#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ib0 h HIS 30 N 0.00 0.45 -2.13 4.41 3.86 -2.05 -3.48 115.15 116.21 1ib0 h HIS 30 Ca 0.00 -0.29 -0.51 0.00 -1.16 0.00 0.00 60.37 58.41 1ib0 h HIS 30 Cb 0.00 -0.03 -0.05 0.00 1.06 0.00 0.00 27.41 28.39 1ib0 h HIS 30 CO 0.00 1.17 -0.53 -1.01 0.86 0.00 0.00 177.93 178.43 1ib0 s HIS 31 N -2.71 3.02 -0.85 2.45 3.76 -1.26 -5.02 115.29 114.69 1ib0 s HIS 31 Ca -0.14 -0.16 -0.25 0.00 -0.15 0.00 0.00 55.06 54.36 1ib0 s HIS 31 Cb 0.01 -1.45 -0.04 0.00 1.11 0.00 0.00 32.58 32.22 1ib0 s HIS 31 CO 0.80 0.47 1.90 1.41 -0.85 0.00 0.00 174.74 178.47 1ib0 s MET 32 N -3.85 2.63 0.32 1.40 1.75 -1.26 -4.92 119.30 115.37 1ib0 s MET 32 Ca 0.34 -0.16 0.07 0.00 -1.25 0.00 0.00 55.69 54.70 1ib0 s MET 32 Cb -0.07 -4.94 -0.03 0.00 2.84 0.00 0.00 34.83 32.64 1ib0 s MET 32 CO 0.25 -3.18 0.31 0.96 -0.65 0.00 0.00 175.02 172.70 1ib0 s ILE 33 N 9.59 3.74 -0.11 10.11 -5.25 -1.26 -2.14 121.20 135.88 1ib0 s ILE 33 Ca 0.68 -1.32 -0.20 0.00 -0.99 0.00 0.00 60.65 58.82 1ib0 s ILE 33 Cb -0.08 -3.25 -0.27 0.00 2.95 0.00 0.00 42.46 41.81 1ib0 s ILE 33 CO 0.03 -0.19 0.64 0.74 -1.79 0.00 0.00 174.94 174.37 1ib0 h THR 34 N 1.22 1.27 -1.66 8.37 2.02 -0.58 -3.41 112.91 120.14 1ib0 h THR 34 Ca -0.45 -2.40 -0.73 0.00 0.77 0.00 0.00 66.41 63.60 1ib0 h THR 34 Cb 1.25 2.90 -0.14 0.00 -1.74 0.00 0.00 68.15 70.42 1ib0 h THR 34 CO 0.58 0.65 1.72 0.18 0.37 0.00 0.00 175.52 179.02 1ib0 n LEU 35 N -4.15 5.41 0.09 2.58 4.77 -0.98 -4.77 117.00 119.95 1ib0 n LEU 35 Ca -0.20 -4.34 -0.08 0.00 -0.03 0.00 0.00 56.01 51.36 1ib0 n LEU 35 Cb 0.79 -1.63 -0.01 0.00 -2.33 0.00 0.00 43.42 40.23 1ib0 n LEU 35 CO 0.39 0.69 0.24 -0.33 -1.33 0.00 0.00 177.39 177.06 1ib0 h GLU 36 N 7.01 0.13 -3.65 3.23 5.08 -1.88 -3.45 114.58 121.05 1ib0 h GLU 36 Ca 0.37 -0.15 -0.38 0.00 -1.00 0.00 0.00 59.36 58.20 1ib0 h GLU 36 Cb 0.83 0.05 -0.36 0.00 0.50 0.00 0.00 28.75 29.77 1ib0 h GLU 36 CO 1.37 0.93 -0.75 1.21 -1.00 0.00 0.00 179.01 180.77 1ib0 s ASN 37 N -6.88 0.90 0.46 1.42 3.84 -1.26 -5.03 114.94 108.39 1ib0 s ASN 37 Ca -0.02 -0.03 0.31 0.00 0.21 0.00 0.00 52.86 53.34 1ib0 s ASN 37 Cb 0.10 -0.27 1.41 0.00 -0.55 0.00 0.00 41.25 41.94 1ib0 s ASN 37 CO 0.82 -0.15 1.94 1.55 -2.79 0.00 0.00 177.10 178.47 1ib0 h PRO 38 N 7.77 0.00 -0.10 0.43 0.13 -1.86 -2.59 132.00 135.79 1ib0 h PRO 38 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1ib0 h PRO 38 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1ib0 h PRO 38 CO 0.35 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 177.87 1ib0 n ASP 39 N -2.77 1.41 -4.84 1.44 8.00 -1.26 -4.31 116.55 114.22 1ib0 n ASP 39 Ca 0.00 -1.58 -0.29 0.00 0.71 0.00 0.00 54.79 53.63 1ib0 n ASP 39 Cb 0.22 -0.06 -0.05 0.00 -0.02 0.00 0.00 41.12 41.21 1ib0 n ASP 39 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1ib0 s ILE 40 N -1.88 4.82 -0.18 0.53 -1.09 -0.98 -5.11 121.20 117.31 1ib0 s ILE 40 Ca 0.35 -0.77 -0.06 0.00 -2.23 0.00 0.00 60.65 57.94 1ib0 s ILE 40 Cb 0.18 -3.39 -0.03 0.00 -1.58 0.00 0.00 42.46 37.64 1ib0 s ILE 40 CO 0.29 0.03 0.02 -0.54 -1.23 0.00 0.00 174.94 173.50 1ib0 s LYS 41 N -2.75 3.77 -0.27 2.79 3.01 -1.26 -4.59 119.74 120.43 1ib0 s LYS 41 Ca 0.32 -0.45 -0.03 0.00 -1.01 0.00 0.00 55.97 54.80 1ib0 s LYS 41 Cb -0.12 -3.10 0.03 0.00 -1.01 0.00 0.00 37.83 33.64 1ib0 s LYS 41 CO 0.25 0.16 -0.02 0.71 0.51 0.00 0.00 175.35 176.96 1ib0 s TYR 42 N 0.63 3.15 -0.46 3.18 1.51 0.76 -4.90 117.35 121.22 1ib0 s TYR 42 Ca 0.01 -1.57 -0.29 0.00 -1.01 0.00 0.00 57.07 54.20 1ib0 s TYR 42 Cb -0.14 -2.11 0.03 0.00 -0.11 0.00 0.00 41.96 39.63 1ib0 s TYR 42 CO 0.02 -0.73 1.18 -1.25 -1.11 0.00 0.00 175.55 173.66 1ib0 s PRO 43 N 1.33 3.71 0.02 -1.71 0.04 -1.26 -0.22 135.00 136.91 1ib0 s PRO 43 Ca -0.01 0.64 -0.01 0.00 0.04 0.00 0.00 61.00 61.67 1ib0 s PRO 43 Cb -0.18 -3.92 -0.04 0.00 0.04 0.00 0.00 34.50 30.40 1ib0 s PRO 43 CO -0.02 -1.40 0.15 -0.51 0.04 0.00 0.00 177.00 175.26 1ib0 s LEU 44 N 4.59 4.17 -0.01 -3.56 1.43 -0.42 -4.83 118.68 120.04 1ib0 s LEU 44 Ca 0.50 0.22 -0.20 0.00 -1.03 0.00 0.00 54.13 53.62 1ib0 s LEU 44 Cb -0.08 -2.60 -0.05 0.00 0.03 0.00 0.00 46.19 43.48 1ib0 s LEU 44 CO 0.31 0.23 0.58 -0.60 0.23 0.00 0.00 176.35 177.10 1ib0 s ARG 45 N -2.11 4.30 -0.24 1.70 3.52 -1.26 -1.89 118.95 122.97 1ib0 s ARG 45 Ca 0.29 0.71 -0.28 0.00 -0.13 0.00 0.00 55.73 56.31 1ib0 s ARG 45 Cb -0.12 -3.34 0.01 0.00 -1.56 0.00 0.00 34.95 29.94 1ib0 s ARG 45 CO 0.20 0.38 1.00 -1.17 -0.81 0.00 0.00 175.30 174.91 1ib0 s LEU 46 N -0.23 4.08 -0.00 -0.88 2.96 -0.11 -0.42 118.68 124.08 1ib0 s LEU 46 Ca 0.30 1.29 0.08 0.00 -0.22 0.00 0.00 54.13 55.58 1ib0 s LEU 46 Cb -0.18 -3.47 -0.09 0.00 0.50 0.00 0.00 46.19 42.94 1ib0 s LEU 46 CO 0.17 -0.66 0.30 2.30 -1.32 0.00 0.00 176.35 177.14 1ib0 n ILE 47 N 5.35 0.00 -3.45 6.68 -5.35 0.65 -0.23 119.36 123.01 1ib0 n ILE 47 Ca 0.11 -0.29 -0.12 0.00 -0.27 0.00 0.00 62.75 62.17 1ib0 n ILE 47 Cb 0.46 0.87 -0.03 0.00 -1.74 0.00 0.00 39.64 39.20 1ib0 n ILE 47 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1ib0 s ASP 48 N -1.97 -0.55 -0.15 7.28 -1.08 -0.91 -4.97 116.67 114.32 1ib0 s ASP 48 Ca 0.02 0.11 -0.18 0.00 -0.52 0.00 0.00 52.55 51.98 1ib0 s ASP 48 Cb 0.06 0.55 0.05 0.00 -1.46 0.00 0.00 42.92 42.12 1ib0 s ASP 48 CO 0.32 -0.85 0.48 -0.75 0.52 0.00 0.00 175.17 174.89 1ib0 s LYS 49 N -3.23 0.63 -0.03 4.34 2.20 -1.26 -1.22 119.74 121.16 1ib0 s LYS 49 Ca -0.00 0.52 0.03 0.00 -0.36 0.00 0.00 55.97 56.15 1ib0 s LYS 49 Cb -0.01 0.30 0.00 0.00 -1.51 0.00 0.00 37.83 36.62 1ib0 s LYS 49 CO -0.09 -0.11 -0.12 -2.00 -0.36 0.00 0.00 175.35 172.68 1ib0 s GLU 50 N -0.10 1.25 -0.50 4.03 2.12 -0.11 -4.97 118.70 120.42 1ib0 s GLU 50 Ca -0.03 -0.40 -0.20 0.00 0.36 0.00 0.00 54.97 54.70 1ib0 s GLU 50 Cb -0.03 -1.13 0.05 0.00 0.26 0.00 0.00 34.13 33.28 1ib0 s GLU 50 CO 0.02 0.15 0.67 0.42 -0.54 0.00 0.00 175.26 175.98 1ib0 s ILE 51 N 0.18 4.80 0.02 -3.70 1.09 -1.26 -1.52 121.20 120.81 1ib0 s ILE 51 Ca -0.04 -0.28 -0.17 0.00 -1.10 0.00 0.00 60.65 59.06 1ib0 s ILE 51 Cb -0.10 -4.31 -0.34 0.00 -1.06 0.00 0.00 42.46 36.65 1ib0 s ILE 51 CO 0.01 -0.81 1.00 -0.07 -0.10 0.00 0.00 174.94 174.97 1ib0 h LEU 52 N 9.88 0.79 -8.15 2.97 3.38 -1.78 -3.49 115.31 118.91 1ib0 h LEU 52 Ca -0.27 -0.90 -0.10 0.00 0.09 0.00 0.00 57.88 56.70 1ib0 h LEU 52 Cb 1.09 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 1ib0 h LEU 52 CO 0.97 1.64 0.15 -0.94 0.09 0.00 0.00 178.44 180.34 1ib0 s SER 53 N -7.44 0.31 0.23 -0.43 1.04 -1.11 -4.96 113.70 101.33 1ib0 s SER 53 Ca -0.10 -1.29 -0.15 0.00 0.48 0.00 0.00 55.95 54.89 1ib0 s SER 53 Cb 0.04 0.81 0.28 0.00 0.10 0.00 0.00 66.02 67.25 1ib0 s SER 53 CO 0.92 -1.61 1.58 -0.74 0.98 0.00 0.00 173.24 174.37 1ib0 h HIS 54 N 2.02 -0.71 -0.18 5.02 -0.00 -2.00 -2.98 115.15 116.33 1ib0 h HIS 54 Ca -0.32 0.08 0.00 0.00 -0.00 0.00 0.00 60.37 60.13 1ib0 h HIS 54 Cb 1.25 0.44 0.00 0.00 -0.00 0.00 0.00 27.41 29.09 1ib0 h HIS 54 CO 1.50 -0.38 0.00 -0.40 -0.00 0.00 0.00 177.93 178.66 1ib0 n ASP 55 N -5.50 2.99 -4.31 3.26 5.75 -1.26 -5.00 116.55 112.47 1ib0 n ASP 55 Ca 0.10 -2.62 -0.28 0.00 -0.01 0.00 0.00 54.79 51.98 1ib0 n ASP 55 Cb 0.40 -0.35 -0.14 0.00 -1.03 0.00 0.00 41.12 40.00 1ib0 n ASP 55 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1ib0 s THR 56 N -2.10 1.95 0.23 2.12 -4.23 -1.13 0.45 115.64 112.94 1ib0 s THR 56 Ca 0.28 -1.41 -0.00 0.00 -1.18 0.00 0.00 61.69 59.38 1ib0 s THR 56 Cb 0.22 -1.70 -0.04 0.00 1.34 0.00 0.00 72.50 72.32 1ib0 s THR 56 CO 0.08 0.21 0.19 -0.13 -0.54 0.00 0.00 174.62 174.42 1ib0 s ARG 57 N -1.45 1.34 -0.10 3.99 1.81 0.21 -2.24 118.95 122.51 1ib0 s ARG 57 Ca 0.10 -1.68 0.01 0.00 -1.72 0.00 0.00 55.73 52.44 1ib0 s ARG 57 Cb -0.10 0.30 0.02 0.00 -0.45 0.00 0.00 34.95 34.72 1ib0 s ARG 57 CO 0.03 -0.46 -0.10 0.50 -0.68 0.00 0.00 175.30 174.58 1ib0 s ARG 58 N -4.00 1.74 -0.14 3.54 3.52 -0.57 -1.54 118.95 121.50 1ib0 s ARG 58 Ca 0.38 -0.37 -0.01 0.00 -0.13 0.00 0.00 55.73 55.60 1ib0 s ARG 58 Cb 0.06 -1.63 -0.02 0.00 -1.56 0.00 0.00 34.95 31.80 1ib0 s ARG 58 CO 0.15 -0.16 -0.10 -0.06 -0.81 0.00 0.00 175.30 174.31 1ib0 s PHE 59 N 1.31 2.87 -0.13 5.12 0.08 0.88 -0.93 117.98 127.18 1ib0 s PHE 59 Ca -0.02 -0.56 0.02 0.00 0.12 0.00 0.00 56.93 56.50 1ib0 s PHE 59 Cb -0.14 -1.88 0.01 0.00 -0.57 0.00 0.00 43.02 40.45 1ib0 s PHE 59 CO -0.04 -0.17 -0.19 0.50 -0.10 0.00 0.00 175.22 175.22 1ib0 s ARG 60 N 0.37 2.68 0.13 0.44 3.52 -0.36 -0.60 118.95 125.13 1ib0 s ARG 60 Ca -0.09 -0.73 0.08 0.00 -0.13 0.00 0.00 55.73 54.86 1ib0 s ARG 60 Cb -0.15 -2.22 -0.04 0.00 -1.56 0.00 0.00 34.95 30.98 1ib0 s ARG 60 CO 0.05 -0.06 -0.11 -0.06 -0.81 0.00 0.00 175.30 174.31 1ib0 s PHE 61 N 0.94 2.67 0.27 5.12 0.08 -0.79 -0.25 117.98 126.02 1ib0 s PHE 61 Ca -0.06 -0.20 -0.23 0.00 0.12 0.00 0.00 56.93 56.56 1ib0 s PHE 61 Cb -0.15 -1.37 -0.09 0.00 -0.57 0.00 0.00 43.02 40.84 1ib0 s PHE 61 CO -0.03 0.44 0.84 0.00 -0.10 0.00 0.00 175.22 176.37 1ib0 s ALA 62 N -1.35 3.32 0.74 5.36 0.00 0.43 -1.59 121.76 128.67 1ib0 s ALA 62 Ca 0.22 0.36 -0.04 0.00 0.00 0.00 0.00 51.96 52.50 1ib0 s ALA 62 Cb -0.10 -3.01 0.12 0.00 0.00 0.00 0.00 23.12 20.13 1ib0 s ALA 62 CO 0.13 0.25 1.03 -0.51 0.00 0.00 0.00 175.76 176.67 1ib0 s LEU 63 N -1.94 2.94 0.46 0.00 1.43 -0.20 -4.03 118.68 