#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ona s ASP 2 N 0.00 6.25 -0.23 0.00 1.01 -1.26 -5.05 116.67 117.39 1ona s ASP 2 Ca 0.00 1.46 -0.07 0.00 0.71 0.00 0.00 52.55 54.65 1ona s ASP 2 Cb 0.00 -2.48 -0.03 0.00 1.01 0.00 0.00 42.92 41.42 1ona s ASP 2 CO 0.00 -0.85 0.06 -0.89 0.21 0.00 0.00 175.17 173.70 1ona s THR 3 N -3.07 4.31 -0.06 -1.27 2.01 -1.26 -5.02 115.64 111.28 1ona s THR 3 Ca 0.56 -0.18 0.03 0.00 0.31 0.00 0.00 61.69 62.41 1ona s THR 3 Cb -0.11 -3.00 0.00 0.00 0.01 0.00 0.00 72.50 69.41 1ona s THR 3 CO 0.50 0.36 -0.16 -0.63 -0.69 0.00 0.00 174.62 174.01 1ona s ILE 4 N 1.39 1.37 -0.13 1.82 -1.09 -1.26 -3.31 121.20 119.99 1ona s ILE 4 Ca 0.05 -0.64 -0.00 0.00 -2.23 0.00 0.00 60.65 57.83 1ona s ILE 4 Cb -0.15 -1.21 0.03 0.00 -1.58 0.00 0.00 42.46 39.55 1ona s ILE 4 CO 0.03 0.40 -0.09 -0.69 -1.23 0.00 0.00 174.94 173.36 1ona s VAL 5 N 0.37 1.21 0.09 2.92 1.01 -0.85 0.43 120.40 125.59 1ona s VAL 5 Ca -0.11 -0.43 -0.07 0.00 0.00 0.00 0.00 61.98 61.36 1ona s VAL 5 Cb -0.14 -1.21 -0.01 0.00 0.00 0.00 0.00 36.38 35.02 1ona s VAL 5 CO 0.04 0.37 0.17 0.00 0.00 0.00 0.00 175.10 175.68 1ona s ALA 6 N 1.63 -0.05 -0.24 5.51 0.00 -0.64 0.26 121.76 128.23 1ona s ALA 6 Ca 0.05 -0.77 0.01 0.00 0.00 0.00 0.00 51.96 51.25 1ona s ALA 6 Cb -0.13 0.52 0.04 0.00 0.00 0.00 0.00 23.12 23.55 1ona s ALA 6 CO -0.09 -0.51 -0.11 0.08 0.00 0.00 0.00 175.76 175.13 1ona s VAL 7 N -3.89 2.42 0.08 0.00 1.01 -0.01 -0.98 120.40 119.02 1ona s VAL 7 Ca 0.08 -1.22 0.02 0.00 0.00 0.00 0.00 61.98 60.86 1ona s VAL 7 Cb 0.05 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 1ona s VAL 7 CO -0.09 0.20 0.13 -1.83 0.00 0.00 0.00 175.10 173.51 1ona s GLU 8 N 1.24 3.07 -0.54 2.72 -1.05 -0.60 -1.63 118.70 121.91 1ona s GLU 8 Ca -0.02 -0.61 0.04 0.00 -0.15 0.00 0.00 54.97 54.23 1ona s GLU 8 Cb -0.17 -2.83 0.14 0.00 -0.44 0.00 0.00 34.13 30.83 1ona s GLU 8 CO -0.07 0.58 0.30 -0.51 0.95 0.00 0.00 175.26 176.50 1ona s LEU 9 N -2.47 4.24 -0.62 1.83 1.02 0.88 -1.32 118.68 122.25 1ona s LEU 9 Ca 0.31 -3.12 -0.24 0.00 0.02 0.00 0.00 54.13 51.10 1ona s LEU 9 Cb -0.12 -1.58 0.05 0.00 0.02 0.00 0.00 46.19 44.56 1ona s LEU 9 CO 0.24 -0.21 0.97 -0.62 0.02 0.00 0.00 176.35 176.75 1ona s ASP 10 N -0.43 6.24 0.43 2.29 -1.08 -0.14 -1.61 116.67 122.38 1ona s ASP 10 Ca 0.18 -0.67 0.24 0.00 -0.52 0.00 0.00 52.55 51.78 1ona s ASP 10 Cb -0.22 -2.43 0.65 0.00 -1.46 0.00 0.00 42.92 39.45 1ona s ASP 10 CO -0.03 -1.37 1.71 0.71 0.52 0.00 0.00 175.17 176.71 1ona h THR 11 N 6.00 0.30 -3.31 1.71 1.35 -1.62 -2.13 112.91 115.20 1ona h THR 11 Ca -0.28 -1.16 -0.66 0.00 -0.55 0.00 0.00 66.41 63.76 1ona h THR 11 Cb 1.07 1.92 -0.36 0.00 -1.73 0.00 0.00 68.15 69.05 1ona h THR 11 CO 1.14 0.15 -0.84 -0.47 -0.25 0.00 0.00 175.52 175.25 1ona s TYR 12 N -3.37 2.86 -0.06 4.73 5.04 -1.22 -4.52 117.35 120.81 1ona s TYR 12 Ca 0.04 -1.81 -0.30 0.00 -2.44 0.00 0.00 57.07 52.55 1ona s TYR 12 Cb 0.08 -1.89 -0.04 0.00 0.35 0.00 0.00 41.96 40.46 1ona s TYR 12 CO 