.00 0.02 0.00 0.00 175.30 176.85 1bue s ALA 257 N -3.47 2.61 0.75 2.13 0.00 -1.26 -4.26 121.76 118.26 1bue s ALA 257 Ca 0.02 0.90 -0.15 0.00 0.00 0.00 0.00 51.96 52.74 1bue s ALA 257 Cb 0.03 -3.40 0.05 0.00 0.00 0.00 0.00 23.12 19.80 1bue s ALA 257 CO -0.09 -0.98 1.22 -1.25 0.00 0.00 0.00 175.76 174.66 1bue s PRO 258 N -3.33 2.00 0.17 0.00 0.04 -1.26 -4.50 135.00 128.11 1bue s PRO 258 Ca 0.75 1.80 0.08 0.00 0.04 0.00 0.00 61.00 63.67 1bue s PRO 258 Cb -0.27 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.42 1bue s PRO 258 CO 0.30 -1.95 -0.09 -0.51 0.04 0.00 0.00 177.00 174.79 1bue s LEU 259 N -5.27 3.01 -0.16 -3.56 1.43 0.15 -2.05 118.68 112.22 1bue s LEU 259 Ca 0.75 -0.53 0.01 0.00 -1.03 0.00 0.00 54.13 53.33 1bue s LEU 259 Cb -0.30 -1.71 0.01 0.00 0.03 0.00 0.00 46.19 44.22 1bue s LEU 259 CO 0.47 0.12 -0.20 -0.63 0.23 0.00 0.00 176.35 176.33 1bue s ILE 260 N -1.61 2.17 -0.04 -0.59 -1.09 0.09 -0.64 121.20 119.48 1bue s ILE 260 Ca 0.24 -0.92 0.04 0.00 -2.23 0.00 0.00 60.65 57.78 1bue s ILE 260 Cb -0.09 -1.90 -0.00 0.00 -1.58 0.00 0.00 42.46 38.89 1bue s ILE 260 CO 0.15 0.54 -0.17 -0.63 -1.23 0.00 0.00 174.94 173.60 1bue s ILE 261 N 1.06 1.40 -0.08 2.92 1.01 -0.40 -0.65 121.20 126.46 1bue s ILE 261 Ca -0.01 -0.70 -0.02 0.00 0.00 0.00 0.00 60.65 59.93 1bue s ILE 261 Cb -0.14 -1.21 0.03 0.00 0.01 0.00 0.00 42.46 41.15 1bue s ILE 261 CO -0.07 0.40 0.01 -0.55 0.00 0.00 0.00 174.94 174.74 1bue s SER 262 N 0.07 1.70 -0.11 3.58 0.15 0.19 -0.31 113.70 118.97 1bue s SER 262 Ca -0.04 -0.16 -0.00 0.00 0.70 0.00 0.00 55.95 56.44 1bue s SER 262 Cb -0.12 -0.42 0.02 0.00 -1.71 0.00 0.00 66.02 63.80 1bue s SER 262 CO 0.02 -0.22 -0.08 -0.69 1.20 0.00 0.00 173.24 173.48 1bue s VAL 263 N 1.98 1.04 -0.02 4.45 1.01 -0.24 -1.30 120.40 127.32 1bue s VAL 263 Ca 0.04 -0.30 0.06 0.00 0.00 0.00 0.00 61.98 61.78 1bue s VAL 263 Cb -0.13 -1.05 -0.01 0.00 0.00 0.00 0.00 36.38 35.19 1bue s VAL 263 CO -0.05 0.37 -0.20 -0.31 0.00 0.00 0.00 175.10 174.90 1bue s TYR 264 N 1.64 1.87 0.06 5.22 1.51 0.23 -1.50 117.35 126.38 1bue s TYR 264 Ca 0.04 -0.41 0.01 0.00 -1.01 0.00 0.00 57.07 55.70 1bue s TYR 264 Cb -0.13 -1.21 -0.03 0.00 -0.11 0.00 0.00 41.96 40.48 1bue s TYR 264 CO -0.07 -0.07 -0.05 0.95 -1.11 0.00 0.00 175.55 175.19 1bue s THR 265 N -0.35 0.42 0.16 -0.71 -4.23 -0.55 -0.13 115.64 110.25 1bue s THR 265 Ca 0.05 -1.49 -0.24 0.00 -1.18 0.00 0.00 61.69 58.84 1bue s THR 