117.35 1ib0 s LEU 63 Ca 0.46 -0.11 0.22 0.00 -1.03 0.00 0.00 54.13 53.67 1ib0 s LEU 63 Cb -0.18 -2.28 1.23 0.00 0.03 0.00 0.00 46.19 44.99 1ib0 s LEU 63 CO 0.23 -1.91 1.88 -0.65 0.23 0.00 0.00 176.35 176.13 1ib0 h PRO 64 N -0.67 0.24 -3.68 1.29 0.11 -1.95 -3.43 132.00 123.91 1ib0 h PRO 64 Ca -0.39 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.62 1ib0 h PRO 64 Cb 1.27 -0.06 -0.14 0.00 0.11 0.00 0.00 31.00 32.18 1ib0 h PRO 64 CO 0.44 0.16 -0.31 -1.54 -0.21 0.00 0.00 178.00 176.54 1ib0 s SER 65 N -5.68 0.03 0.62 -2.05 1.04 -1.26 -5.02 113.70 101.38 1ib0 s SER 65 Ca -0.07 -0.54 0.41 0.00 0.48 0.00 0.00 55.95 56.23 1ib0 s SER 65 Cb 0.22 0.36 2.15 0.00 0.10 0.00 0.00 66.02 68.85 1ib0 s SER 65 CO 0.78 -0.73 2.25 -0.65 0.98 0.00 0.00 173.24 175.87 1ib0 h PRO 66 N 2.77 0.00 -0.10 4.02 0.11 -1.85 -2.31 132.00 134.64 1ib0 h PRO 66 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1ib0 h PRO 66 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1ib0 h PRO 66 CO 0.53 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.36 1ib0 n GLN 67 N -3.01 1.88 -2.20 1.05 3.00 -1.26 -1.90 117.38 114.93 1ib0 n GLN 67 Ca -0.02 -1.29 -0.27 0.00 -0.01 0.00 0.00 57.00 55.41 1ib0 n GLN 67 Cb 0.11 -1.46 0.05 0.00 0.00 0.00 0.00 30.24 28.95 1ib0 n GLN 67 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.06 176.05 1ib0 s HIS 68 N -1.89 3.11 0.26 1.08 3.76 -0.87 -4.79 115.29 115.95 1ib0 s HIS 68 Ca 0.35 0.64 0.05 0.00 -0.15 0.00 0.00 55.06 55.95 1ib0 s HIS 68 Cb 0.20 -3.02 -0.05 0.00 1.11 0.00 0.00 32.58 30.81 1ib0 s HIS 68 CO 0.31 -1.17 -0.04 0.96 -0.85 0.00 0.00 174.74 173.95 1ib0 s ILE 69 N -3.19 1.39 0.01 0.60 -4.36 -0.91 -1.38 121.20 113.36 1ib0 s ILE 69 Ca 0.57 -2.09 -0.25 0.00 -0.26 0.00 0.00 60.65 58.63 1ib0 s ILE 69 Cb -0.11 -2.39 -0.17 0.00 1.25 0.00 0.00 42.46 41.05 1ib0 s ILE 69 CO 0.46 -0.32 1.24 0.25 0.24 0.00 0.00 174.94 176.81 1ib0 h LEU 70 N 2.37 -0.31 -1.19 0.37 5.85 -1.86 -0.65 115.31 119.88 1ib0 h LEU 70 Ca -0.39 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.13 1ib0 h LEU 70 Cb 1.23 0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.34 1ib0 h LEU 70 CO 0.66 0.06 0.00 0.61 -0.34 0.00 0.00 178.44 179.43 1ib0 n GLY 71 N -0.27 0.67 3.06 3.75 0.00 -1.26 -2.15 105.19 109.00 1ib0 n GLY 71 Ca -0.09 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.22 1ib0 n GLY 71 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ib0 s LEU 72 N -1.19 4.18 0.53 0.99 2.96 -1.26 -4.69 118.68 120.20 1ib0 s LEU 72 Ca 0.00 -1.77 -0.21 0.00 -0.22 0.00 0.00 54.13 51.93 1ib0 s LEU 72 Cb 0.00 -1.61 -0.06 0.00 0.50 0.00 0.00 46.19 45.01 1ib0 s LEU 72 CO 0.00 -0.30 1.15 -2.65 -1.32 0.00 0.00 176.35 173.23 1ib0 n PRO 73 N 4.37 1.38 -1.99 0.98 -0.02 -1.26 -4.83 135.00 133.63 1ib0 n PRO 73 Ca -0.05 0.51 -0.42 0.00 -2.02 0.00 0.00 63.50 61.52 1ib0 n PRO 73 Cb 0.42 -2.32 -0.03 0.00 -0.02 0.00 0.00 33.50 31.56 1ib0 n PRO 73 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1ib0 s ILE 74 N -1.35 2.66 0.00 4.25 -1.09 -1.26 -1.97 121.20 122.44 1ib0 s ILE 74 Ca 0.70 0.53 0.00 0.00 -2.23 0.00 0.00 60.65 59.65 1ib0 s ILE 74 Cb -0.45 -3.34 0.00 0.00 -1.58 0.00 0.00 42.46 37.09 1ib0 s ILE 74 CO 0.51 0.07 0.00 0.61 -1.23 0.00 0.00 174.94 174.90 1ib0 n GLY 75 N 2.69 1.83 3.91 6.18 0.00 -1.26 -0.80 105.19 117.75 1ib0 n GLY 75 Ca 0.09 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.91 1ib0 n GLY 75 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ib0 s GLN 76 N -0.84 2.73 0.31 1.61 -0.21 -0.83 -4.60 119.66 117.82 1ib0 s GLN 76 Ca 0.00 -1.33 0.04 0.00 0.02 0.00 0.00 55.36 54.08 1ib0 s GLN 76 Cb 0.00 -2.55 -0.03 0.00 1.00 0.00 0.00 33.01 31.43 1ib0 s GLN 76 CO 0.00 -0.09 0.18 -3.38 -2.12 0.00 0.00 175.29 169.88 1ib0 s HIS 77 N -2.36 1.61 0.44 0.91 -3.43 -0.25 -4.89 115.29 107.31 1ib0 s HIS 77 Ca 0.47 -1.43 0.06 0.00 -0.80 0.00 0.00 55.06 53.35 1ib0 s HIS 77 Cb -0.06 -0.82 -0.05 0.00 -1.43 0.00 0.00 32.58 30.21 1ib0 s HIS 77 CO 0.29 -0.60 0.05 0.96 -2.00 0.00 0.00 174.74 173.45 1ib0 s ILE 78 N -3.59 1.84 0.00 -5.38 -5.25 -0.57 -1.10 121.20 107.15 1ib0 s ILE 78 Ca 0.36 -1.92 0.06 0.00 -0.99 0.00 0.00 60.65 58.15 1ib0 s ILE 78 Cb 0.04 -2.77 -0.02 0.00 2.95 0.00 0.00 42.46 42.67 1ib0 s ILE 78 CO 0.19 0.00 -0.17 -0.31 -1.79 0.00 0.00 174.94 172.86 1ib0 s TYR 79 N -2.73 1.56 0.10 1.37 1.51 -0.62 -0.09 117.35 118.44 1ib0 s TYR 79 Ca 0.29 -0.31 0.03 0.00 -1.01 0.00 0.00 57.07 56.07 1ib0 s TYR 79 Cb 0.06 -0.98 -0.04 0.00 -0.11 0.00 0.00 41.96 40.90 1ib0 s TYR 79 CO 0.15 0.00 0.10 -0.51 -1.11 0.00 0.00 175.55 174.19 1ib0 s LEU 80 N -0.62 3.84 -0.07 -1.29 1.43 0.40 -1.84 118.68 120.53 1ib0 s LEU 80 Ca 0.06 -0.02 -0.18 0.00 -1.03 0.00 0.00 54.13 52.97 1ib0 s LEU 80 Cb -0.07 -2.50 0.04 0.00 0.03 0.00 0.00 46.19 43.68 1ib0 s LEU 80 CO -0.00 0.15 0.42 -0.94 0.23 0.00 0.00 176.35 176.20 1ib0 s SER 81 N -2.57 -0.36 0.09 2.29 1.04 -0.92 -1.30 113.70 111.96 1ib0 s SER 81 Ca 0.30 0.46 -0.26 0.00 0.48 0.00 0.00 55.95 56.93 1ib0 s SER 81 Cb -0.12 0.55 0.09 0.00 0.10 0.00 0.00 66.02 66.64 1ib0 s SER 81 CO 0.23 -0.38 1.14 0.28 0.98 0.00 0.00 173.24 175.49 1ib0 s THR 82 N -0.78 0.00 -0.26 2.02 -1.32 -0.73 -3.44 115.64 111.14 1ib0 s THR 82 Ca -0.09 -0.42 -0.10 0.00 -1.21 0.00 0.00 61.69 59.88 1ib0 s THR 82 Cb -0.04 -2.53 -0.04 0.00 -1.51 0.00 0.00 72.50 68.38 1ib0 s THR 82 CO 0.04 0.00 0.14 -0.13 -2.21 0.00 0.00 174.62 172.46 1ib0 s ARG 83 N -2.40 3.89 -0.11 7.08 0.52 -1.26 -0.42 118.95 126.25 1ib0 s ARG 83 Ca 0.20 -0.36 0.02 0.00 -0.52 0.00 0.00 55.73 55.08 1ib0 s ARG 83 Cb -0.00 -3.51 0.01 0.00 0.52 0.00 0.00 34.95 31.97 1ib0 s ARG 83 CO 0.01 -0.11 -0.18 0.42 0.02 0.00 0.00 175.30 175.46 1ib0 s ILE 84 N 1.49 1.72 -1.48 1.52 -1.09 -0.20 -4.80 121.20 118.36 1ib0 s ILE 84 Ca 0.07 -0.79 -0.03 0.00 -2.23 0.00 0.00 60.65 57.66 1ib0 s ILE 84 Cb -0.15 -1.53 0.03 0.00 -1.58 0.00 0.00 42.46 39.23 1ib0 s ILE 84 CO 0.07 0.48 0.43 -0.67 -1.23 0.00 0.00 174.94 174.02 1ib0 n ASP 85 N 3.96 -0.68 0.00 3.58 4.64 -1.26 -1.31 116.55 125.49 1ib0 n ASP 85 Ca -0.20 -1.05 0.00 0.00 -1.38 0.00 0.00 54.79 52.17 1ib0 n ASP 85 Cb 0.52 -2.79 0.00 0.00 -1.04 0.00 0.00 41.12 37.80 1ib0 n ASP 85 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1ib0 n GLY 86 N -1.96 0.84 3.49 0.27 0.00 -1.26 -5.03 105.19 101.55 1ib0 n GLY 86 Ca -0.24 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.53 1ib0 n GLY 86 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ib0 s ASN 87 N -2.84 3.55 -0.08 1.61 0.01 -0.43 -5.12 114.94 111.64 1ib0 s ASN 87 Ca 0.00 -1.12 -0.20 0.00 -0.71 0.00 0.00 52.86 50.83 1ib0 s ASN 87 Cb 0.00 -0.31 -0.04 0.00 0.41 0.00 0.00 41.25 41.31 1ib0 s ASN 87 CO 0.00 -0.11 0.55 -0.22 -1.51 0.00 0.00 177.10 175.81 1ib0 s LEU 88 N -3.54 4.31 -0.11 0.60 2.96 -1.26 -1.03 118.68 120.61 1ib0 s LEU 88 Ca 0.31 0.97 0.03 0.00 -0.22 0.00 0.00 54.13 55.22 1ib0 s LEU 88 Cb -0.01 -2.83 0.01 0.00 0.50 0.00 0.00 46.19 43.86 1ib0 s LEU 88 CO 0.15 -0.00 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.29 1ib0 s VAL 89 N 0.49 1.82 -0.05 1.68 1.01 0.44 -4.95 120.40 120.85 1ib0 s VAL 89 Ca 0.30 -0.86 0.06 0.00 0.00 0.00 0.00 61.98 61.48 1ib0 s VAL 89 Cb -0.16 -1.62 -0.01 0.00 0.00 0.00 0.00 36.38 34.59 1ib0 s VAL 89 CO 0.14 0.51 -0.22 -0.63 0.00 0.00 0.00 175.10 174.89 1ib0 s ILE 90 N 0.70 1.84 -0.13 2.22 1.01 -1.26 -1.77 121.20 123.81 1ib0 s ILE 90 Ca -0.11 -0.95 -0.10 0.00 0.00 0.00 0.00 60.65 59.49 1ib0 s ILE 90 Cb -0.16 -1.56 0.04 0.00 0.01 0.00 0.00 42.46 40.79 1ib0 s ILE 90 CO 0.02 0.52 0.33 -0.13 0.00 0.00 0.00 174.94 175.67 1ib0 s ARG 91 N -0.13 0.35 0.22 2.79 1.81 -0.42 -4.98 118.95 118.60 1ib0 s ARG 91 Ca -0.03 0.53 -0.26 0.00 -1.72 0.00 0.00 55.73 54.26 1ib0 s ARG 91 Cb -0.13 0.08 -0.09 0.00 -0.45 0.00 0.00 34.95 34.37 1ib0 s ARG 91 CO 0.03 -0.09 0.84 -1.25 -0.68 0.00 0.00 175.30 174.15 1ib0 s PRO 92 N 0.63 4.61 -0.02 3.54 0.04 -1.26 -0.45 135.00 142.08 1ib0 s PRO 92 Ca -0.04 1.24 -0.05 0.00 0.04 0.00 0.00 61.00 62.20 1ib0 s PRO 92 Cb -0.05 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.36 1ib0 s PRO 92 CO -0.04 0.48 0.11 0.71 0.04 0.00 0.00 177.00 178.30 1ib0 s TYR 93 N -1.29 -0.03 -0.32 0.56 2.02 0.87 -4.95 117.35 114.21 1ib0 s TYR 93 Ca 0.41 0.08 -0.03 0.00 -0.37 0.00 0.00 57.07 57.15 1ib0 s TYR 93 Cb -0.22 -0.01 0.05 0.00 -0.40 0.00 0.00 41.96 41.37 1ib0 s TYR 93 CO 0.27 -0.15 0.04 0.99 -1.57 0.00 0.00 175.55 175.12 1ib0 s THR 94 N -0.60 3.24 0.71 -0.71 2.01 -1.26 -1.51 115.64 117.52 1ib0 s THR 94 Ca -0.07 -1.34 -0.16 0.00 0.31 0.00 0.00 61.69 60.43 1ib0 s THR 94 Cb -0.04 -2.87 0.00 0.00 0.01 0.00 0.00 72.50 69.60 1ib0 s THR 94 CO 0.01 -0.15 0.96 -2.65 -0.69 0.00 0.00 174.62 172.09 1ib0 n PRO 95 N 4.68 0.53 0.04 4.92 -0.02 -1.26 -4.76 135.00 139.13 1ib0 n PRO 95 Ca -0.12 0.23 0.11 0.00 -2.02 0.00 0.00 63.50 61.70 1ib0 n PRO 95 Cb 0.44 -2.21 0.03 0.00 -0.02 0.00 0.00 33.50 31.74 1ib0 n PRO 95 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1ib0 n VAL 96 N -2.46 0.27 -1.99 -1.45 0.24 -0.59 -4.81 118.33 107.53 1ib0 n VAL 96 Ca 0.13 -0.32 -0.29 0.00 -2.04 0.00 0.00 64.34 61.82 1ib0 n VAL 96 Cb 0.49 0.04 0.15 0.00 -1.47 0.00 0.00 33.84 33.05 1ib0 n VAL 96 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1ib0 s SER 97 