0.65 -0.82 1.30 -1.25 -1.34 0.00 0.00 175.55 174.09 1ona s PRO 13 N 1.25 4.30 -0.84 4.97 0.04 -1.26 -4.96 135.00 138.50 1ona s PRO 13 Ca 0.01 1.79 0.01 0.00 0.04 0.00 0.00 61.00 62.84 1ona s PRO 13 Cb -0.15 -3.62 0.23 0.00 0.04 0.00 0.00 34.50 30.99 1ona s PRO 13 CO -0.10 -0.56 0.80 0.09 0.04 0.00 0.00 177.00 177.27 1ona n ASN 14 N 5.61 4.16 0.15 6.66 4.13 -1.26 -4.89 115.26 129.82 1ona n ASN 14 Ca 0.12 -3.23 0.19 0.00 1.68 0.00 0.00 54.58 53.34 1ona n ASN 14 Cb 0.45 -0.96 0.78 0.00 -1.54 0.00 0.00 39.78 38.51 1ona n ASN 14 CO 0.00 0.00 0.00 0.74 0.28 0.00 0.00 177.26 178.28 1ona h THR 15 N 3.88 0.34 -0.11 3.41 2.02 -1.83 0.30 112.91 120.91 1ona h THR 15 Ca 0.17 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.24 1ona h THR 15 Cb 0.75 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 1ona h THR 15 CO 0.88 0.00 -0.42 -2.24 0.37 0.00 0.00 175.52 174.11 1ona h ASP 16 N 0.00 0.26 -0.76 4.18 2.03 -1.90 -3.06 116.42 117.18 1ona h ASP 16 Ca 0.14 -0.11 -0.42 0.00 -0.73 0.00 0.00 57.03 55.91 1ona h ASP 16 Cb 0.89 -0.07 -0.24 0.00 -0.83 0.00 0.00 39.33 39.08 1ona h ASP 16 CO -0.00 0.66 0.34 2.30 -1.03 0.00 0.00 179.24 181.51 1ona n ILE 17 N -4.01 3.00 -0.48 4.15 -5.35 0.01 -4.92 119.36 111.76 1ona n ILE 17 Ca -0.02 -2.49 0.00 0.00 -0.27 0.00 0.00 62.75 59.97 1ona n ILE 17 Cb 0.49 -0.55 0.00 0.00 -1.74 0.00 0.00 39.64 37.84 1ona n ILE 17 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ona n GLY 18 N -1.09 0.75 3.80 3.28 0.00 -1.15 -4.77 105.19 106.01 1ona n GLY 18 Ca 0.50 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.18 1ona n GLY 18 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ona s ASP 19 N -2.72 6.69 1.01 1.61 1.01 -0.71 -4.93 116.67 118.63 1ona s ASP 19 Ca 0.00 1.84 -0.14 0.00 0.71 0.00 0.00 52.55 54.96 1ona s ASP 19 Cb 0.00 -2.56 0.20 0.00 1.01 0.00 0.00 42.92 41.57 1ona s ASP 19 CO 0.00 -0.53 1.13 -2.16 0.21 0.00 0.00 175.17 173.81 1ona s PRO 20 N -3.07 0.29 0.00 8.23 0.04 -1.26 -3.92 135.00 135.32 1ona s PRO 20 Ca 0.63 0.25 0.00 0.00 0.04 0.00 0.00 61.00 61.92 1ona s PRO 20 Cb -0.14 -1.74 0.00 0.00 0.04 0.00 0.00 34.50 32.66 1ona s PRO 20 CO 0.18 -2.76 1.09 0.43 0.04 0.00 0.00 177.00 175.97 1ona n SER 21 N -4.15 3.11 -3.56 6.66 7.64 -1.26 -4.56 113.62 117.50 1ona n SER 21 Ca 0.08 -1.84 -0.07 0.00 1.01 0.00 0.00 58.87 58.05 1ona n SER 21 Cb 0.59 -0.58 -0.02 0.00 -1.01 0.00 0.00 64.21 63.19 1ona n SER 21 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 1ona s TYR 22 N 0.19 -0.28 0.56 1.43 -0.85 -1.26 -5.00 117.35 112.14 1ona s TYR 22 Ca 0.00 0.12 -0.21 0.00 -0.52 0.00 0.00 57.07 56.47 1ona s TYR 22 Cb 0.00 0.55 -0.05 0.00 0.38 0.00 0.00 41.96 42.84 1ona s TYR 22 CO 0.00 -0.54 1.17 -2.30 -1.52 0.00 0.00 175.55 172.36 1ona n PRO 23 N -0.27 1.33 -3.86 -3.49 -0.02 -1.26 -4.57 135.00 122.86 1ona n PRO 23 Ca -0.07 0.50 -0.08 0.00 -2.02 0.00 0.00 63.50 61.83 1ona n PRO 23 Cb 0.61 -2.36 -0.03 0.00 -0.02 0.00 0.00 33.50 31.71 1ona n PRO 23 