265 Cb -0.09 -1.09 0.07 0.00 1.34 0.00 0.00 72.50 72.73 1bue s THR 265 CO 0.00 -0.71 0.66 0.28 -0.54 0.00 0.00 174.62 174.32 1bue s THR 266 N -2.70 0.00 0.24 3.99 -1.32 -0.80 -2.63 115.64 112.42 1bue s THR 266 Ca -0.00 -0.16 0.01 0.00 -1.21 0.00 0.00 61.69 60.33 1bue s THR 266 Cb -0.01 -1.17 -0.05 0.00 -1.51 0.00 0.00 72.50 69.76 1bue s THR 266 CO -0.04 0.00 0.08 -0.54 -2.21 0.00 0.00 174.62 171.91 1bue s LYS 267 N -3.68 1.35 0.02 7.08 1.02 0.40 -0.98 119.74 124.95 1bue s LYS 267 Ca 0.03 -1.72 0.25 0.00 0.02 0.00 0.00 55.97 54.55 1bue s LYS 267 Cb -0.02 -0.24 0.43 0.00 -0.52 0.00 0.00 37.83 37.48 1bue s LYS 267 CO -0.09 -0.27 1.36 0.09 -0.92 0.00 0.00 175.35 175.51 1bue n ASN 268 N -0.42 0.55 -4.67 2.83 5.03 -1.26 -4.74 115.26 112.59 1bue n ASN 268 Ca -0.01 -0.24 -0.39 0.00 0.87 0.00 0.00 54.58 54.81 1bue n ASN 268 Cb 0.66 0.31 -0.07 0.00 -1.02 0.00 0.00 39.78 39.66 1bue n ASN 268 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1bue s GLU 269 N -3.03 4.20 0.36 3.52 2.02 -1.26 -4.97 118.70 119.54 1bue s GLU 269 Ca 0.10 0.37 0.05 0.00 0.02 0.00 0.00 54.97 55.50 1bue s GLU 269 Cb 0.17 -3.55 0.72 0.00 0.10 0.00 0.00 34.13 31.57 1bue s GLU 269 CO 0.72 -0.10 1.99 -0.22 0.02 0.00 0.00 175.26 177.67 1bue h LYS 270 N 7.40 0.74 -0.01 1.61 3.64 -1.92 -2.65 116.57 125.38 1bue h LYS 270 Ca -0.35 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.99 1bue h LYS 270 Cb 1.16 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 1bue h LYS 270 CO 0.73 0.49 -0.23 0.39 -2.27 0.00 0.00 179.45 178.57 1bue n GLU 271 N -4.46 1.03 -1.87 1.90 4.71 -1.26 -1.86 120.64 118.82 1bue n GLU 271 Ca 0.08 -0.64 -0.41 0.00 -0.01 0.00 0.00 57.16 56.18 1bue n GLU 271 Cb 0.13 -1.49 -0.01 0.00 -1.01 0.00 0.00 31.44 29.07 1bue n GLU 271 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1bue s ALA 272 N -2.41 3.60 0.35 0.62 0.00 -1.00 -4.90 121.76 118.02 1bue s ALA 272 Ca 0.26 1.50 -0.09 0.00 0.00 0.00 0.00 51.96 53.63 1bue s ALA 272 Cb 0.19 -3.59 -0.06 0.00 0.00 0.00 0.00 23.12 19.66 1bue s ALA 272 CO 0.49 -0.94 0.68 0.15 0.00 0.00 0.00 175.76 176.13 1bue s LYS 273 N -1.60 3.73 0.69 0.00 3.01 -1.26 -1.10 119.74 123.21 1bue s LYS 273 Ca 0.55 0.29 -0.11 0.00 -1.01 0.00 0.00 55.97 55.69 1bue s LYS 273 Cb -0.45 -2.50 0.00 0.00 -1.01 0.00 0.00 37.83 33.87 1bue s LYS 273 CO 0.57 0.08 1.06 -3.38 0.51 0.00 0.00 175.35 174.19 1bue s HIS 274 N -2.22 3.17 -0.33 3.18 -3.43 -1.26 -4.52 