N -4.27 3.64 0.20 -1.34 1.04 -1.24 -5.01 113.70 106.73 1ib0 s SER 97 Ca 0.03 0.35 0.03 0.00 0.48 0.00 0.00 55.95 56.84 1ib0 s SER 97 Cb 0.13 -0.56 -0.01 0.00 0.10 0.00 0.00 66.02 65.68 1ib0 s SER 97 CO 0.79 -2.40 0.19 -1.54 0.98 0.00 0.00 173.24 171.26 1ib0 n SER 98 N -3.54 -0.50 0.00 7.02 3.41 -1.26 -4.92 113.62 113.83 1ib0 n SER 98 Ca 0.13 -2.26 0.10 0.00 -0.26 0.00 0.00 58.87 56.58 1ib0 n SER 98 Cb 0.60 1.09 0.56 0.00 -0.26 0.00 0.00 64.21 66.20 1ib0 n SER 98 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1ib0 n ASP 99 N -2.15 0.00 0.08 4.04 8.00 -1.26 -1.61 116.55 123.65 1ib0 n ASP 99 Ca 0.04 -0.53 0.13 0.00 0.71 0.00 0.00 54.79 55.13 1ib0 n ASP 99 Cb 0.35 -0.03 0.39 0.00 -0.02 0.00 0.00 41.12 41.81 1ib0 n ASP 99 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1ib0 n ASP 100 N -1.03 0.65 -4.71 -2.24 10.43 -1.26 -4.82 116.55 113.57 1ib0 n ASP 100 Ca 0.14 0.45 -0.38 0.00 2.57 0.00 0.00 54.79 57.56 1ib0 n ASP 100 Cb 0.07 -0.53 -0.06 0.00 1.84 0.00 0.00 41.12 42.44 1ib0 n ASP 100 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 1ib0 s ASP 101 N -4.17 6.71 -0.21 -2.24 1.01 -0.63 -5.06 116.67 112.08 1ib0 s ASP 101 Ca 0.10 0.84 -0.10 0.00 0.71 0.00 0.00 52.55 54.10 1ib0 s ASP 101 Cb 0.14 -2.30 -0.05 0.00 1.01 0.00 0.00 42.92 41.72 1ib0 s ASP 101 CO 0.61 -0.04 0.14 -0.54 0.21 0.00 0.00 175.17 175.56 1ib0 s LYS 102 N 0.77 4.17 0.00 8.23 -0.14 -1.26 -4.56 119.74 126.95 1ib0 s LYS 102 Ca 0.27 -0.22 0.00 0.00 -1.36 0.00 0.00 55.97 54.66 1ib0 s LYS 102 Cb -0.15 -3.45 0.00 0.00 -1.68 0.00 0.00 37.83 32.55 1ib0 s LYS 102 CO 0.11 0.25 0.00 0.41 -0.76 0.00 0.00 175.35 175.36 1ib0 n GLY 103 N 3.68 2.04 3.36 -3.33 0.00 -0.48 -4.86 105.19 105.60 1ib0 n GLY 103 Ca -0.16 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.77 1ib0 n GLY 103 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ib0 s PHE 104 N -2.41 0.35 -0.03 1.61 -0.12 -1.26 -1.03 117.98 115.08 1ib0 s PHE 104 Ca 0.00 -0.71 0.01 0.00 -0.05 0.00 0.00 56.93 56.18 1ib0 s PHE 104 Cb 0.00 -0.01 0.02 0.00 -0.63 0.00 0.00 43.02 42.40 1ib0 s PHE 104 CO 0.00 -0.74 -0.02 0.54 -0.05 0.00 0.00 175.22 174.95 1ib0 s VAL 105 N -3.96 0.29 -0.15 -2.49 0.11 -0.62 -4.79 120.40 108.79 1ib0 s VAL 105 Ca 0.16 0.01 -0.04 0.00 -2.93 0.00 0.00 61.98 59.18 1ib0 s VAL 105 Cb 0.03 -0.35 -0.03 0.00 -1.53 0.00 0.00 36.38 34.50 1ib0 s VAL 105 CO -0.00 0.16 -0.02 -1.81 -3.33 0.00 0.00 175.10 170.10 1ib0 s ASP 106 N 0.89 5.00 -0.02 3.54 1.01 -1.26 -1.88 116.67 123.95 1ib0 s ASP 106 Ca -0.10 -0.05 0.07 0.00 0.71 0.00 0.00 52.55 53.18 1ib0 s ASP 106 Cb -0.13 -1.75 -0.02 0.00 1.01 0.00 0.00 42.92 42.03 1ib0 s ASP 106 CO -0.01 0.21 -0.24 -0.76 0.21 0.00 0.00 175.17 174.58 1ib0 s LEU 107 N 0.14 2.18 -0.22 1.23 1.43 0.23 -1.55 118.68 122.13 1ib0 s LEU 107 Ca 0.00 -0.43 -0.03 0.00 -1.03 0.00 0.00 54.13 52.64 1ib0 s LEU 107 Cb -0.13 -1.38 0.00 0.00 0.03 0.00 0.00 46.19 44.71 1ib0 s LEU 107 CO 0.02 0.32 -0.06 -0.69 0.23 0.00 0.00 176.35 176.17 1ib0 s VAL 108 N -0.64 3.12 0.02 -1.59 1.01 -1.26 -0.09 120.40 120.97 1ib0 s VAL 108 Ca 0.10 -0.67 0.05 0.00 0.00 0.00 0.00 61.98 61.47 1ib0 s VAL 108 Cb -0.10 -2.45 -0.02 0.00 0.00 0.00 0.00 36.38 33.81 1ib0 s VAL 108 CO -0.01 0.38 -0.15 -0.69 0.00 0.00 0.00 175.10 174.63 1ib0 s VAL 109 N 1.42 1.22 -0.19 2.92 1.01 -0.59 -4.97 120.40 121.23 1ib0 s VAL 109 Ca 0.04 -0.90 -0.16 0.00 0.00 0.00 0.00 61.98 60.97 1ib0 s VAL 109 Cb -0.15 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.12 1ib0 s VAL 109 CO -0.05 0.16 0.39 -0.75 0.00 0.00 0.00 175.10 174.85 1ib0 s LYS 110 N -0.86 4.20 -0.21 2.72 2.20 -1.26 -0.62 119.74 125.91 1ib0 s LYS 110 Ca 0.04 0.21 -0.17 0.00 -0.36 0.00 0.00 55.97 55.70 1ib0 s LYS 110 Cb -0.07 -3.51 -0.04 0.00 -1.51 0.00 0.00 37.83 32.70 1ib0 s LYS 110 CO 0.01 0.01 0.44 0.08 -0.36 0.00 0.00 175.35 175.53 1ib0 s VAL 111 N 1.15 5.16 -0.76 4.02 1.01 0.17 -4.83 120.40 126.33 1ib0 s VAL 111 Ca 0.19 0.78 -0.16 0.00 0.00 0.00 0.00 61.98 62.79 1ib0 s VAL 111 Cb -0.15 -3.77 0.17 0.00 0.00 0.00 0.00 36.38 32.64 1ib0 s VAL 111 CO 0.08 0.21 0.78 -0.31 0.00 0.00 0.00 175.10 175.85 1ib0 s TYR 112 N 1.57 3.43 0.29 5.22 2.02 -1.26 -4.87 117.35 123.75 1ib0 s TYR 112 Ca 0.20 -1.59 -0.29 0.00 -0.37 0.00 0.00 57.07 55.02 1ib0 s TYR 112 Cb -0.15 -3.94 -0.10 0.00 -0.40 0.00 0.00 41.96 37.38 1ib0 s TYR 112 CO 0.09 -1.14 1.19 -0.06 -1.57 0.00 0.00 175.55 174.06 1ib0 s PHE 113 N 1.31 3.36 1.02 2.71 0.08 -1.26 0.32 117.98 125.51 1ib0 s PHE 113 Ca 0.17 1.55 -0.12 0.00 0.12 0.00 0.00 56.93 58.65 1ib0 s PHE 113 Cb -0.15 -3.46 0.20 0.00 -0.57 0.00 0.00 43.02 39.05 1ib0 s PHE 113 CO -0.04 -1.14 1.08 -1.59 -0.10 0.00 0.00 175.22 173.42 1ib0 s LYS 114 N -1.41 0.24 -1.51 0.44 -2.85 -1.26 -3.81 119.74 109.58 1ib0 s LYS 114 Ca 0.47 0.74 -0.01 0.00 -1.00 0.00 0.00 55.97 56.17 1ib0 s LYS 114 Cb -0.35 -1.70 0.00 0.00 -2.06 0.00 0.00 37.83 33.72 1ib0 s LYS 114 CO 0.45 -2.91 0.11 0.39 0.10 0.00 0.00 175.35 173.48 1ib0 n GLU 115 N -4.34 -1.45 0.02 1.78 1.02 0.20 -4.80 120.64 113.08 1ib0 n GLU 115 Ca 0.05 0.16 0.00 0.00 -0.02 0.00 0.00 57.16 57.35 1ib0 n GLU 115 Cb 0.56 -3.77 0.00 0.00 -0.02 0.00 0.00 31.44 28.20 1ib0 n GLU 115 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1ib0 n THR 116 N -4.56 0.12 -3.44 2.62 -1.04 -1.25 -5.03 114.28 101.70 1ib0 n THR 116 Ca -0.32 0.04 -0.38 0.00 -2.04 0.00 0.00 64.05 61.35 1ib0 n THR 116 Cb 0.69 -0.99 -0.07 0.00 -1.82 0.00 0.00 70.33 68.14 1ib0 n THR 116 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 1ib0 s HIS 117 N -2.00 3.40 0.52 -1.42 5.65 -1.26 -4.97 115.29 115.22 1ib0 s HIS 117 Ca 0.00 0.60 0.24 0.00 0.25 0.00 0.00 55.06 56.15 1ib0 s HIS 117 Cb 0.00 -2.46 1.36 0.00 -1.18 0.00 0.00 32.58 30.30 1ib0 s HIS 117 CO 0.00 0.07 2.00 -1.00 -0.65 0.00 0.00 174.74 175.17 1ib0 h PRO 118 N 7.15 0.03 0.00 2.88 0.13 -1.99 -1.96 132.00 138.24 1ib0 h PRO 118 Ca -0.38 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1ib0 h PRO 118 Cb 1.16 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1ib0 h PRO 118 CO 0.73 0.02 -0.31 0.87 -0.23 0.00 0.00 178.00 179.07 1ib0 h LYS 119 N 0.03 0.00 -1.77 0.86 1.57 -2.04 -3.38 116.57 111.85 1ib0 h LYS 119 Ca 0.24 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.52 1ib0 h LYS 119 Cb 0.92 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.82 1ib0 h LYS 119 CO -0.01 0.00 -0.97 1.19 -0.57 0.00 0.00 179.45 179.09 1ib0 n PHE 120 N -2.95 1.99 -0.55 -1.35 3.72 -0.75 -4.96 117.46 112.62 1ib0 n PHE 120 Ca 0.03 -3.51 0.43 0.00 -0.05 0.00 0.00 57.45 54.35 1ib0 n PHE 120 Cb 0.53 -0.37 0.69 0.00 -0.94 0.00 0.00 39.48 39.39 1ib0 n PHE 120 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1ib0 n PRO 121 N -0.07 -0.01 0.15 -1.08 -0.04 -1.17 -0.43 135.00 132.35 1ib0 n PRO 121 Ca 0.25 1.04 0.13 0.00 -0.04 0.00 0.00 63.50 64.88 1ib0 n PRO 121 Cb 0.63 -2.24 0.31 0.00 -0.04 0.00 0.00 33.50 32.15 1ib0 n PRO 121 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ib0 h ALA 122 N 1.12 1.00 -0.18 0.55 0.00 -1.92 0.58 119.26 120.40 1ib0 h ALA 122 Ca 0.83 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.74 1ib0 h ALA 122 Cb 3.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 20.85 1ib0 h ALA 122 CO -0.18 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.48 1ib0 n GLY 123 N 1.21 -1.74 3.86 0.00 0.00 0.43 -4.30 105.19 104.64 1ib0 n GLY 123 Ca 0.05 -1.34 -0.35 0.00 0.00 0.00 0.00 46.02 44.38 1ib0 n GLY 123 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ib0 s GLY 124 N -1.19 2.39 -0.08 -0.02 0.00 0.15 -4.91 107.32 103.66 1ib0 s GLY 124 Ca 0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 44.72 44.45 1ib0 s GLY 124 CO 0.00 -0.03 0.00 0.50 0.00 0.00 0.00 173.10 173.58 1ib0 h LYS 125 N 3.57 -0.00 -0.55 2.90 1.57 -1.88 -3.07 116.57 119.10 1ib0 h LYS 125 Ca -0.49 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.18 1ib0 h LYS 125 Cb 1.19 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.48 1ib0 h LYS 125 CO 0.66 -0.00 -0.08 1.98 -0.57 0.00 0.00 179.45 181.44 1ib0 h MET 126 N -0.83 1.02 -0.69 3.15 4.05 -1.97 -1.38 114.93 118.28 1ib0 h MET 126 Ca -0.00 -0.36 -0.06 0.00 -0.28 0.00 0.00 59.70 58.99 1ib0 h MET 126 Cb 0.00 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 30.70 1ib0 h MET 126 CO 0.00 1.05 0.18 0.66 0.23 0.00 0.00 176.91 179.03 1ib0 h SER 127 N 0.91 1.03 0.41 1.39 4.64 -1.88 -1.04 113.55 119.01 1ib0 h SER 127 Ca 0.15 -0.21 -0.16 0.00 -0.47 0.00 0.00 61.79 61.10 1ib0 h SER 127 Cb 0.64 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.45 1ib0 h SER 127 CO 0.04 0.98 -0.67 1.56 -0.87 0.00 0.00 176.83 177.87 1ib0 h GLN 128 N 1.04 0.24 -0.82 4.77 4.20 -1.43 -2.15 115.11 120.97 1ib0 h GLN 128 Ca 0.22 -0.18 -0.04 0.00 0.06 0.00 0.00 58.65 58.71 1ib0 h GLN 128 Cb 0.35 0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.12 1ib0 h GLN 128 CO -0.00 0.82 0.35 -0.92 -0.67 0.00 0.00 178.83 178.41 1ib0 h TYR 129 N 0.17 1.23 -0.32 2.96 3.20 -0.94 -1.31 116.97 121.95 1ib0 h TYR 129 Ca -0.02 -0.08 -0.02 0.00 3.14 0.00 0.00 58.73 61.75 1ib0 h TYR 129 Cb 1.21 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 39.09 1ib0 h TYR 129 CO 0.02 0.91 0.12 -0.07 -1.64 0.00 0.00 178.16 177.50 1ib0 h LEU 130 N 1.18 0.45 -2.30 2.82 3.38 -0.97 -2.51 