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1ona s HIS 24 N -1.37 -0.12 0.12 6.00 -3.43 -0.80 -1.11 115.29 114.58 1ona s HIS 24 Ca 0.73 -0.31 0.10 0.00 -0.80 0.00 0.00 55.06 54.77 1ona s HIS 24 Cb -0.43 0.61 -0.04 0.00 -1.43 0.00 0.00 32.58 31.29 1ona s HIS 24 CO 0.49 -1.17 -0.22 0.96 -2.00 0.00 0.00 174.74 172.80 1ona s ILE 25 N -3.93 2.60 0.27 -5.38 -4.36 -0.18 -0.97 121.20 109.26 1ona s ILE 25 Ca 0.12 -1.58 -0.13 0.00 -0.26 0.00 0.00 60.65 58.80 1ona s ILE 25 Cb -0.05 -2.17 0.00 0.00 1.25 0.00 0.00 42.46 41.49 1ona s ILE 25 CO 0.06 0.11 0.53 -0.83 0.24 0.00 0.00 174.94 175.05 1ona s GLY 26 N -2.05 0.51 -0.25 6.27 0.00 -0.43 -1.07 107.32 110.30 1ona s GLY 26 Ca 0.16 -0.84 0.01 0.00 0.00 0.00 0.00 44.72 44.05 1ona s GLY 26 CO 0.08 -0.57 -0.10 -0.42 0.00 0.00 0.00 173.10 172.09 1ona s ILE 27 N -3.85 2.43 -0.25 0.90 1.01 -0.06 -1.56 121.20 119.82 1ona s ILE 27 Ca 0.21 -1.32 -0.09 0.00 0.00 0.00 0.00 60.65 59.45 1ona s ILE 27 Cb -0.02 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 40.11 1ona s ILE 27 CO 0.10 0.13 0.13 -1.81 0.00 0.00 0.00 174.94 173.49 1ona s ASP 28 N 1.21 5.68 -0.44 3.58 1.01 -0.15 0.31 116.67 127.86 1ona s ASP 28 Ca -0.03 -0.05 0.01 0.00 0.71 0.00 0.00 52.55 53.19 1ona s ASP 28 Cb -0.18 -2.03 0.12 0.00 1.01 0.00 0.00 42.92 41.84 1ona s ASP 28 CO -0.06 -0.00 0.19 -0.63 0.21 0.00 0.00 175.17 174.88 1ona s ILE 29 N 1.46 2.80 -1.55 0.77 -1.09 -1.26 -1.62 121.20 120.71 1ona s ILE 29 Ca 0.06 -2.60 -0.03 0.00 -2.23 0.00 0.00 60.65 55.86 1ona s ILE 29 Cb -0.15 -2.96 0.01 0.00 -1.58 0.00 0.00 42.46 37.78 1ona s ILE 29 CO 0.06 -0.71 0.27 0.29 -1.23 0.00 0.00 174.94 173.62 1ona n LYS 30 N 3.95 -3.11 -3.64 2.79 5.02 0.17 -4.93 118.16 118.41 1ona n LYS 30 Ca 0.03 0.87 -0.09 0.00 -2.02 0.00 0.00 58.31 57.10 1ona n LYS 30 Cb 0.39 -5.60 -0.07 0.00 -0.02 0.00 0.00 35.03 29.72 1ona n LYS 30 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1ona s SER 31 N -2.35 -0.46 0.17 4.39 0.15 -1.26 -4.96 113.70 109.38 1ona s SER 31 Ca 0.15 0.89 0.24 0.00 0.70 0.00 0.00 55.95 57.93 1ona s SER 31 Cb -0.07 0.90 0.91 0.00 -1.71 0.00 0.00 66.02 66.05 1ona s SER 31 CO 0.18 -0.15 1.73 0.55 1.20 0.00 0.00 173.24 176.75 1ona n VAL 32 N 2.25 0.66 -2.84 4.45 3.14 -1.26 -4.38 118.33 120.34 1ona n VAL 32 Ca -0.13 0.02 -0.43 0.00 -2.96 0.00 0.00 64.34 60.85 1ona n VAL 32 Cb 0.56 -0.85 -0.03 0.00 -1.06 0.00 0.00 33.84 32.45 1ona n VAL 32 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 1ona s ARG 33 N -3.16 3.33 0.07 1.45 0.52 -1.26 -4.98 118.95 114.92 1ona s ARG 33 Ca 0.08 -1.17 -0.36 0.00 -0.52 0.00 0.00 55.73 53.76 1ona s ARG 33 Cb 0.12 -4.58 -0.19 0.00 0.52 0.00 0.00 34.95 30.82 1ona s ARG 33 CO 0.47 -1.85 0.99 0.43 0.02 0.00 0.00 175.30 175.35 1ona n SER 34 N 7.48 0.04 0.22 0.23 7.64 -1.26 -4.80 113.62 123.16 1ona n SER 34 Ca 0.10 1.15 0.09 0.00 1.01 0.00 0.00 58.87 61.22 1ona n SER 34 Cb 0.47 -0.98 0.46 0.00 -1.01 0.00 0.00 64.21 63.15 1ona n SER 34 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1ona h LYS 