115.29 109.87 1bue s HIS 274 Ca 0.48 1.39 0.03 0.00 -0.80 0.00 0.00 55.06 56.16 1bue s HIS 274 Cb -0.10 -2.87 0.10 0.00 -1.43 0.00 0.00 32.58 28.27 1bue s HIS 274 CO 0.30 -1.19 0.05 -1.21 -2.00 0.00 0.00 174.74 170.69 1bue s GLU 275 N -5.07 1.37 0.31 -0.38 0.41 -1.26 -4.98 118.70 109.10 1bue s GLU 275 Ca 0.58 -1.69 0.01 0.00 -0.41 0.00 0.00 54.97 53.45 1bue s GLU 275 Cb -0.14 -2.96 0.54 0.00 -1.78 0.00 0.00 34.13 29.79 1bue s GLU 275 CO 0.55 -0.93 1.92 -0.44 -0.49 0.00 0.00 175.26 175.87 1bue h ASP 276 N 7.71 0.89 0.09 -0.19 3.32 -1.96 -2.11 116.42 124.17 1bue h ASP 276 Ca -0.07 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.95 1bue h ASP 276 Cb 1.02 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.38 1bue h ASP 276 CO 0.51 0.58 -0.13 0.11 -1.72 0.00 0.00 179.24 178.58 1bue h LYS 277 N 1.01 0.09 -0.35 3.56 1.57 -1.94 -1.32 116.57 119.20 1bue h LYS 277 Ca 0.38 -0.02 -0.16 0.00 -1.87 0.00 0.00 60.65 58.97 1bue h LYS 277 Cb 0.17 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1bue h LYS 277 CO -0.13 0.23 -0.42 0.28 -0.57 0.00 0.00 179.45 178.84 1bue h VAL 278 N 0.09 1.27 -0.44 0.50 2.07 -1.76 -0.50 116.25 117.49 1bue h VAL 278 Ca 0.02 -1.60 -0.08 0.00 0.82 0.00 0.00 66.70 65.87 1bue h VAL 278 Cb 0.29 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 1bue h VAL 278 CO 0.02 0.53 -0.02 0.40 0.02 0.00 0.00 177.57 178.52 1bue h ILE 279 N 0.72 1.26 -0.62 4.57 2.04 -1.30 -0.85 117.51 123.33 1bue h ILE 279 Ca 0.05 -1.07 -0.05 0.00 1.00 0.00 0.00 64.86 64.78 1bue h ILE 279 Cb 1.01 1.08 -0.03 0.00 -0.74 0.00 0.00 36.82 38.14 1bue h ILE 279 CO 0.10 0.37 0.17 0.00 0.00 0.00 0.00 178.15 178.79 1bue h ALA 280 N 0.90 0.81 -0.41 1.87 0.00 -1.13 -2.03 119.26 119.27 1bue h ALA 280 Ca 0.12 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.68 1bue h ALA 280 Cb 0.52 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1bue h ALA 280 CO 0.03 0.50 -0.26 1.49 0.00 0.00 0.00 179.25 181.01 1bue h GLU 281 N 0.89 0.86 -0.49 0.00 4.57 -0.94 -1.16 114.58 118.32 1bue h GLU 281 Ca 0.20 -0.38 -0.05 0.00 -1.18 0.00 0.00 59.36 57.95 1bue h GLU 281 Cb 0.32 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.87 1bue h GLU 281 CO -0.00 1.02 0.10 0.00 -1.18 0.00 0.00 179.01 178.95 1bue h ALA 282 N 0.96 1.26 -0.28 2.92 0.00 -0.98 -1.07 119.26 122.07 1bue h ALA 282 Ca 0.09 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 1bue h ALA 282 Cb 0.81 