115.31 117.36 1ib0 h LEU 130 Ca 0.28 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1ib0 h LEU 130 Cb 0.19 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 1ib0 h LEU 130 CO -0.03 0.51 -0.04 -0.08 0.09 0.00 0.00 178.44 178.89 1ib0 h GLU 131 N 0.37 0.00 -0.01 1.13 4.57 -0.90 -2.54 114.58 117.20 1ib0 h GLU 131 Ca 0.11 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.29 1ib0 h GLU 131 Cb 0.21 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.80 1ib0 h GLU 131 CO -0.01 0.04 -0.28 0.09 -1.18 0.00 0.00 179.01 177.68 1ib0 n ASN 132 N -3.69 1.57 -4.78 1.04 3.02 -0.54 -4.96 115.26 106.92 1ib0 n ASN 132 Ca -0.02 -1.26 -0.35 0.00 -0.03 0.00 0.00 54.58 52.92 1ib0 n ASN 132 Cb 0.14 0.22 -0.01 0.00 -0.61 0.00 0.00 39.78 39.53 1ib0 n ASN 132 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1ib0 s MET 133 N -2.40 3.45 0.02 3.52 -1.94 -0.96 -5.04 119.30 115.95 1ib0 s MET 133 Ca 0.24 1.53 -0.01 0.00 -1.71 0.00 0.00 55.69 55.74 1ib0 s MET 133 Cb 0.19 -2.03 -0.04 0.00 2.01 0.00 0.00 34.83 34.96 1ib0 s MET 133 CO 0.50 -0.75 0.16 -0.80 -0.01 0.00 0.00 175.02 174.12 1ib0 s ASN 134 N -1.88 6.17 0.28 3.03 -0.87 -1.26 -5.02 114.94 115.39 1ib0 s ASN 134 Ca 0.71 0.26 -0.30 0.00 -1.57 0.00 0.00 52.86 51.96 1ib0 s ASN 134 Cb -0.22 -1.88 -0.13 0.00 -0.02 0.00 0.00 41.25 39.00 1ib0 s ASN 134 CO 0.26 0.24 1.38 -0.38 -2.57 0.00 0.00 177.10 176.02 1ib0 n ILE 135 N 0.79 1.30 0.00 0.60 5.41 -1.26 -0.55 119.36 125.64 1ib0 n ILE 135 Ca -0.10 -0.32 0.00 0.00 1.00 0.00 0.00 62.75 63.33 1ib0 n ILE 135 Cb 0.52 -1.54 0.00 0.00 -0.71 0.00 0.00 39.64 37.91 1ib0 n ILE 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ib0 n GLY 136 N 1.72 3.20 3.73 7.39 0.00 0.68 -4.99 105.19 116.93 1ib0 n GLY 136 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 1ib0 n GLY 136 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ib0 s ASP 137 N -0.18 3.85 0.29 1.61 1.01 0.28 -4.58 116.67 118.95 1ib0 s ASP 137 Ca 0.00 1.65 0.11 0.00 0.71 0.00 0.00 52.55 55.01 1ib0 s ASP 137 Cb 0.00 -2.33 -0.05 0.00 1.01 0.00 0.00 42.92 41.55 1ib0 s ASP 137 CO 0.00 -2.42 -0.16 0.42 0.21 0.00 0.00 175.17 173.22 1ib0 s THR 138 N -2.91 2.29 -0.04 -1.27 -4.23 -1.26 -0.93 115.64 107.30 1ib0 s THR 138 Ca 0.63 -2.32 -0.13 0.00 -1.18 0.00 0.00 61.69 58.68 1ib0 s THR 138 Cb -0.18 -2.38 0.02 0.00 1.34 0.00 0.00 72.50 71.30 1ib0 s THR 138 CO 0.57 -0.36 0.30 -0.51 -0.54 0.00 0.00 174.62 174.08 1ib0 s ILE 139 N -2.61 0.05 0.11 2.99 2.07 -0.79 -4.93 121.20 118.09 1ib0 s ILE 139 Ca 0.30 -0.39 -0.30 0.00 -1.41 0.00 0.00 60.65 58.85 1ib0 s ILE 139 Cb -0.02 -0.57 -0.06 0.00 0.13 0.00 0.00 42.46 41.94 1ib0 s ILE 139 CO 0.14 -0.21 1.01 -1.61 -1.91 0.00 0.00 174.94 172.36 1ib0 s GLU 140 N -1.01 4.64 0.08 3.50 2.02 -1.22 -1.30 118.70 125.40 1ib0 s GLU 140 Ca -0.11 1.54 0.07 0.00 0.02 0.00 0.00 54.97 56.49 1ib0 s GLU 140 Cb -0.05 -3.36 -0.04 0.00 0.10 0.00 0.00 34.13 30.79 1ib0 s GLU 140 CO 0.03 0.13 -0.15 -0.06 0.02 0.00 0.00 175.26 175.23 1ib0 s PHE 141 N 0.10 2.64 0.02 1.61 0.40 0.69 -2.17 117.98 121.27 1ib0 s PHE 141 Ca 0.49 -0.21 -0.16 0.00 -0.60 0.00 0.00 56.93 56.45 1ib0 s PHE 141 Cb -0.25 -1.43 0.03 0.00 0.51 0.00 0.00 43.02 41.87 1ib0 s PHE 141 CO 0.31 0.36 0.34 -0.98 0.70 0.00 0.00 175.22 175.95 1ib0 s ARG 142 N -1.88 0.78 0.00 0.44 1.70 -0.77 -0.17 118.95 119.06 1ib0 s ARG 142 Ca 0.18 -0.31 0.00 0.00 -0.47 0.00 0.00 55.73 55.13 1ib0 s ARG 142 Cb -0.11 0.35 0.00 0.00 -0.57 0.00 0.00 34.95 34.62 1ib0 s ARG 142 CO 0.09 -0.24 0.00 0.41 -1.08 0.00 0.00 175.30 174.48 1ib0 n GLY 143 N 0.87 -1.62 3.91 3.88 0.00 -1.26 -1.59 105.19 109.38 1ib0 n GLY 143 Ca -0.20 -1.26 -0.27 0.00 0.00 0.00 0.00 46.02 44.28 1ib0 n GLY 143 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ib0 s PRO 144 N -2.00 3.34 -0.02 1.61 0.04 -1.26 -3.64 135.00 133.07 1ib0 s PRO 144 Ca 0.00 0.15 -0.05 0.00 0.04 0.00 0.00 61.00 61.14 1ib0 s PRO 144 Cb 0.00 -2.33 0.00 0.00 0.04 0.00 0.00 34.50 32.21 1ib0 s PRO 144 CO 0.00 -0.38 0.11 -0.80 0.04 0.00 0.00 177.00 175.97 1ib0 s ASN 145 N -4.18 -0.01 0.00 6.66 0.01 -0.26 -4.92 114.94 112.24 1ib0 s ASN 145 Ca 0.50 -0.05 0.00 0.00 -0.71 0.00 0.00 52.86 52.59 1ib0 s ASN 145 Cb -0.10 0.21 0.00 0.00 0.41 0.00 0.00 41.25 41.77 1ib0 s ASN 145 CO 0.45 -0.22 0.00 0.61 -1.51 0.00 0.00 177.10 176.43 1ib0 n GLY 146 N 2.14 4.87 0.15 0.66 0.00 -1.26 -1.10 105.19 110.65 1ib0 n GLY 146 Ca -0.18 -0.86 0.13 0.00 0.00 0.00 0.00 46.02 45.11 1ib0 n GLY 146 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ib0 h LEU 147 N 0.00 0.00 -8.64 0.99 3.38 -1.89 -3.44 115.31 105.71 1ib0 h LEU 147 Ca 0.00 0.00 -0.66 0.00 0.09 0.00 0.00 57.88 57.31 1ib0 h LEU 147 Cb 0.00 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 40.48 1ib0 h LEU 147 CO 0.00 0.00 -0.78 -0.22 0.09 0.00 0.00 178.44 177.53 1ib0 s LEU 148 N -4.80 2.67 -0.08 1.67 0.20 -1.26 -1.42 118.68 115.65 1ib0 s LEU 148 Ca 0.05 -0.33 0.01 0.00 0.69 0.00 0.00 54.13 54.56 1ib0 s LEU 148 Cb 0.10 -1.59 0.02 0.00 -0.43 0.00 0.00 46.19 44.29 1ib0 s LEU 148 CO 0.48 0.19 -0.09 -0.69 -0.29 0.00 0.00 176.35 175.94 1ib0 s VAL 149 N 0.19 1.00 -0.18 1.68 1.01 -0.54 -3.71 120.40 119.85 1ib0 s VAL 149 Ca -0.08 -0.36 -0.20 0.00 0.00 0.00 0.00 61.98 61.34 1ib0 s VAL 149 Cb -0.15 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 35.23 1ib0 s VAL 149 CO 0.05 0.34 0.56 -0.47 0.00 0.00 0.00 175.10 175.59 1ib0 s TYR 150 N 1.04 3.40 -1.73 5.22 5.04 0.02 -0.90 117.35 129.44 1ib0 s TYR 150 Ca -0.08 0.87 0.20 0.00 -2.44 0.00 0.00 57.07 55.62 1ib0 s TYR 150 Cb -0.15 -2.71 0.64 0.00 0.35 0.00 0.00 41.96 40.09 1ib0 s TYR 150 CO -0.01 -0.09 1.54 1.04 -1.34 0.00 0.00 175.55 176.70 1ib0 n GLN 151 N 4.69 2.94 0.00 4.97 6.02 0.73 -4.52 117.38 132.20 1ib0 n GLN 151 Ca -0.04 -2.58 0.00 0.00 -0.01 0.00 0.00 57.00 54.38 1ib0 n GLN 151 Cb 0.50 -1.65 0.00 0.00 1.02 0.00 0.00 30.24 30.12 1ib0 n GLN 151 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ib0 n GLY 152 N 1.45 -2.24 3.82 1.08 0.00 -1.24 -4.82 105.19 103.24 1ib0 n GLY 152 Ca 0.24 -1.49 -0.28 0.00 0.00 0.00 0.00 46.02 44.49 1ib0 n GLY 152 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ib0 n LYS 153 N -1.81 -5.93 -0.72 1.61 4.76 -1.26 -1.81 118.16 113.00 1ib0 n LYS 153 Ca 0.00 0.65 0.00 0.00 -2.87 0.00 0.00 58.31 56.09 1ib0 n LYS 153 Cb 0.00 -5.53 0.00 0.00 -1.84 0.00 0.00 35.03 27.66 1ib0 n LYS 153 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ib0 n GLY 154 N -1.73 1.41 3.66 0.72 0.00 -1.26 -4.90 105.19 103.10 1ib0 n GLY 154 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 1ib0 n GLY 154 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ib0 s LYS 155 N -0.05 4.22 -0.19 1.61 1.02 -0.75 -1.13 119.74 124.47 1ib0 s LYS 155 Ca 0.00 0.62 -0.00 0.00 0.02 0.00 0.00 55.97 56.61 1ib0 s LYS 155 Cb 0.00 -3.57 0.01 0.00 -0.52 0.00 0.00 37.83 33.75 1ib0 s LYS 155 CO 0.00 -0.22 -0.16 -0.06 -0.92 0.00 0.00 175.35 173.99 1ib0 s PHE 156 N 1.84 2.83 -0.37 3.18 0.40 0.76 -0.19 117.98 126.44 1ib0 s PHE 156 Ca 0.29 -1.49 -0.19 0.00 -0.60 0.00 0.00 56.93 54.94 1ib0 s PHE 156 Cb -0.16 -1.97 0.00 0.00 0.51 0.00 0.00 43.02 41.41 1ib0 s PHE 156 CO 0.11 -0.75 0.56 0.00 0.70 0.00 0.00 175.22 175.83 1ib0 s ALA 157 N 1.33 3.45 -0.03 5.36 0.00 -0.08 -1.38 121.76 130.40 1ib0 s ALA 157 Ca 0.05 -1.03 0.06 0.00 0.00 0.00 0.00 51.96 51.04 1ib0 s ALA 157 Cb -0.13 -3.10 -0.01 0.00 0.00 0.00 0.00 23.12 19.88 1ib0 s ALA 157 CO -0.10 -1.35 -0.22 0.42 0.00 0.00 0.00 175.76 174.51 1ib0 s ILE 158 N 2.51 1.77 -0.20 0.00 -1.09 -0.45 -1.47 121.20 122.28 1ib0 s ILE 158 Ca 0.20 -0.93 -0.07 0.00 -2.23 0.00 0.00 60.65 57.62 1ib0 s ILE 158 Cb -0.15 -1.49 -0.04 0.00 -1.58 0.00 0.00 42.46 39.20 1ib0 s ILE 158 CO 0.14 0.50 0.06 -0.13 -1.23 0.00 0.00 174.94 174.28 1ib0 s ARG 159 N -0.30 3.88 0.29 2.79 0.52 -0.51 0.47 118.95 126.10 1ib0 s ARG 159 Ca 0.02 -0.39 -0.00 0.00 -0.52 0.00 0.00 55.73 54.84 1ib0 s ARG 159 Cb -0.11 -3.22 0.49 0.00 0.52 0.00 0.00 34.95 32.63 1ib0 s ARG 159 CO 0.01 0.16 1.90 0.00 0.02 0.00 0.00 175.30 177.39 1ib0 h ALA 160 N 7.05 1.47 -2.94 2.13 0.00 -1.88 -3.45 119.26 121.64 1ib0 h ALA 160 Ca -0.36 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.48 1ib0 h ALA 160 Cb 1.17 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.63 1ib0 h ALA 160 CO 0.66 0.38 0.08 0.16 0.00 0.00 0.00 179.25 180.54 1ib0 s ASP 161 N -5.95 0.04 0.55 0.00 1.47 -1.26 -5.06 116.67 106.46 1ib0 s ASP 161 Ca -0.12 -0.98 0.25 0.00 1.18 0.00 0.00 52.55 52.88 1ib0 s ASP 161 Cb 0.20 0.72 1.59 0.00 -0.34 0.00 0.00 42.92 45.08 1ib0 s ASP 161 CO 0.81 -1.38 2.19 0.11 0.68 0.00 0.00 175.17 177.57 1ib0 h LYS 162 N 2.09 0.00 -0.43 2.11 1.57 -2.00 -2.68 116.57 117.23 1ib0 h LYS 162 Ca -0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.52 1ib0 h LYS 162 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.56 1ib0 h LYS 162 CO 0.34 0.03 0.00 1.63 -0.57 0.00 0.00 179.45 180.88 1ib0 n LYS 163 N -4.02 2.01 -4.31 3.15 5.02 -1.26 -4.90 118.16 113.85 1ib0 n LYS 163 Ca -0.03 -1.54 -0.23 0.00 -2.02 0.00 0.00 58.31 54.49 1ib0 n LYS 163 Cb 0.12 -1.34 -0.08 0.00 -0.02 0.00 0.00 35.03 33.71 1ib0 n LYS 163 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1ib0 s SER 164 N -0.99 4.37 0.51 4.39 0.01 -1.01 -5.13 113.70 