35 N 2.77 0.00 -2.19 1.43 1.79 -0.48 -3.44 116.57 116.45 1ona h LYS 35 Ca -0.45 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 57.98 1ona h LYS 35 Cb 1.41 0.00 -0.22 0.00 -1.58 0.00 0.00 32.23 31.84 1ona h LYS 35 CO 0.65 0.24 -0.03 0.21 -1.08 0.00 0.00 179.45 179.44 1ona s LYS 36 N -3.70 0.67 0.41 3.15 2.47 -1.23 -5.00 119.74 116.51 1ona s LYS 36 Ca 0.00 1.01 0.03 0.00 -1.56 0.00 0.00 55.97 55.46 1ona s LYS 36 Cb 0.11 0.21 -0.03 0.00 -1.46 0.00 0.00 37.83 36.65 1ona s LYS 36 CO 0.64 -0.13 0.10 0.95 0.16 0.00 0.00 175.35 177.08 1ona s THR 37 N 1.06 0.76 -0.15 3.43 -4.23 -1.26 -0.88 115.64 114.36 1ona s THR 37 Ca -0.06 -2.00 -0.27 0.00 -1.18 0.00 0.00 61.69 58.18 1ona s THR 37 Cb -0.05 -2.40 0.07 0.00 1.34 0.00 0.00 72.50 71.46 1ona s THR 37 CO -0.10 0.00 0.68 0.00 -0.54 0.00 0.00 174.62 174.65 1ona s ALA 38 N -3.18 -1.71 0.43 3.99 0.00 -0.24 -4.95 121.76 116.09 1ona s ALA 38 Ca 0.24 1.60 -0.25 0.00 0.00 0.00 0.00 51.96 53.55 1ona s ALA 38 Cb 0.03 -0.55 -0.08 0.00 0.00 0.00 0.00 23.12 22.53 1ona s ALA 38 CO 0.13 -0.35 1.24 0.21 0.00 0.00 0.00 175.76 176.99 1ona s LYS 39 N -0.44 3.86 -0.07 0.00 2.20 -1.26 -1.01 119.74 123.02 1ona s LYS 39 Ca -0.06 1.98 -0.01 0.00 -0.36 0.00 0.00 55.97 57.53 1ona s LYS 39 Cb -0.03 -2.60 0.03 0.00 -1.51 0.00 0.00 37.83 33.72 1ona s LYS 39 CO 0.05 -0.53 -0.00 -0.46 -0.36 0.00 0.00 175.35 174.06 1ona s TRP 40 N -1.37 0.69 -1.05 4.03 -0.00 -0.26 -4.71 118.94 116.27 1ona s TRP 40 Ca 0.60 -0.18 -0.17 0.00 -0.00 0.00 0.00 56.10 56.35 1ona s TRP 40 Cb -0.34 -0.80 0.15 0.00 -0.00 0.00 0.00 33.47 32.48 1ona s TRP 40 CO 0.42 -0.32 1.26 -0.80 -0.00 0.00 0.00 176.95 177.51 1ona s ASN 41 N 1.88 6.82 0.29 5.86 -0.87 -1.26 -4.30 114.94 123.36 1ona s ASN 41 Ca 0.04 -2.44 -0.29 0.00 -1.57 0.00 0.00 52.86 48.59 1ona s ASN 41 Cb -0.12 -2.40 -0.10 0.00 -0.02 0.00 0.00 41.25 38.60 1ona s ASN 41 CO -0.05 -0.93 1.42 -0.32 -2.57 0.00 0.00 177.10 174.65 1ona s MET 42 N 2.24 4.26 -0.51 -0.60 1.75 -1.26 -4.99 119.30 120.19 1ona s MET 42 Ca 0.37 2.34 -0.04 0.00 -1.25 0.00 0.00 55.69 57.11 1ona s MET 42 Cb -0.04 -3.07 0.13 0.00 2.84 0.00 0.00 34.83 34.69 1ona s MET 42 CO -0.05 -0.38 0.32 -0.65 -0.65 0.00 0.00 175.02 173.60 1ona s GLN 43 N -1.03 2.29 0.08 4.11 -0.21 -1.26 -5.06 119.66 118.57 1ona s GLN 43 Ca 0.56 -2.11 -0.35 0.00 0.02 0.00 0.00 55.36 53.48 1ona s GLN 43 Cb -0.42 -3.69 -0.14 0.00 1.00 0.00 0.00 33.01 29.76 1ona s GLN 43 CO 0.49 -1.13 1.61 -1.71 -2.12 0.00 0.00 175.29 172.43 1ona n ASN 44 N 4.17 2.88 0.00 5.90 5.15 -1.26 -1.48 115.26 130.62 1ona n ASN 44 Ca 0.02 1.07 0.00 0.00 -0.60 0.00 0.00 54.58 55.06 1ona n ASN 44 Cb 0.40 -1.36 0.00 0.00 -0.53 0.00 0.00 39.78 38.29 1ona n ASN 44 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1ona n GLY 45 N 3.50 2.17 3.90 8.20 0.00 0.03 -4.97 105.19 118.02 1ona n GLY 45 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1ona n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ona s LYS 46 N -0.59 3.37 -0.18 1.61 -0.14 -0.55 -4.93 119.74 118.32 1ona s LYS 46 Ca 0.00 -0.44 -0.28 0.00 -1.36 0.00 0.00 55.97 53.89 1ona s LYS 46 Cb 0.00 -3.01 -0.00 0.00 -1.68 0.00 0.00 37.83 33.13 1ona s LYS 46 CO 0.00 0.62 0.95 0.08 -0.76 0.00 0.00 175.35 176.24 1ona s VAL 47 N -1.45 4.78 0.48 3.17 1.01 -1.26 -4.22 120.40 122.91 1ona s VAL 47 Ca 0.32 1.88 0.08 0.00 0.00 0.00 0.00 61.98 64.26 1ona s VAL 47 Cb -0.13 -4.24 0.03 0.00 0.00 0.00 0.00 36.38 32.03 1ona s VAL 47 CO 0.25 -0.06 0.54 -0.83 0.00 0.00 0.00 175.10 174.99 1ona s GLY 48 N 1.18 2.03 -0.01 4.51 0.00 -0.35 -4.60 107.32 110.08 1ona s GLY 48 Ca 0.43 -1.79 0.00 0.00 0.00 0.00 0.00 44.72 43.36 1ona s GLY 48 CO 0.11 -1.69 -0.01 -1.59 0.00 0.00 0.00 173.10 169.92 1ona s THR 49 N -2.55 0.13 -0.05 0.90 2.01 -0.42 -1.57 115.64 114.10 1ona s THR 49 Ca 0.51 -0.02 0.05 0.00 0.31 0.00 0.00 61.69 62.53 1ona s THR 49 Cb -0.05 -0.15 -0.00 0.00 0.01 0.00 0.00 72.50 72.30 1ona s THR 49 CO 0.31 0.06 -0.18 0.00 -0.69 0.00 0.00 174.62 174.12 1ona s ALA 50 N 0.26 1.64 -0.12 7.40 0.00 -0.64 -0.92 121.76 129.38 1ona s ALA 50 Ca -0.02 -0.75 0.03 0.00 0.00 0.00 0.00 51.96 51.22 1ona s ALA 50 Cb -0.04 -0.54 0.01 0.00 0.00 0.00 0.00 23.12 22.55 1ona s ALA 50 CO -0.01 0.30 -0.21 -1.01 0.00 0.00 0.00 175.76 174.83 1ona s HIS 51 N 0.02 2.44 0.03 0.00 3.76 -0.22 -2.58 115.29 118.74 1ona s HIS 51 Ca -0.04 -1.15 0.08 0.00 -0.15 0.00 0.00 55.06 53.81 1ona s HIS 51 Cb -0.12 -1.67 -0.03 0.00 1.11 0.00 0.00 32.58 31.87 1ona s HIS 51 CO 0.03 -0.52 -0.24 0.42 -0.85 0.00 0.00 174.74 173.57 1ona s ILE 52 N 0.72 1.95 -0.08 0.60 1.09 -0.48 -0.48 121.20 124.52 1ona s ILE 52 Ca -0.10 -1.26 -0.14 0.00 -1.10 0.00 0.00 60.65 58.04 1ona s ILE 52 Cb -0.16 -1.67 0.03 0.00 -1.06 0.00 0.00 42.46 39.61 1ona s ILE 52 CO 0.01 0.36 0.36 0.27 -0.10 0.00 0.00 174.94 175.84 1ona s ILE 53 N -0.75 0.02 -0.04 2.92 -4.36 0.28 -1.50 121.20 117.78 1ona s ILE 53 Ca 0.10 -0.20 -0.10 0.00 -0.26 0.00 0.00 60.65 60.19 1ona s ILE 53 Cb -0.09 -0.58 0.02 0.00 1.25 0.00 0.00 42.46 43.05 1ona s ILE 53 CO 0.01 -0.11 0.23 -0.47 0.24 0.00 0.00 174.94 174.84 1ona s TYR 54 N -0.51 -0.15 -0.06 1.37 5.04 -0.78 -0.91 117.35 121.35 1ona s TYR 54 Ca -0.06 0.32 -0.10 0.00 -2.44 0.00 0.00 57.07 54.78 1ona s TYR 54 Cb -0.04 0.05 0.02 0.00 0.35 0.00 0.00 41.96 42.34 1ona s TYR 54 CO 0.02 -0.24 0.25 0.54 -1.34 0.00 0.00 175.55 174.78 1ona s ASN 55 N -0.70 -0.20 0.32 4.32 2.20 -1.26 -2.10 114.94 117.52 1ona s ASN 55 Ca -0.08 0.30 0.25 0.00 -0.94 0.00 0.00 52.86 52.39 1ona s ASN 55 Cb -0.04 0.43 1.12 0.00 -2.00 0.00 0.00 41.25 40.76 1ona s ASN 55 CO 0.02 -0.22 1.76 0.77 -2.94 0.00 0.00 177.10 176.49 1ona h SER 56 N 5.05 0.00 0.05 3.54 4.64 -0.38 0.26 113.55 126.71 1ona h SER 56 Ca -0.28 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1ona h SER 56 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1ona h SER 56 CO 0.37 0.00 -0.02 0.58 -0.87 0.00 0.00 176.83 176.88 1ona h VAL 57 N 0.00 1.29 0.07 0.95 2.07 -1.87 -3.34 116.25 115.42 1ona h VAL 57 