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1bue h ALA 282 CO 0.07 0.51 -0.25 1.03 0.00 0.00 0.00 179.25 180.61 1bue h SER 283 N 0.73 0.70 -0.53 0.00 0.87 -1.11 -2.15 113.55 112.05 1bue h SER 283 Ca 0.16 -0.46 0.00 0.00 -1.23 0.00 0.00 61.79 60.26 1bue h SER 283 Cb 0.29 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.03 1bue h SER 283 CO 0.00 1.02 0.35 -0.09 -0.53 0.00 0.00 176.83 177.58 1bue h ARG 284 N 0.39 0.70 -0.54 2.24 2.43 -0.82 -1.50 114.38 117.29 1bue h ARG 284 Ca 0.05 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 1bue h ARG 284 Cb 0.81 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 30.18 1bue h ARG 284 CO 0.06 0.47 0.31 0.82 -1.51 0.00 0.00 179.97 180.12 1bue h ILE 285 N 0.72 1.17 -0.20 1.20 2.04 -1.18 -2.14 117.51 119.12 1bue h ILE 285 Ca 0.20 -0.42 -0.00 0.00 1.00 0.00 0.00 64.86 65.63 1bue h ILE 285 Cb -0.08 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 36.47 1bue h ILE 285 CO -0.04 0.18 0.12 0.00 0.00 0.00 0.00 178.15 178.41 1bue h ALA 286 N 1.14 0.26 -0.80 1.87 0.00 -1.00 -2.14 119.26 118.59 1bue h ALA 286 Ca 0.19 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1bue h ALA 286 Cb 0.02 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1bue h ALA 286 CO -0.03 -0.22 0.42 0.82 0.00 0.00 0.00 179.25 180.23 1bue h ILE 287 N 0.23 1.24 -0.00 0.00 2.04 -1.15 -2.26 117.51 117.62 1bue h ILE 287 Ca 0.07 -0.63 0.00 0.00 1.00 0.00 0.00 64.86 65.30 1bue h ILE 287 Cb 0.04 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.30 1bue h ILE 287 CO -0.01 0.28 -0.01 0.47 0.00 0.00 0.00 178.15 178.87 1bue n ASP 288 N -4.33 0.03 -1.40 1.72 8.00 -0.82 -3.94 116.55 115.81 1bue n ASP 288 Ca 0.08 0.05 -0.04 0.00 0.71 0.00 0.00 54.79 55.59 1bue n ASP 288 Cb 0.11 -0.34 0.11 0.00 -0.02 0.00 0.00 41.12 40.98 1bue n ASP 288 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1bue n ASN 289 N -1.35 2.53 -4.68 -2.24 3.02 -0.82 -5.04 115.26 106.68 1bue n ASN 289 Ca 0.12 -3.36 -0.42 0.00 -0.03 0.00 0.00 54.58 50.89 1bue n ASN 289 Cb 0.28 -0.43 -0.03 0.00 -0.61 0.00 0.00 39.78 38.99 1bue n ASN 289 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1bue s LEU 290 N -2.89 4.28 0.00 3.41 1.43 -1.17 -4.71 118.68 119.03 1bue s LEU 290 Ca 0.40 1.91 0.00 0.00 -1.03 0.00 0.00 54.13 55.41 1bue s LEU 290 Cb 0.38 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 43.04 1bue s LEU 290 CO -0.05 -0.66 0.03 0.29 0.23 0.00 0.00 176.35 176.19