115.84 1ib0 s SER 164 Ca 0.29 -0.76 -0.08 0.00 1.31 0.00 0.00 55.95 56.70 1ib0 s SER 164 Cb 0.15 -0.71 -0.04 0.00 0.21 0.00 0.00 66.02 65.63 1ib0 s SER 164 CO 0.19 -0.06 0.86 0.20 0.41 0.00 0.00 173.24 174.84 1ib0 s ASN 165 N -3.67 6.31 0.36 2.44 0.01 -1.26 -4.83 114.94 114.30 1ib0 s ASN 165 Ca 0.32 1.12 -0.25 0.00 -0.71 0.00 0.00 52.86 53.34 1ib0 s ASN 165 Cb -0.05 -2.33 -0.09 0.00 0.41 0.00 0.00 41.25 39.19 1ib0 s ASN 165 CO 0.19 -0.63 1.00 -2.16 -1.51 0.00 0.00 177.10 174.00 1ib0 s PRO 166 N -4.69 4.38 -0.22 -0.60 0.04 -1.26 -4.60 135.00 128.05 1ib0 s PRO 166 Ca 0.50 1.43 -0.10 0.00 0.04 0.00 0.00 61.00 62.88 1ib0 s PRO 166 Cb -0.10 -2.67 -0.05 0.00 0.04 0.00 0.00 34.50 31.72 1ib0 s PRO 166 CO 0.45 0.06 0.13 0.08 0.04 0.00 0.00 177.00 177.76 1ib0 s VAL 167 N -1.64 5.24 0.05 -0.36 1.01 0.18 -4.77 120.40 120.10 1ib0 s VAL 167 Ca 0.54 0.13 -0.11 0.00 0.00 0.00 0.00 61.98 62.54 1ib0 s VAL 167 Cb -0.21 -3.42 -0.06 0.00 0.00 0.00 0.00 36.38 32.70 1ib0 s VAL 167 CO 0.26 0.39 0.39 -0.69 0.00 0.00 0.00 175.10 175.45 1ib0 s VAL 168 N 0.79 5.09 -0.01 2.92 1.01 -1.26 -1.34 120.40 127.60 1ib0 s VAL 168 Ca 0.07 0.57 -0.07 0.00 0.00 0.00 0.00 61.98 62.55 1ib0 s VAL 168 Cb -0.13 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.60 1ib0 s VAL 168 CO 0.02 0.40 0.14 0.00 0.00 0.00 0.00 175.10 175.66 1ib0 s ARG 169 N -1.60 0.44 -0.14 2.72 1.70 -0.48 -4.98 118.95 116.61 1ib0 s ARG 169 Ca 0.29 -0.32 -0.00 0.00 -0.47 0.00 0.00 55.73 55.23 1ib0 s ARG 169 Cb -0.15 0.19 -0.01 0.00 -0.57 0.00 0.00 34.95 34.41 1ib0 s ARG 169 CO 0.16 -0.10 -0.13 0.99 -1.08 0.00 0.00 175.30 175.13 1ib0 s THR 170 N -1.19 2.93 0.42 4.99 2.01 -1.26 -0.17 115.64 123.37 1ib0 s THR 170 Ca -0.13 -0.69 0.05 0.00 0.31 0.00 0.00 61.69 61.23 1ib0 s THR 170 Cb -0.07 -2.24 -0.06 0.00 0.01 0.00 0.00 72.50 70.15 1ib0 s THR 170 CO 0.01 0.51 0.03 0.68 -0.69 0.00 0.00 174.62 175.16 1ib0 s VAL 171 N 0.58 1.53 -0.02 3.82 -7.23 -0.29 -4.78 120.40 114.02 1ib0 s VAL 171 Ca -0.08 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.13 1ib0 s VAL 171 Cb -0.16 -2.71 -0.06 0.00 0.56 0.00 0.00 36.38 34.02 1ib0 s VAL 171 CO 0.03 0.00 0.09 0.29 -0.31 0.00 0.00 175.10 175.20 1ib0 n LYS 172 N -0.98 0.61 -3.93 4.82 5.02 0.90 -4.58 118.16 120.02 1ib0 n LYS 172 Ca -0.08 -0.03 -0.13 0.00 -2.02 0.00 0.00 58.31 56.05 1ib0 n LYS 172 Cb 0.67 -1.05 -0.14 0.00 -0.02 0.00 0.00 35.03 34.48 1ib0 n LYS 172 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1ib0 s SER 173 N -2.33 0.16 -0.22 4.39 0.01 -0.85 -2.02 113.70 112.85 1ib0 s SER 173 Ca -0.01 -0.02 0.01 0.00 1.31 0.00 0.00 55.95 57.24 1ib0 s SER 173 Cb 0.02 -0.03 0.05 0.00 0.21 0.00 0.00 66.02 66.28 1ib0 s SER 173 CO 0.15 0.01 -0.08 -0.69 0.41 0.00 0.00 173.24 173.04 1ib0 s VAL 174 N 0.06 1.62 0.32 3.43 1.01 -0.32 -1.96 120.40 124.56 1ib0 s VAL 174 Ca -0.00 -1.14 -0.20 0.00 0.00 0.00 0.00 61.98 60.64 1ib0 s VAL 174 Cb -0.02 -1.78 -0.09 0.00 0.00 0.00 0.00 36.38 34.49 1ib0 s VAL 174 CO -0.00 0.04 0.82 -0.83 0.00 0.00 0.00 175.10 175.12 1ib0 s GLY 175 N 1.38 2.51 -0.04 4.51 0.00 0.27 -0.69 107.32 115.25 1ib0 s GLY 175 Ca -0.04 0.24 -0.02 0.00 0.00 0.00 0.00 44.72 44.91 1ib0 s GLY 175 CO -0.07 0.55 0.07 1.06 0.00 0.00 0.00 173.10 174.71 1ib0 s MET 176 N -2.58 -0.03 -0.21 2.90 -1.94 0.29 -0.52 119.30 117.22 1ib0 s MET 176 Ca 0.52 0.34 -0.01 0.00 -1.71 0.00 0.00 55.69 54.83 1ib0 s MET 176 Cb -0.13 -0.35 0.01 0.00 2.01 0.00 0.00 34.83 36.37 1ib0 s MET 176 CO 0.19 -0.25 -0.11 0.42 -0.01 0.00 0.00 175.02 175.25 1ib0 s ILE 177 N 1.71 2.73 -0.01 2.53 1.01 -0.14 -0.52 121.20 128.51 1ib0 s ILE 177 Ca -0.02 -0.76 0.05 0.00 0.00 0.00 0.00 60.65 59.92 1ib0 s ILE 177 Cb -0.12 -2.23 -0.01 0.00 0.01 0.00 0.00 42.46 40.11 1ib0 s ILE 177 CO -0.04 0.44 -0.16 0.00 0.00 0.00 0.00 174.94 175.19 1ib0 s ALA 178 N 1.37 1.33 -0.06 9.38 0.00 -0.79 -2.15 121.76 130.84 1ib0 s ALA 178 Ca 0.05 -0.69 0.04 0.00 0.00 0.00 0.00 51.96 51.35 1ib0 s ALA 178 Cb -0.14 -0.34 0.00 0.00 0.00 0.00 0.00 23.12 22.65 1ib0 s ALA 178 CO -0.08 0.33 -0.17 0.20 0.00 0.00 0.00 175.76 176.04 1ib0 s GLY 179 N -0.39 0.98 0.00 0.00 0.00 -0.97 0.85 107.32 107.78 1ib0 s GLY 179 Ca 0.06 -0.67 0.00 0.00 0.00 0.00 0.00 44.72 44.11 1ib0 s GLY 179 CO -0.01 -0.20 0.00 0.61 0.00 0.00 0.00 173.10 173.50 1ib0 n GLY 180 N 3.44 2.97 0.00 0.20 0.00 -0.75 -1.41 105.19 109.64 1ib0 n GLY 180 Ca -0.20 -0.21 0.07 0.00 0.00 0.00 0.00 46.02 45.69 1ib0 n GLY 180 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ib0 n THR 181 N 0.00 0.44 0.16 2.61 -2.24 -1.26 -2.96 114.28 111.03 1ib0 n THR 181 Ca 0.00 0.11 0.02 0.00 -2.27 0.00 0.00 64.05 61.91 1ib0 n THR 181 Cb 0.00 -0.87 0.08 0.00 -2.10 0.00 0.00 70.33 67.44 1ib0 n THR 181 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ib0 n GLY 182 N -0.03 -0.33 0.13 3.38 0.00 -0.50 -2.67 105.19 105.17 1ib0 n GLY 182 Ca 0.08 -0.02 -0.02 0.00 0.00 0.00 0.00 46.02 46.07 1ib0 n GLY 182 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1ib0 h ILE 183 N 0.00 1.46 -0.70 -0.61 -0.00 -1.74 -3.30 117.51 112.62 1ib0 h ILE 183 Ca 0.00 -2.20 -0.03 0.00 -0.00 0.00 0.00 64.86 62.63 1ib0 h ILE 183 Cb 0.02 2.18 -0.03 0.00 -0.00 0.00 0.00 36.82 38.99 1ib0 h ILE 183 CO 0.00 0.63 0.33 0.71 -0.00 0.00 0.00 178.15 179.83 1ib0 h THR 184 N 0.02 1.23 0.00 2.19 1.35 -1.82 -0.14 112.91 115.73 1ib0 h THR 184 Ca -0.01 -0.64 -0.03 0.00 -0.55 0.00 0.00 66.41 65.18 1ib0 h THR 184 Cb 1.15 0.33 -0.00 0.00 -1.73 0.00 0.00 68.15 67.89 1ib0 h THR 184 CO 0.09 0.27 -0.15 -0.65 -0.25 0.00 0.00 175.52 174.82 1ib0 h PRO 185 N 1.00 0.00 0.15 4.72 0.11 -1.81 -1.77 132.00 134.40 1ib0 h PRO 185 Ca 0.24 0.00 -0.30 0.00 0.11 0.00 0.00 66.00 66.05 1ib0 h PRO 185 Cb 0.11 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.22 1ib0 h PRO 185 CO -0.03 0.15 -1.40 0.52 -0.21 0.00 0.00 178.00 177.03 1ib0 h MET 186 N 0.00 0.33 -0.38 1.05 2.86 -1.29 -3.18 114.93 114.31 1ib0 h MET 186 Ca -0.00 -0.56 -0.09 0.00 -2.06 0.00 0.00 59.70 56.99 1ib0 h MET 186 Cb 0.39 0.21 -0.02 0.00 0.06 0.00 0.00 31.60 32.24 1ib0 h MET 186 CO 0.02 1.24 -0.13 1.25 1.06 0.00 0.00 176.91 180.35 1ib0 h LEU 187 N 0.09 0.66 -0.41 1.22 5.85 -0.76 0.12 115.31 122.08 1ib0 h LEU 187 Ca -0.20 -0.19 -0.03 0.00 0.84 0.00 0.00 57.88 58.29 1ib0 h LEU 187 Cb 2.03 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 42.87 1ib0 h LEU 187 CO 0.21 0.81 0.13 -0.61 -0.34 0.00 0.00 178.44 178.64 1ib0 h GLN 188 N 0.61 0.63 -0.07 1.25 4.15 -1.42 -1.02 115.11 119.24 1ib0 h GLN 188 Ca 0.10 -0.13 -0.01 0.00 0.77 0.00 0.00 58.65 59.38 1ib0 h GLN 188 Cb 0.57 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 28.17 1ib0 h GLN 188 CO 0.04 0.62 0.00 0.28 -1.93 0.00 0.00 178.83 177.85 1ib0 h VAL 189 N 0.52 1.24 -0.56 2.39 2.07 -1.45 -2.56 116.25 117.89 1ib0 h VAL 189 Ca 0.13 -0.74 0.08 0.00 0.82 0.00 0.00 66.70 67.00 1ib0 h VAL 189 Cb 0.25 1.60 -0.07 0.00 -1.52 0.00 0.00 31.29 31.55 1ib0 h VAL 189 CO -0.00 0.21 0.19 0.40 0.02 0.00 0.00 177.57 178.38 1ib0 h ILE 190 N -0.15 0.78 -0.34 4.57 2.04 -0.87 -1.30 117.51 122.24 1ib0 h ILE 190 Ca 0.02 -0.13 -0.09 0.00 1.00 0.00 0.00 64.86 65.67 1ib0 h ILE 190 Cb 0.32 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 1ib0 h ILE 190 CO 0.00 0.07 -0.15 0.03 0.00 0.00 0.00 178.15 178.10 1ib0 h ARG 191 N 0.37 0.60 -0.23 2.37 3.08 -1.16 -1.68 114.38 117.72 1ib0 h ARG 191 Ca 0.28 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1ib0 h ARG 191 Cb 0.34 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 1ib0 h ARG 191 CO -0.29 0.73 0.09 0.00 -1.07 0.00 0.00 179.97 179.43 1ib0 h ALA 192 N 1.29 0.30 0.43 0.04 0.00 -0.94 -1.44 119.26 118.94 1ib0 h ALA 192 Ca 0.09 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1ib0 h ALA 192 Cb 0.58 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1ib0 h ALA 192 CO 0.04 -0.10 -0.24 0.28 0.00 0.00 0.00 179.25 179.23 1ib0 h VAL 193 N 0.22 0.51 -0.08 0.00 2.07 -1.10 -3.22 116.25 114.66 1ib0 h VAL 193 Ca 0.08 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.55 1ib0 h VAL 193 Cb 0.18 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 1ib0 h VAL 193 CO -0.01 0.00 -0.18 -0.07 0.02 0.00 0.00 177.57 177.33 1ib0 h LEU 194 N -0.62 0.12 -1.83 2.57 3.38 -1.25 -2.83 115.31 114.84 1ib0 h LEU 194 Ca -0.05 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1ib0 h LEU 194 Cb 0.50 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.22 1ib0 h LEU 194 CO 0.07 0.31 -0.08 0.11 0.09 0.00 0.00 178.44 178.94 1ib0 h LYS 195 N 0.12 0.00 -4.89 1.13 1.57 -1.27 -3.38 116.57 109.85 1ib0 h LYS 195 Ca 0.02 0.00 -0.69 0.00 -1.87 0.00 0.00 60.65 58.12 1ib0 h LYS 195 Cb 0.40 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 32.52 1ib0 h LYS 195 CO 0.03 0.08 0.17 0.34 -0.57 0.00 0.00 179.45 179.49 1ib0 s ASP 196 N -5.83 6.20 0.56 0.86 -1.08 -1.07 -4.90 116.67 111.40 1ib0 s ASP 196 Ca -0.01 -1.22 0.35 0.00 -0.52 0.00 0.00 52.55 51.15 1ib0 s ASP 196 Cb 0.11 -2.32 1.91 0.00 -1.46 0.00 0.00 42.92 41.16 1ib0 s ASP 196 CO 0.55 -1.11 2.07 1.55 0.52 0.00 0.00 175.17 178.75 1ib0 h PRO 197 N 9.20 0.00 -0.23 4.34 0.13 -1.84 0.50 132.00 144.09 1ib0 h PRO 197 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1ib0 h PRO 197 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1ib0 h PRO 