Ca 0.00 -1.25 -0.29 0.00 0.82 0.00 0.00 66.70 65.98 1ona h VAL 57 Cb 0.30 2.10 -0.02 0.00 -1.52 0.00 0.00 31.29 32.15 1ona h VAL 57 CO 0.00 0.31 -1.56 0.44 0.02 0.00 0.00 177.57 176.78 1ona h ASP 58 N -0.63 0.22 -5.65 0.57 3.32 -1.96 -3.48 116.42 108.81 1ona h ASP 58 Ca -0.01 -0.34 -0.37 0.00 0.02 0.00 0.00 57.03 56.33 1ona h ASP 58 Cb 0.55 -0.07 0.14 0.00 0.22 0.00 0.00 39.33 40.18 1ona h ASP 58 CO 0.01 1.29 -0.68 0.29 -1.72 0.00 0.00 179.24 178.43 1ona n LYS 59 N -3.32 -7.39 -5.03 3.56 5.02 0.89 -4.88 118.16 107.01 1ona n LYS 59 Ca -0.16 0.81 -0.30 0.00 -2.02 0.00 0.00 58.31 56.65 1ona n LYS 59 Cb 1.03 -5.78 -0.17 0.00 -0.02 0.00 0.00 35.03 30.10 1ona n LYS 59 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1ona s ARG 60 N -6.01 2.52 -0.28 1.97 3.52 -1.26 -0.78 118.95 118.63 1ona s ARG 60 Ca 0.41 -0.74 -0.10 0.00 -0.13 0.00 0.00 55.73 55.17 1ona s ARG 60 Cb -0.18 -1.98 -0.03 0.00 -1.56 0.00 0.00 34.95 31.19 1ona s ARG 60 CO 0.71 0.18 0.15 -1.17 -0.81 0.00 0.00 175.30 174.36 1ona s LEU 61 N 0.31 3.91 0.17 -0.88 2.96 -0.41 -3.98 118.68 120.76 1ona s LEU 61 Ca -0.14 -0.19 0.10 0.00 -0.22 0.00 0.00 54.13 53.67 1ona s LEU 61 Cb -0.16 -2.04 -0.04 0.00 0.50 0.00 0.00 46.19 44.44 1ona s LEU 61 CO 0.06 -0.09 -0.21 -0.44 -1.32 0.00 0.00 176.35 174.35 1ona s SER 62 N 1.69 3.01 0.01 3.68 0.01 -0.09 -0.83 113.70 121.18 1ona s SER 62 Ca 0.06 -0.83 -0.05 0.00 1.31 0.00 0.00 55.95 56.44 1ona s SER 62 Cb -0.16 -0.20 -0.00 0.00 0.21 0.00 0.00 66.02 65.87 1ona s SER 62 CO 0.08 0.05 0.09 0.00 0.41 0.00 0.00 173.24 173.88 1ona s ALA 63 N -1.71 -0.21 -0.05 1.44 0.00 -0.43 -0.55 121.76 120.25 1ona s ALA 63 Ca 0.16 -0.26 -0.02 0.00 0.00 0.00 0.00 51.96 51.84 1ona s ALA 63 Cb -0.07 0.12 0.04 0.00 0.00 0.00 0.00 23.12 23.20 1ona s ALA 63 CO 0.08 -0.20 0.09 0.08 0.00 0.00 0.00 175.76 175.81 1ona s VAL 64 N -1.41 -0.14 -0.11 0.00 1.01 0.37 -2.10 120.40 118.02 1ona s VAL 64 Ca -0.15 0.37 -0.01 0.00 0.00 0.00 0.00 61.98 62.18 1ona s VAL 64 Cb -0.08 -0.18 -0.03 0.00 0.00 0.00 0.00 36.38 36.09 1ona s VAL 64 CO 0.01 0.15 -0.07 -0.69 0.00 0.00 0.00 175.10 174.50 1ona s VAL 65 N 1.99 3.67 0.09 2.92 1.01 -0.20 -1.06 120.40 128.81 1ona s VAL 65 Ca 0.02 -0.46 -0.12 0.00 0.00 0.00 0.00 61.98 61.42 1ona s VAL 65 Cb -0.12 -2.55 0.01 0.00 0.00 0.00 0.00 36.38 33.72 1ona s VAL 65 CO -0.04 0.55 0.27 -0.94 0.00 0.00 0.00 175.10 174.93 1ona s SER 66 N -0.16 -0.03 0.06 3.32 1.04 -0.10 -0.82 113.70 117.02 1ona s SER 66 Ca 0.02 -0.46 0.07 0.00 0.48 0.00 0.00 55.95 56.06 1ona s SER 66 Cb -0.13 0.38 -0.03 0.00 0.10 0.00 0.00 66.02 66.34 1ona s SER 66 CO 0.03 -0.73 -0.19 -0.31 0.98 0.00 0.00 173.24 173.02 1ona s TYR 67 N -3.51 1.61 0.33 5.02 2.02 -1.26 -1.30 117.35 120.26 1ona s TYR 67 Ca 0.02 -0.39 -0.29 0.00 -0.37 0.00 0.00 57.07 56.04 1ona s TYR 67 Cb 0.03 -0.93 -0.12 0.00 -0.40 0.00 0.00 41.96 40.54 1ona s TYR 67 CO -0.09 0.11 1.50 -0.35 -1.57 0.00 0.00 175.55 175.15 1ona n PRO 68 N 1.56 2.56 -1.71 -1.71 -0.04 -1.26 -2.27 135.00 132.12 1ona n PRO 68 Ca -0.19 0.90 -0.14 0.00 -0.04 0.00 0.00 63.50 64.04 1ona n PRO 68 Cb 0.54 -2.63 -0.04 0.00 -0.04 0.00 0.00 33.50 31.32 1ona n PRO 68 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1ona n ASN 69 N 1.31 -4.58 -4.10 3.54 5.03 -1.26 -4.98 115.26 110.22 1ona n ASN 69 Ca 0.05 0.22 -0.09 0.00 0.87 0.00 0.00 54.58 55.64 1ona n ASN 69 Cb 0.37 -3.47 -0.10 0.00 -1.02 0.00 0.00 39.78 35.55 1ona n ASN 69 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ona s ALA 70 N -2.59 0.63 0.75 5.41 0.00 -0.96 -5.14 121.76 119.85 1ona s ALA 70 Ca 0.00 -1.15 -0.12 0.00 0.00 0.00 0.00 51.96 50.69 1ona s ALA 70 Cb 0.00 0.20 0.04 0.00 0.00 0.00 0.00 23.12 23.36 1ona s ALA 70 CO 0.00 -0.27 1.10 -0.51 0.00 0.00 0.00 175.76 176.08 1ona s ASP 71 N -2.68 4.59 0.28 0.00 1.11 -1.26 -4.55 116.67 114.16 1ona s ASP 71 Ca 0.05 1.90 0.07 0.00 0.18 0.00 0.00 52.55 54.74 1ona s ASP 71 Cb 0.03 -2.53 -0.03 0.00 1.07 0.00 0.00 42.92 41.46 1ona s ASP 71 CO -0.06 -1.98 0.25 -0.94 1.18 0.00 0.00 175.17 173.62 1ona s SER 72 N -3.12 5.52 -0.05 0.27 1.04 -1.26 -4.51 113.70 111.59 1ona s SER 72 Ca 0.63 -0.31 0.01 0.00 0.48 0.00 0.00 55.95 56.76 1ona s SER 72 Cb -0.18 -1.29 -0.03 0.00 0.10 0.00 0.00 66.02 64.62 1ona s SER 72 CO 0.52 -0.16 -0.04 0.00 0.98 0.00 0.00 173.24 174.54 1ona s ALA 73 N -2.18 3.10 -0.01 5.32 0.00 0.00 -4.96 121.76 123.03 1ona s ALA 73 Ca 0.36 -0.91 0.01 0.00 0.00 0.00 0.00 51.96 51.42 1ona s ALA 73 Cb -0.07 -1.28 0.00 0.00 0.00 0.00 0.00 23.12 21.77 1ona s ALA 73 CO 0.26 0.60 -0.04 0.99 0.00 0.00 0.00 175.76 177.57 1ona s THR 74 N -0.91 0.31 -0.02 0.00 2.01 -1.26 -1.04 115.64 114.73 1ona s THR 74 Ca 0.15 -0.14 -0.02 0.00 0.31 0.00 0.00 61.69 61.99 1ona s THR 74 Cb -0.11 -0.28 0.01 0.00 0.01 0.00 0.00 72.50 72.13 1ona s THR 74 CO 0.04 0.10 0.06 0.54 -0.69 0.00 0.00 174.62 174.67 1ona s VAL 75 N 0.05 -0.01 0.02 3.82 0.11 -0.89 -4.82 120.40 118.67 1ona s VAL 75 Ca -0.00 0.05 0.02 0.00 -2.93 0.00 0.00 61.98 59.12 1ona s VAL 75 Cb -0.03 -0.10 -0.01 0.00 -1.53 0.00 0.00 36.38 34.71 1ona s VAL 75 CO -0.00 0.02 -0.06 -0.44 -3.33 0.00 0.00 175.10 171.29 1ona s SER 76 N 0.30 0.67 -0.12 3.54 0.01 -1.26 -1.31 113.70 115.53 1ona s SER 76 Ca -0.02 -0.34 -0.05 0.00 1.31 0.00 0.00 55.95 56.84 1ona s SER 76 Cb -0.03 -0.00 0.05 0.00 0.21 0.00 0.00 66.02 66.25 1ona s SER 76 CO -0.01 -0.10 0.26 -0.47 0.41 0.00 0.00 173.24 173.33 1ona s TYR 77 N -0.83 -0.37 -0.21 2.43 5.04 -0.01 -4.95 117.35 118.45 1ona s TYR 77 Ca -0.05 0.87 -0.29 0.00 -2.44 0.00 0.00 57.07 55.15 1ona s TYR 77 Cb -0.06 0.05 -0.03 0.00 0.35 0.00 0.00 41.96 42.27 1ona s TYR 77 CO 0.00 -0.27 1.59 -0.51 -1.34 0.00 0.00 175.55 175.03 1ona s ASP 78 N 1.52 6.43 -0.20 4.32 1.01 -1.26 -1.29 116.67 127.19 1ona s ASP 78 Ca -0.07 1.64 -0.14 0.00 0.71 0.00 0.00 52.55 54.69 1ona s ASP 78 Cb -0.11 -2.53 0.06 0.00 1.01 0.00 0.00 42.92 41.35 1ona s ASP 78 CO -0.09 -1.22 0.51 0.54 0.21 0.00 0.00 175.17 175.12 1ona s VAL 79 N 5.04 -0.01 -0.61 -1.27 0.11 