197 CO 1.08 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.94 1ib0 n ASN 198 N -2.78 3.18 -4.58 1.44 3.02 -1.26 -4.85 115.26 109.43 1ib0 n ASN 198 Ca -0.02 -1.97 -0.42 0.00 -0.03 0.00 0.00 54.58 52.14 1ib0 n ASN 198 Cb 0.12 -0.14 -0.06 0.00 -0.61 0.00 0.00 39.78 39.08 1ib0 n ASN 198 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1ib0 s ASP 199 N -1.70 6.45 0.00 6.41 -1.08 0.17 -4.93 116.67 121.98 1ib0 s ASP 199 Ca 0.34 0.23 0.17 0.00 -0.52 0.00 0.00 52.55 52.77 1ib0 s ASP 199 Cb 0.22 -2.33 0.48 0.00 -1.46 0.00 0.00 42.92 39.83 1ib0 s ASP 199 CO 0.31 -0.58 1.39 1.41 0.52 0.00 0.00 175.17 178.22 1ib0 n HIS 200 N 6.03 0.53 -1.96 -5.34 8.25 -1.26 -4.92 115.22 116.56 1ib0 n HIS 200 Ca -0.01 -0.26 -0.41 0.00 -0.26 0.00 0.00 57.72 56.78 1ib0 n HIS 200 Cb 0.49 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.58 1ib0 n HIS 200 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1ib0 s THR 201 N -1.47 2.51 -0.20 1.59 2.01 -1.26 -5.00 115.64 113.82 1ib0 s THR 201 Ca 0.32 0.43 -0.06 0.00 0.31 0.00 0.00 61.69 62.69 1ib0 s THR 201 Cb 0.17 -3.28 -0.03 0.00 0.01 0.00 0.00 72.50 69.37 1ib0 s THR 201 CO 0.23 0.07 0.04 -0.69 -0.69 0.00 0.00 174.62 173.58 1ib0 s VAL 202 N -0.07 4.37 -0.16 3.82 1.01 -0.85 -4.81 120.40 123.71 1ib0 s VAL 202 Ca 0.60 -0.17 -0.07 0.00 0.00 0.00 0.00 61.98 62.33 1ib0 s VAL 202 Cb -0.43 -2.98 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 1ib0 s VAL 202 CO 0.45 0.43 0.09 0.00 0.00 0.00 0.00 175.10 176.07 1ib0 s TYR 204 N -0.09 2.88 -0.12 0.00 1.51 0.13 -0.34 117.35 121.33 1ib0 s TYR 204 Ca 0.08 -1.67 -0.02 0.00 -1.01 0.00 0.00 57.07 54.46 1ib0 s TYR 204 Cb -0.12 -1.95 -0.03 0.00 -0.11 0.00 0.00 41.96 39.75 1ib0 s TYR 204 CO 0.01 -0.79 -0.06 -1.17 -1.11 0.00 0.00 175.55 172.43 1ib0 s LEU 205 N 1.29 3.19 -0.28 -1.29 2.96 0.39 0.10 118.68 125.03 1ib0 s LEU 205 Ca 0.03 -0.09 0.02 0.00 -0.22 0.00 0.00 54.13 53.87 1ib0 s LEU 205 Cb -0.14 -1.73 0.08 0.00 0.50 0.00 0.00 46.19 44.89 1ib0 s LEU 205 CO -0.10 0.25 -0.03 -0.22 -1.32 0.00 0.00 176.35 174.93 1ib0 s LEU 206 N -0.13 3.55 -0.27 -0.68 2.96 0.32 -1.19 118.68 123.23 1ib0 s LEU 206 Ca 0.02 -1.60 -0.08 0.00 -0.22 0.00 0.00 54.13 52.25 1ib0 s LEU 206 Cb -0.13 -1.43 -0.02 0.00 0.50 0.00 0.00 46.19 45.11 1ib0 s LEU 206 CO 0.03 -0.28 0.10 0.12 -1.32 0.00 0.00 176.35 175.00 1ib0 s PHE 207 N 1.15 3.12 -0.11 5.38 5.36 0.37 -1.89 117.98 131.36 1ib0 s PHE 207 Ca -0.01 -0.53 -0.01 0.00 -0.96 0.00 0.00 56.93 55.42 1ib0 s PHE 207 Cb -0.19 -2.28 -0.02 0.00 -0.34 0.00 0.00 43.02 40.19 1ib0 s PHE 207 CO -0.08 -0.41 -0.08 0.00 -1.46 0.00 0.00 175.22 173.19 1ib0 s ALA 208 N 1.60 2.87 0.15 11.12 0.00 0.25 -1.63 121.76 136.11 1ib0 s ALA 208 Ca 0.05 -0.87 -0.06 0.00 0.00 0.00 0.00 51.96 51.08 1ib0 s ALA 208 Cb -0.16 -1.32 -0.02 0.00 0.00 0.00 0.00 23.12 21.62 1ib0 s ALA 208 CO 0.04 0.36 0.20 -0.80 0.00 0.00 0.00 175.76 175.57 1ib0 s ASN 209 N -0.08 0.13 0.12 0.00 0.01 -0.49 -1.81 114.94 112.83 1ib0 s ASN 209 Ca 0.00 -0.98 -0.17 0.00 -0.71 0.00 0.00 52.86 51.00 1ib0 s ASN 209 Cb -0.13 0.39 -0.03 0.00 0.41 0.00 0.00 41.25 41.88 1ib0 s ASN 209 CO 0.03 -0.83 1.69 1.56 -1.51 0.00 0.00 177.10 178.03 1ib0 h GLN 210 N 2.66 0.48 -3.60 -0.60 4.20 -1.88 -0.09 115.11 116.27 1ib0 h GLN 210 Ca -0.33 -0.07 -0.05 0.00 0.06 0.00 0.00 58.65 58.26 1ib0 h GLN 210 Cb 1.22 -0.08 -0.09 0.00 0.30 0.00 0.00 27.48 28.82 1ib0 h GLN 210 CO 0.52 0.45 -0.10 -1.54 -0.67 0.00 0.00 178.83 177.49 1ib0 s SER 211 N -5.71 -0.11 0.31 1.46 1.04 -1.26 -1.34 113.70 108.09 1ib0 s SER 211 Ca -0.13 -0.85 0.03 0.00 0.48 0.00 0.00 55.95 55.47 1ib0 s SER 211 Cb 0.09 0.58 0.60 0.00 0.10 0.00 0.00 66.02 67.39 1ib0 s SER 211 CO 0.73 -1.12 1.89 -0.08 0.98 0.00 0.00 173.24 175.64 1ib0 h GLU 212 N 2.26 0.92 0.00 4.02 4.81 -1.90 -0.91 114.58 123.77 1ib0 h GLU 212 Ca -0.27 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 58.90 1ib0 h GLU 212 Cb 1.25 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 30.42 1ib0 h GLU 212 CO 0.36 0.61 -0.05 1.57 -0.73 0.00 0.00 179.01 180.76 1ib0 h LYS 213 N 0.94 0.00 -0.14 1.92 2.10 -1.97 -2.31 116.57 117.11 1ib0 h LYS 213 Ca 0.43 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.08 1ib0 h LYS 213 Cb 0.38 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.71 1ib0 h LYS 213 CO -0.19 0.05 0.00 -0.25 -2.00 0.00 0.00 179.45 177.07 1ib0 n ASP 214 N -3.32 1.39 -4.56 7.07 10.43 -0.35 -4.76 116.55 122.45 1ib0 n ASP 214 Ca -0.01 -1.67 -0.39 0.00 2.57 0.00 0.00 54.79 55.29 1ib0 n ASP 214 Cb 0.22 -0.09 -0.03 0.00 1.84 0.00 0.00 41.12 43.05 1ib0 n ASP 214 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1ib0 s ILE 215 N -1.82 3.76 0.21 0.53 1.01 -0.87 -4.85 121.20 119.16 1ib0 s ILE 215 Ca 0.31 -0.34 -0.30 0.00 0.00 0.00 0.00 60.65 60.32 1ib0 s ILE 215 Cb 0.16 -4.78 -0.10 0.00 0.01 0.00 0.00 42.46 37.76 1ib0 s ILE 215 CO 0.25 -1.69 1.43 -0.22 0.00 0.00 0.00 174.94 174.71 1ib0 s LEU 216 N 6.26 4.39 -1.57 2.97 2.96 -1.26 -3.29 118.68 129.14 1ib0 s LEU 216 Ca 0.49 2.56 -0.01 0.00 -0.22 0.00 0.00 54.13 56.95 1ib0 s LEU 216 Cb -0.04 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 43.04 1ib0 s LEU 216 CO -0.00 -0.69 0.10 0.18 -1.32 0.00 0.00 176.35 174.62 1ib0 n LEU 217 N 2.92 -1.98 -0.35 -0.68 4.77 -1.26 -4.92 117.00 115.49 1ib0 n LEU 217 Ca 0.09 -0.06 0.01 0.00 -0.03 0.00 0.00 56.01 56.02 1ib0 n LEU 217 Cb 0.41 -2.70 0.15 0.00 -2.33 0.00 0.00 43.42 38.95 1ib0 n LEU 217 CO 0.60 -0.13 1.25 -0.09 -1.33 0.00 0.00 177.39 177.70 1ib0 h ARG 218 N -0.22 1.13 -0.22 3.23 2.43 -1.98 -2.08 114.38 116.66 1ib0 h ARG 218 Ca -0.45 -0.07 0.01 0.00 -0.81 0.00 0.00 59.98 58.66 1ib0 h ARG 218 Cb 1.33 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 30.61 1ib0 h ARG 218 CO 0.52 0.75 0.13 -1.35 -1.51 0.00 0.00 179.97 178.51 1ib0 h PRO 219 N 1.16 0.26 -0.54 0.20 0.11 -1.91 -0.73 132.00 130.56 1ib0 h PRO 219 Ca 0.40 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.47 1ib0 h PRO 219 Cb 0.10 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.12 1ib0 h PRO 219 CO -0.15 0.17 0.23 0.93 -0.21 0.00 0.00 178.00 178.97 1ib0 h GLU 220 N 0.27 0.80 -0.72 1.05 3.07 -1.90 -0.88 114.58 116.26 1ib0 h GLU 220 Ca 0.09 -0.14 -0.06 0.00 -0.50 0.00 0.00 59.36 58.75 1ib0 h GLU 220 Cb -0.01 -0.13 -0.03 0.00 -0.84 0.00 0.00 28.75 27.74 1ib0 h GLU 220 CO -0.04 0.68 0.20 -0.07 -1.40 0.00 0.00 179.01 178.38 1ib0 h LEU 221 N 0.73 1.06 -0.57 1.33 3.38 -1.27 -2.41 115.31 117.56 1ib0 h LEU 221 Ca 0.18 -0.22 -0.15 0.00 0.09 0.00 0.00 57.88 57.78 1ib0 h LEU 221 Cb 0.17 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1ib0 h LEU 221 CO -0.02 1.01 -0.71 -0.33 0.09 0.00 0.00 178.44 178.48 1ib0 h GLU 222 N 1.07 0.02 -0.36 1.13 5.08 -0.89 -1.41 114.58 119.23 1ib0 h GLU 222 Ca 0.23 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.55 1ib0 h GLU 222 Cb 0.34 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 1ib0 h GLU 222 CO -0.00 0.72 0.14 1.49 -1.00 0.00 0.00 179.01 180.36 1ib0 h GLU 223 N 0.01 0.55 -0.46 2.33 4.57 -1.07 -0.97 114.58 119.54 1ib0 h GLU 223 Ca -0.01 -0.10 -0.05 0.00 -1.18 0.00 0.00 59.36 58.01 1ib0 h GLU 223 Cb 1.26 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.74 1ib0 h GLU 223 CO 0.09 0.54 0.06 -0.07 -1.18 0.00 0.00 179.01 178.46 1ib0 h LEU 224 N 0.44 0.68 -1.00 1.64 3.38 -1.17 -1.91 115.31 117.36 1ib0 h LEU 224 Ca 0.12 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 1ib0 h LEU 224 Cb 0.20 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1ib0 h LEU 224 CO -0.01 0.71 -0.10 -0.09 0.09 0.00 0.00 178.44 179.03 1ib0 h ARG 225 N 0.69 0.60 -0.32 1.13 2.43 -0.87 -1.55 114.38 116.49 1ib0 h ARG 225 Ca 0.15 -0.18 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1ib0 h ARG 225 Cb 0.33 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.81 1ib0 h ARG 225 CO 0.01 0.70 0.16 -0.91 -1.51 0.00 0.00 179.97 178.41 1ib0 h ASN 226 N 0.55 0.42 1.37 -3.80 4.21 -0.42 -3.04 115.58 114.88 1ib0 h ASN 226 Ca 0.10 -0.12 -0.01 0.00 1.21 0.00 0.00 56.30 57.48 1ib0 h ASN 226 Cb 0.51 -0.11 -0.00 0.00 -1.12 0.00 0.00 38.32 37.60 1ib0 h ASN 226 CO 0.03 0.42 -0.63 -0.33 -1.29 0.00 0.00 177.43 175.63 1ib0 h GLU 227 N 0.39 0.00 -1.15 0.81 5.08 -1.32 -3.40 114.58 114.98 1ib0 h GLU 227 Ca 0.11 0.00 -0.39 0.00 -1.00 0.00 0.00 59.36 58.09 1ib0 h GLU 227 Cb 0.11 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 28.96 1ib0 h GLU 227 CO -0.01 0.03 -1.18 0.72 -1.00 0.00 0.00 179.01 177.57 1ib0 n HIS 228 N -2.86 1.13 -0.34 4.33 8.25 -0.59 -4.95 115.22 120.19 1ib0 n HIS 228 Ca 0.01 -2.94 0.09 0.00 -0.26 0.00 0.00 57.72 54.63 1ib0 n HIS 228 Cb 0.56 -0.37 0.27 0.00 1.12 0.00 0.00 29.99 31.56 1ib0 n HIS 228 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1ib0 h SER 229 N 2.98 0.73 0.28 0.41 0.87 -1.74 -1.56 113.55 115.53 1ib0 h SER 229 Ca -0.06 0.08 -0.03 0.00 -1.23 0.00 0.00 61.79 60.55 1ib0 h SER 229 Cb 1.14 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 63.05 1ib0 h SER 229 CO 0.52 0.31 -0.14 0.77 -0.53 0.00 0.00 176.83 177.75 1ib0 h SER 230 N 0.77 0.00 -0.23 6.23 4.64 -1.92 -3.01 113.55 120.04 1ib0 h SER 230 Ca 0.52 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.84 1ib0 h SER 230 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 1ib0 h SER 230 CO -0.35 0.14 0.00 0.54 -0.87 0.00 0.00 176.83 176.30 1ib0 n ARG 231 N -3.90 2.16 -3.50 4.77 1.74 -0.70 -4.87 116.66 112.36 1ib0 n ARG 231 Ca -0.02 -1.73 -0.16 0.00 -0.77 0.00 0.00 57.85 55.17 1ib0 n ARG 231 Cb 0.24 -1.23 -0.12 0.00 -1.02 0.00 0.00 32.46 30.33 1ib0 n ARG 231 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 1ib0 s PHE 232 N -0.95 -0.39 -0.13 -1.55 5.36 -0.67 -1.24 117.98 118.41 1ib0 s PHE 232 Ca 0.18 0.44 -0.06 0.00 -0.96 0.00 0.00 56.93 56.54 1ib0 s PHE 232 Cb 0.10 -0.25 -0.04 0.00 -0.34 0.00 0.00 43.02 42.49 1ib0 s PHE 232 CO 0.14 -0.58 0.08 0.15 -1.46 0.00 0.00 175.22 173.54 1ib0 s LYS 233 N 2.38 3.46 -0.05 10.12 -0.14 0.54 -4.57 119.74 131.48 1ib0 s LYS 233 Ca 0.07 -0.27 0.01 0.00 -1.36 0.00 0.00 55.97 54.42 1ib0 s LYS 233 Cb -0.15 -3.08 0.02 0.00 -1.68 0.00 0.00 37.83 32.94 1ib0 s LYS 233 CO -0.12 0.61 -0.06 -1.17 -0.76 0.00 0.00 175.35 173.85 1ib0 s LEU 234 N -0.58 1.40 -0.02 3.17 2.96 -1.26 -0.46 118.68 123.89 1ib0 s LEU 234 Ca 0.11 -0.17 -0.06 0.00 -0.22 0.00 0.00 54.13 53.80 1ib0 s LEU 234 Cb -0.12 -0.53 0.00 0.00 0.50 0.00 0.00 46.19 46.04 1ib0 s LEU 234 CO 0.02 -0.03 0.12 0.86 -1.32 0.00 0.00 176.35 176.00 1ib0 s TRP 235 N 0.85 -0.02 0.24 5.38 -0.11 -0.34 -4.99 118.94 119.95 1ib0 s TRP 235 Ca -0.12 0.04 0.11 0.00 1.22 0.00 0.00 56.10 57.35 1ib0 s TRP 235 Cb -0.15 -0.02 -0.05 0.00 -1.50 0.00 0.00 33.47 31.76 1ib0 s TRP 235 CO 0.01 -0.19 -0.21 0.71 -4.62 0.00 0.00 176.95 172.66 1ib0 s TYR 236 N -0.77 2.19 -0.07 5.86 2.02 -1.26 -0.48 117.35 124.84 1ib0 s TYR 236 Ca -0.09 -0.38 -0.06 0.00 -0.37 0.00 0.00 57.07 56.18 1ib0 s TYR 236 Cb -0.05 -1.01 0.02 0.00 -0.40 0.00 0.00 41.96 40.52 1ib0 s TYR 236 CO 0.01 0.58 0.18 -0.08 -1.57 0.00 0.00 175.55 174.67 1ib0 s THR 237 N -2.25 -0.00 0.06 -0.71 -1.32 -0.65 -1.99 115.64 108.77 1ib0 s THR 237 Ca 0.25 0.00 0.05 0.00 -1.21 0.00 0.00 61.69 60.79 1ib0 s THR 237 Cb -0.06 -0.26 -0.03 0.00 -1.51 0.00 0.00 72.50 70.65 1ib0 s THR 237 CO 0.12 0.00 -0.15 0.68 -2.21 0.00 0.00 174.62 173.06 1ib0 s VAL 238 N 0.11 1.18 0.03 5.08 -7.23 -0.97 -1.39 120.40 117.20 1ib0 s VAL 238 Ca -0.00 -1.19 -0.26 0.00 -1.81 0.00 0.00 61.98 58.71 1ib0 s VAL 238 Cb -0.01 -1.10 -0.17 0.00 0.56 0.00 0.00 36.38 35.66 1ib0 s VAL 238 CO 0.00 -0.10 1.38 0.44 -0.31 0.00 0.00 175.10 176.51 1ib0 h ASP 239 N 4.56 -0.32 -3.67 4.85 3.32 -0.34 -1.03 116.42 123.79 1ib0 h ASP 239 Ca -0.40 -0.15 -0.66 0.00 0.02 0.00 0.00 57.03 55.84 1ib0 h ASP 239 Cb 1.18 0.08 -0.22 0.00 0.22 0.00 0.00 39.33 40.59 1ib0 h ASP 239 CO 0.42 -0.02 -0.58 -1.59 -1.72 0.00 0.00 179.24 175.74 1ib0 s LYS 240 N -5.07 3.48 -0.18 3.56 0.00 -0.45 -4.39 119.74 116.68 1ib0 s LYS 240 Ca -0.15 -0.61 -0.11 0.00 0.00 0.00 0.00 55.97 55.09 1ib0 s LYS 240 Cb 0.03 -3.48 -0.05 0.00 0.00 0.00 0.00 37.83 34.34 1ib0 s LYS 240 CO 0.59 -0.32 0.19 0.00 0.00 0.00 0.00 175.35 175.81 1ib0 s ALA 241 N 1.62 3.66 1.10 0.59 0.00 -1.26 -4.35 121.76 123.12 1ib0 s ALA 241 Ca 0.05 -0.60 -0.15 0.00 0.00 0.00 0.00 51.96 51.27 1ib0 s ALA 241 Cb -0.16 -2.25 0.24 0.00 0.00 0.00 0.00 23.12 20.95 1ib0 s ALA 241 CO 0.05 0.15 1.08 -1.25 0.00 0.00 0.00 175.76 175.79 1ib0 s PRO 242 N 0.34 -0.42 0.22 0.00 0.04 -1.26 -4.94 135.00 128.98 1ib0 s PRO 242 Ca 0.12 0.40 -0.04 0.00 0.04 0.00 0.00 61.00 61.51 1ib0 s PRO 242 Cb -0.12 -1.65 0.21 0.00 0.04 0.00 0.00 34.50 32.99 1ib0 s PRO 242 CO 0.01 -3.28 1.66 -0.44 0.04 0.00 0.00 177.00 174.99 1ib0 h ASP 243 N -2.28 0.81 -3.14 6.66 3.32 -2.07 -3.34 116.42 116.36 1ib0 h ASP 243 Ca -0.54 -0.26 -0.74 0.00 0.02 0.00 0.00 57.03 55.51 1ib0 h ASP 243 Cb 1.33 -0.22 -0.23 0.00 0.22 0.00 0.00 39.33 40.43 1ib0 h ASP 243 CO 0.50 0.96 0.02 0.00 -1.72 0.00 0.00 179.24 179.00 1ib0 s ALA 244 N -4.74 3.65 -0.12 3.45 0.00 -1.26 -4.98 121.76 117.75 1ib0 s ALA 244 Ca -0.10 -2.62 -0.05 0.00 0.00 0.00 0.00 51.96 49.19 1ib0 s ALA 244 Cb 0.13 -3.45 0.06 0.00 0.00 0.00 0.00 23.12 19.86 1ib0 s ALA 244 CO 0.83 -2.24 0.27 -0.46 0.00 0.00 0.00 175.76 174.16 1ib0 s TRP 245 N 1.71 -0.40 -2.62 0.00 -0.11 -1.26 -5.02 118.94 111.25 1ib0 s TRP 245 Ca 0.11 0.91 0.23 0.00 1.22 0.00 0.00 56.10 58.57 1ib0 s TRP 245 Cb -0.22 0.03 0.31 0.00 -1.50 0.00 0.00 33.47 32.08 1ib0 s TRP 245 CO 0.01 -0.30 1.31 -0.25 -4.62 0.00 0.00 176.95 173.10 1ib0 n ASP 246 N 4.73 3.20 0.00 5.86 8.00 -1.26 -4.99 116.55 132.09 1ib0 n ASP 246 Ca -0.17 -1.97 0.00 0.00 0.71 0.00 0.00 54.79 53.36 1ib0 n ASP 246 Cb 0.52 -0.13 0.00 0.00 -0.02 0.00 0.00 41.12 41.48 1ib0 n ASP 246 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1ib0 n TYR 247 N 1.38 0.00 -2.81 1.24 4.02 -1.26 -5.09 117.16 114.65 1ib0 n TYR 247 Ca 0.16 0.00 -0.25 0.00 -0.01 0.00 0.00 57.90 57.80 1ib0 n TYR 247 Cb 0.59 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 39.92 1ib0 n TYR 247 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 1ib0 s SER 248 N 0.37 5.98 -0.04 7.72 0.01 -0.84 -5.03 113.70 121.88 1ib0 s SER 248 Ca 0.00 0.61 0.03 0.00 1.31 0.00 0.00 55.95 57.90 1ib0 s SER 248 Cb 0.00 -1.87 0.00 0.00 0.21 0.00 0.00 66.02 64.36 1ib0 s SER 248 CO 0.00 -0.68 -0.14 -1.58 0.41 0.00 0.00 173.24 171.25 1ib0 s GLN 249 N -4.67 1.48 0.00 12.44 0.74 -1.26 -2.30 119.66 126.08 1ib0 s GLN 249 Ca 0.48 -0.48 0.00 0.00 0.05 0.00 0.00 55.36 55.41 1ib0 s GLN 249 Cb -0.10 -1.30 0.00 0.00 1.10 0.00 0.00 33.01 32.70 1ib0 s GLN 249 CO 0.41 0.18 0.00 0.41 -0.55 0.00 0.00 175.29 175.74 1ib0 n GLY 250 N 3.25 2.11 3.70 2.59 0.00 -0.39 -4.88 105.19 111.57 1ib0 n GLY 250 Ca -0.19 -2.06 -0.33 0.00 0.00 0.00 0.00 46.02 43.45 1ib0 n GLY 250 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ib0 s PHE 251 N -2.17 1.89 0.28 1.61 0.08 -1.26 -4.49 117.98 113.93 1ib0 s PHE 251 Ca 0.00 1.68 -0.30 0.00 0.12 0.00 0.00 56.93 58.43 1ib0 s PHE 251 Cb 0.00 -3.40 -0.13 0.00 -0.57 0.00 0.00 43.02 38.92 1ib0 s PHE 251 CO 0.00 -2.67 1.36 0.28 -0.10 0.00 0.00 175.22 174.09 1ib0 n VAL 252 N -3.41 1.39 -4.16 -0.44 0.31 -1.26 -4.98 118.33 105.78 1ib0 n VAL 252 Ca 0.13 -0.35 -0.11 0.00 -0.01 0.00 0.00 64.34 64.00 1ib0 n VAL 252 Cb 0.51 -1.51 -0.04 0.00 -0.91 0.00 0.00 33.84 31.88 1ib0 n VAL 252 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1ib0 n ASN 253 N 1.60 -0.36 0.11 4.52 0.23 -1.26 -4.73 115.26 115.36 1ib0 n ASN 253 Ca 0.09 -2.21 -0.13 0.00 -0.53 0.00 0.00 54.58 51.81 1ib0 n ASN 253 Cb 0.33 0.91 -0.06 0.00 -2.08 0.00 0.00 39.78 38.89 1ib0 n ASN 253 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1ib0 h GLU 254 N 0.00 -0.36 -0.51 -3.83 4.81 -1.89 -2.31 114.58 110.49 1ib0 h GLU 254 Ca -0.13 0.02 0.09 0.00 -0.13 0.00 0.00 59.36 59.21 1ib0 h GLU 254 Cb 0.66 0.08 -0.07 0.00 0.63 0.00 0.00 28.75 30.05 1ib0 h GLU 254 CO 0.19 -0.24 0.11 1.49 -0.73 0.00 0.00 179.01 179.83 1ib0 h GLU 255 N -0.38 0.24 -0.66 1.92 4.81 -1.97 -1.57 114.58 116.97 1ib0 h GLU 255 Ca 0.02 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1ib0 h GLU 255 Cb 0.39 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.68 1ib0 h GLU 255 CO -0.09 0.16 0.36 0.52 -0.73 0.00 0.00 179.01 179.23 1ib0 h MET 256 N 0.25 0.91 0.15 1.92 2.86 -1.92 0.14 114.93 119.24 1ib0 h MET 256 Ca 0.26 -0.10 -0.01 0.00 -2.06 0.00 0.00 59.70 57.79 1ib0 h MET 256 Cb 0.34 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.82 1ib0 h MET 256 CO -0.33 0.67 -0.07 0.82 1.06 0.00 0.00 176.91 179.06 1ib0 h ILE 257 N 0.92 0.92 -0.43 -1.22 1.08 -0.76 1.00 117.51 119.02 1ib0 h ILE 257 Ca 0.24 -0.27 0.01 0.00 -0.39 0.00 0.00 64.86 64.45 1ib0 h ILE 257 Cb 0.03 1.08 -0.02 0.00 -3.07 0.00 0.00 36.82 34.84 1ib0 h ILE 257 CO -0.04 0.06 0.28 0.03 -0.69 0.00 0.00 178.15 177.79 1ib0 h ARG 258 N -0.32 0.54 0.00 2.37 3.08 -1.06 -1.87 114.38 117.12 1ib0 h ARG 258 Ca -0.02 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 59.94 1ib0 h ARG 258 Cb 0.26 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1ib0 h ARG 258 CO 0.03 0.36 -0.26 -0.44 -1.07 0.00 0.00 179.97 178.60 1ib0 h ASP 259 N 0.56 0.00 0.00 7.04 3.32 -0.88 -3.39 116.42 123.07 1ib0 h ASP 259 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1ib0 h ASP 259 Cb -0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.51 1ib0 h ASP 259 CO -0.05 0.26 0.00 1.41 -1.72 0.00 0.00 179.24 179.14 1ib0 n HIS 260 N -3.18 0.00 -4.32 4.55 8.25 0.34 -5.03 115.22 115.83 1ib0 n HIS 260 Ca 0.03 -0.03 -0.27 0.00 -0.26 0.00 0.00 57.72 57.19 1ib0 n HIS 260 Cb 0.61 -0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.62 1ib0 n HIS 260 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1ib0 s LEU 261 N -0.05 2.80 0.74 2.41 1.43 -0.71 -4.52 118.68 120.78 1ib0 s LEU 261 Ca 0.00 -0.63 -0.15 0.00 -1.03 0.00 0.00 54.13 52.32 1ib0 s LEU 261 Cb 0.00 -1.53 0.05 0.00 0.03 0.00 0.00 46.19 44.73 1ib0 s LEU 261 CO 0.00 0.13 1.21 -2.16 0.23 0.00 0.00 176.35 175.75 1ib0 s PRO 262 N -2.62 2.04 0.61 1.29 0.04 -1.26 -4.76 135.00 130.33 1ib0 s PRO 262 Ca 0.22 1.76 -0.16 0.00 0.04 0.00 0.00 61.00 62.87 1ib0 s PRO 262 Cb -0.09 -1.82 -0.03 0.00 0.04 0.00 0.00 34.50 32.60 1ib0 s PRO 262 CO 0.13 -1.91 1.08 -1.25 0.04 0.00 0.00 177.00 175.09 1ib0 s PRO 263 N -3.95 3.18 0.48 0.56 0.04 -1.26 -4.97 135.00 129.08 1ib0 s PRO 263 Ca 0.74 1.30 -0.23 0.00 0.04 0.00 0.00 61.00 62.85 1ib0 s PRO 263 Cb -0.29 -2.01 -0.08 0.00 0.04 0.00 0.00 34.50 32.16 1ib0 s PRO 263 CO 0.46 -0.93 1.13 -2.30 0.04 0.00 0.00 177.00 175.40 1ib0 n PRO 264 N -2.05 1.48 0.00 0.56 -0.02 -1.26 -4.75 135.00 128.96 1ib0 n PRO 264 Ca 0.09 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 1ib0 n PRO 264 Cb 0.52 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 1ib0 n PRO 264 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ib0 n GLY 265 N 1.03 2.99 0.34 -1.23 0.00 -1.26 -4.94 105.19 102.12 1ib0 n GLY 265 Ca 0.10 -0.89 0.12 0.00 0.00 0.00 0.00 46.02 45.35 1ib0 n GLY 265 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ib0 h GLU 266 N 0.00 0.29 0.00 1.61 4.81 -1.99 0.19 114.58 119.48 1ib0 h GLU 266 Ca 0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1ib0 h GLU 266 Cb 0.00 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.32 1ib0 h GLU 266 CO 0.00 0.19 0.00 0.39 -0.73 0.00 0.00 179.01 178.86 1ib0 n GLU 267 N -4.46 0.42 -5.00 1.92 1.02 -1.26 -4.76 120.64 108.52 1ib0 n GLU 267 Ca 0.08 0.06 -0.32 0.00 -0.02 0.00 0.00 57.16 56.95 1ib0 n GLU 267 Cb 0.36 -1.50 -0.15 0.00 -0.02 0.00 0.00 31.44 30.13 1ib0 n GLU 267 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1ib0 s THR 268 N -2.43 2.66 -0.04 2.62 2.01 0.65 -0.07 115.64 121.04 1ib0 s THR 268 Ca 0.25 -0.84 0.04 0.00 0.31 0.00 0.00 61.69 61.45 1ib0 s THR 268 Cb 0.15 -2.05 0.00 0.00 0.01 0.00 0.00 72.50 70.62 1ib0 s THR 268 CO 0.33 0.56 -0.15 -0.22 -0.69 0.00 0.00 174.62 174.45 1ib0 s LEU 269 N -0.09 1.86 -0.16 4.42 2.96 -0.83 -4.68 118.68 122.17 1ib0 s LEU 269 Ca -0.04 -0.32 -0.05 0.00 -0.22 0.00 0.00 54.13 53.51 1ib0 s LEU 269 Cb -0.14 -0.88 -0.03 0.00 0.50 0.00 0.00 46.19 45.64 1ib0 s LEU 269 CO 0.04 0.12 0.00 -0.63 -1.32 0.00 0.00 176.35 174.56 1ib0 s ILE 270 N 0.15 4.24 -0.02 6.68 -1.09 -0.26 -0.57 121.20 130.33 1ib0 s ILE 270 Ca -0.05 -0.24 0.02 0.00 -2.23 0.00 0.00 60.65 58.15 1ib0 s ILE 270 Cb -0.12 -2.87 -0.03 0.00 -1.58 0.00 0.00 42.46 37.86 1ib0 s ILE 270 CO 0.02 0.49 -0.05 -0.76 -1.23 0.00 0.00 174.94 173.41 1ib0 s LEU 271 N 0.23 3.26 0.01 2.97 1.02 0.32 -1.41 118.68 125.08 1ib0 s LEU 271 Ca -0.00 -0.07 0.00 0.00 0.02 0.00 0.00 54.13 54.08 1ib0 s LEU 271 Cb -0.13 -1.82 -0.01 0.00 0.02 0.00 0.00 46.19 44.24 1ib0 s LEU 271 CO 0.02 0.31 -0.02 -0.04 0.02 0.00 0.00 176.35 176.63 1ib0 s MET 272 N -1.27 0.21 -0.30 1.70 -1.94 -0.12 -0.96 119.30 116.62 1ib0 s MET 272 Ca 0.16 -0.36 -0.11 0.00 -1.71 0.00 0.00 55.69 53.67 1ib0 s MET 272 Cb -0.11 0.01 0.15 0.00 2.01 0.00 0.00 34.83 36.89 1ib0 s MET 272 CO 0.06 -0.01 0.80 0.00 -0.01 0.00 0.00 175.02 175.86 1ib0 n GLY 274 N 5.27 -1.32 3.74 0.00 0.00 -1.26 -2.30 105.19 109.32 1ib0 n GLY 274 Ca -0.09 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.55 1ib0 n GLY 274 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ib0 n PRO 275 N -0.08 2.50 -0.31 1.61 -0.04 -1.26 -4.77 135.00 132.64 1ib0 n PRO 275 Ca 0.00 0.88 0.10 0.00 -0.04 0.00 0.00 63.50 64.44 1ib0 n PRO 275 Cb 0.00 -2.57 0.23 0.00 -0.04 0.00 0.00 33.50 31.12 1ib0 n PRO 275 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 1ib0 h PRO 276 N 3.21 0.05 0.00 0.54 0.11 -2.01 0.41 132.00 134.32 1ib0 h PRO 276 Ca -0.48 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 1ib0 h PRO 276 Cb 1.25 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 1ib0 h PRO 276 CO 0.67 0.03 -0.07 -1.35 -0.21 0.00 0.00 178.00 177.07 1ib0 h PRO 277 N 0.05 0.00 -0.07 1.05 0.11 -1.99 -0.35 132.00 130.80 1ib0 h PRO 277 Ca 0.52 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.56 1ib0 h PRO 277 Cb 1.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1ib0 h PRO 277 CO -0.84 0.07 -0.24 1.98 -0.21 0.00 0.00 178.00 178.76 1ib0 h MET 278 N 0.00 0.28 -0.37 1.05 1.85 -0.53 -2.21 114.93 115.00 1ib0 h MET 278 Ca -0.00 -0.21 -0.10 0.00 -0.61 0.00 0.00 59.70 58.77 1ib0 h MET 278 Cb 0.14 0.04 -0.01 0.00 0.43 0.00 0.00 31.60 32.20 1ib0 h MET 278 CO 0.01 0.84 -0.16 0.82 -0.40 0.00 0.00 176.91 178.02 1ib0 h ILE 279 N -0.22 1.28 -0.14 1.77 1.08 -1.16 -1.21 117.51 118.92 1ib0 h ILE 279 Ca -0.01 -1.28 -0.15 0.00 -0.39 0.00 0.00 64.86 63.03 1ib0 h ILE 279 Cb 0.87 1.33 0.01 0.00 -3.07 0.00 0.00 36.82 35.96 1ib0 h ILE 279 CO 0.05 0.42 -0.50 -0.61 -0.69 0.00 0.00 178.15 176.82 1ib0 h GLN 280 N 0.55 0.58 0.00 2.37 4.15 -1.16 -2.55 115.11 119.05 1ib0 h GLN 280 Ca 0.08 -0.44 -0.36 0.00 0.77 0.00 0.00 58.65 58.71 1ib0 h GLN 280 Cb 0.70 0.08 -0.07 0.00 0.21 0.00 0.00 27.48 28.41 1ib0 h GLN 280 CO 0.05 1.06 -2.34 1.19 -1.93 0.00 0.00 178.83 176.87 1ib0 n PHE 281 N -4.20 0.00 -0.05 3.99 3.72 -0.83 -4.48 117.46 115.61 1ib0 n PHE 281 Ca -0.07 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.30 1ib0 n PHE 281 Cb 0.60 -0.94 -0.15 0.00 -0.94 0.00 0.00 39.48 38.05 1ib0 n PHE 281 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ib0 n ALA 282 N -2.89 1.92 -0.07 4.37 0.00 -0.72 -4.63 120.51 118.49 1ib0 n ALA 282 Ca -0.36 -0.95 -0.06 0.00 0.00 0.00 0.00 53.44 52.07 1ib0 n ALA 282 Cb 1.06 -0.50 -0.02 0.00 0.00 0.00 0.00 19.45 19.99 1ib0 n ALA 282 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ib0 h LEU 284 N -0.84 -1.37 -0.99 0.00 3.38 -1.68 0.37 115.31 114.18 1ib0 h LEU 284 Ca 0.00 0.14 0.12 0.00 0.09 0.00 0.00 57.88 58.23 1ib0 h LEU 284 Cb 0.67 0.49 -0.09 0.00 0.09 0.00 0.00 40.66 41.83 1ib0 h LEU 284 CO 0.00 -0.56 0.62 1.55 0.09 0.00 0.00 178.44 180.13 1ib0 h PRO 285 N -0.79 0.93 -0.08 1.13 0.13 -1.82 0.25 132.00 131.75 1ib0 h PRO 285 Ca -0.01 -0.06 -0.22 0.00 -0.87 0.00 0.00 66.00 64.84 1ib0 h PRO 285 Cb 0.76 -0.21 0.01 0.00 0.13 0.00 0.00 31.00 31.69 1ib0 h PRO 285 CO -0.20 0.62 -0.84 -0.91 -0.23 0.00 0.00 178.00 176.44 1ib0 h ASN 286 N 0.96 0.75 -0.43 1.44 2.35 -1.70 -0.50 115.58 118.46 1ib0 h ASN 286 Ca 0.49 -0.53 -0.07 0.00 -0.55 0.00 0.00 56.30 55.64 1ib0 h ASN 286 Cb 0.51 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.63 1ib0 h ASN 286 CO -0.27 1.31 0.02 -0.07 -1.65 0.00 0.00 177.43 176.76 1ib0 h LEU 287 N 0.40 0.79 -0.08 1.61 3.38 0.46 -0.20 115.31 121.67 1ib0 h LEU 287 Ca -0.06 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 1ib0 h LEU 287 Cb 1.46 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.99 1ib0 h LEU 287 CO 0.16 0.85 0.02 -0.08 0.09 0.00 0.00 178.44 179.48 1ib0 h GLU 288 N 0.77 0.12 -0.72 1.13 4.57 -0.42 0.13 114.58 120.17 1ib0 h GLU 288 Ca 0.15 -0.03 0.07 0.00 -1.18 0.00 0.00 59.36 58.37 1ib0 h GLU 288 Cb 0.44 -0.02 -0.06 0.00 -0.16 0.00 0.00 28.75 28.96 1ib0 h GLU 288 CO 0.02 0.29 0.40 0.00 -1.18 0.00 0.00 179.01 178.54 1ib0 h ARG 289 N -0.07 0.70 0.00 1.92 3.08 -0.69 -1.08 114.38 118.24 1ib0 h ARG 289 Ca 0.03 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1ib0 h ARG 289 Cb 0.22 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.11 1ib0 h ARG 289 CO -0.00 0.46 -0.04 0.28 -1.07 0.00 0.00 179.97 179.61 1ib0 h VAL 290 N 0.72 0.10 0.00 2.04 2.07 -0.88 -3.47 116.25 116.83 1ib0 h VAL 290 Ca 0.33 -0.59 0.00 0.00 0.82 0.00 0.00 66.70 67.26 1ib0 h VAL 290 Cb 0.23 1.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.53 1ib0 h VAL 290 CO -0.20 0.03 0.00 0.61 0.02 0.00 0.00 177.57 178.03 1ib0 n GLY 291 N 0.00 1.25 3.48 2.17 0.00 -0.41 -4.83 105.19 106.85 1ib0 n GLY 291 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1ib0 n GLY 291 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ib0 s HIS 292 N -2.00 3.00 0.72 1.61 3.76 0.36 -4.78 115.29 117.96 1ib0 s HIS 292 Ca 0.00 -0.29 -0.14 0.00 -0.15 0.00 0.00 55.06 54.48 1ib0 s HIS 292 Cb 0.00 -3.60 0.03 0.00 1.11 0.00 0.00 32.58 30.12 1ib0 s HIS 292 CO 0.00 -1.06 1.13 -1.25 -0.85 0.00 0.00 174.74 172.71 1ib0 s PRO 293 N 2.97 2.40 0.46 8.40 0.04 -1.26 -4.09 135.00 143.91 1ib0 s PRO 293 Ca 0.20 1.43 0.12 0.00 0.04 0.00 0.00 61.00 62.80 1ib0 s PRO 293 Cb -0.16 -1.90 1.05 0.00 0.04 0.00 0.00 34.50 33.53 1ib0 s PRO 293 CO 0.15 -1.57 2.08 1.57 0.04 0.00 0.00 177.00 179.28 1ib0 h LYS 294 N -0.44 0.31 0.00 4.56 2.10 -1.96 -0.61 116.57 120.53 1ib0 h LYS 294 Ca -0.46 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 1ib0 h LYS 294 Cb 1.26 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1ib0 h LYS 294 CO 0.52 0.20 0.00 -0.85 -2.00 0.00 0.00 179.45 177.32 1ib0 n GLU 295 N -4.50 0.35 -0.07 0.07 0.00 -1.26 -1.36 120.64 113.88 1ib0 n GLU 295 Ca 0.02 0.06 0.07 0.00 0.00 0.00 0.00 57.16 57.31 1ib0 n GLU 295 Cb 0.12 -1.50 0.10 0.00 0.00 0.00 0.00 31.44 30.16 1ib0 n GLU 295 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1ib0 n ARG 296 N -1.12 1.64 -4.74 3.44 1.74 -0.24 -4.97 116.66 112.42 1ib0 n ARG 296 Ca 0.09 -2.22 -0.30 0.00 -0.77 0.00 0.00 57.85 54.65 1ib0 n ARG 296 Cb 0.07 -1.32 -0.17 0.00 -1.02 0.00 0.00 32.46 30.02 1ib0 n ARG 296 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ib0 s PHE 298 N 0.72 2.06 -0.24 0.00 5.36 -0.50 -4.95 117.98 120.43 1ib0 s PHE 298 Ca -0.11 -0.53 -0.02 0.00 -0.96 0.00 0.00 56.93 55.30 1ib0 s PHE 298 Cb -0.16 -1.35 0.02 0.00 -0.34 0.00 0.00 43.02 41.19 1ib0 s PHE 298 CO 0.02 -0.14 -0.06 0.99 -1.46 0.00 0.00 175.22 174.57 1ib0 s THR 299 N -0.23 2.93 -2.00 0.12 2.01 -1.26 -0.94 115.64 116.27 1ib0 s THR 299 Ca 0.01 -0.91 0.04 0.00 0.31 0.00 0.00 61.69 61.13 1ib0 s THR 299 Cb -0.11 -2.44 0.11 0.00 0.01 0.00 0.00 72.50 70.07 1ib0 s THR 299 CO 0.02 0.26 0.72 0.49 -0.69 0.00 0.00 174.62 175.42