0.04 -4.98 120.40 118.72 1ona s VAL 79 Ca 0.70 0.04 -0.18 0.00 -2.93 0.00 0.00 61.98 59.61 1ona s VAL 79 Cb -0.25 -0.73 0.12 0.00 -1.53 0.00 0.00 36.38 33.98 1ona s VAL 79 CO 0.28 0.02 0.68 -0.62 -3.33 0.00 0.00 175.10 172.14 1ona s ASP 80 N 1.03 6.23 0.00 3.54 -1.08 -1.26 -4.30 116.67 120.83 1ona s ASP 80 Ca -0.06 -1.59 0.03 0.00 -0.52 0.00 0.00 52.55 50.42 1ona s ASP 80 Cb -0.06 -2.28 0.15 0.00 -1.46 0.00 0.00 42.92 39.27 1ona s ASP 80 CO -0.09 -1.04 1.10 0.18 0.52 0.00 0.00 175.17 175.84 1ona n LEU 81 N 6.02 0.00 0.18 -1.34 4.77 -1.26 -1.74 117.00 123.63 1ona n LEU 81 Ca -0.08 0.49 0.06 0.00 -0.03 0.00 0.00 56.01 56.45 1ona n LEU 81 Cb 0.42 -0.49 0.25 0.00 -2.33 0.00 0.00 43.42 41.27 1ona n LEU 81 CO 0.56 -0.43 0.64 0.44 -1.33 0.00 0.00 177.39 177.27 1ona h ASP 82 N 0.00 0.00 0.14 -1.43 3.32 -1.92 -1.03 116.42 115.51 1ona h ASP 82 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ona h ASP 82 Cb 0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.61 1ona h ASP 82 CO 0.00 0.36 -0.50 0.59 -1.72 0.00 0.00 179.24 177.97 1ona n ASN 83 N -3.35 1.31 -0.07 6.45 3.02 -0.71 -4.59 115.26 117.33 1ona n ASN 83 Ca 0.01 -1.04 -0.12 0.00 -0.03 0.00 0.00 54.58 53.39 1ona n ASN 83 Cb 0.57 0.43 -0.04 0.00 -0.61 0.00 0.00 39.78 40.13 1ona n ASN 83 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1ona n VAL 84 N -0.69 1.22 -3.90 2.41 0.31 -1.08 -5.06 118.33 111.53 1ona n VAL 84 Ca 0.09 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.21 1ona n VAL 84 Cb 0.39 -1.93 -0.02 0.00 -0.91 0.00 0.00 33.84 31.37 1ona n VAL 84 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1ona s LEU 85 N -7.32 4.28 0.58 7.52 1.43 -0.41 -4.99 118.68 119.76 1ona s LEU 85 Ca -0.22 0.06 -0.09 0.00 -1.03 0.00 0.00 54.13 52.85 1ona s LEU 85 Cb 0.06 -2.87 -0.03 0.00 0.03 0.00 0.00 46.19 43.38 1ona s LEU 85 CO 0.30 -0.11 0.94 -2.16 0.23 0.00 0.00 176.35 175.55 1ona s PRO 86 N -4.01 3.46 0.26 1.29 0.04 -1.26 -4.65 135.00 130.13 1ona s PRO 86 Ca 0.35 0.47 -0.03 0.00 0.04 0.00 0.00 61.00 61.84 1ona s PRO 86 Cb -0.09 -2.19 0.55 0.00 0.04 0.00 0.00 34.50 32.80 1ona s PRO 86 CO 0.29 -0.49 1.67 0.93 0.04 0.00 0.00 177.00 179.44 1ona h GLU 87 N -0.15 0.23 -5.46 4.56 5.08 -1.94 -3.40 114.58 113.50 1ona h GLU 87 Ca -0.45 -0.01 -0.64 0.00 -1.00 0.00 0.00 59.36 57.25 1ona h GLU 87 Cb 1.21 -0.05 -0.19 0.00 0.50 0.00 0.00 28.75 30.21 1ona h GLU 87 CO 0.62 0.15 -0.65 -1.58 -1.00 0.00 0.00 179.01 176.55 1ona s TRP 88 N -6.02 3.07 0.33 4.33 0.52 -1.26 0.47 118.94 120.39 1ona s TRP 88 Ca -0.13 -0.14 0.07 0.00 0.02 0.00 0.00 56.10 55.92 1ona s TRP 88 Cb 0.23 -1.93 -0.03 0.00 -1.15 0.00 0.00 33.47 30.59 1ona s TRP 88 CO 0.76 0.10 0.26 0.14 0.02 0.00 0.00 176.95 178.23 1ona s VAL 89 N 0.09 0.05 0.09 4.03 -7.23 -0.21 -4.16 120.40 113.06 1ona s VAL 89 Ca 0.01 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.25 1ona s VAL 89 Cb -0.13 -2.48 -0.03 0.00 0.56 0.00 0.00 36.38 34.29 1ona s VAL 89 CO 0.02 0.00 -0.19 -0.13 -0.31 0.00 0.00 175.10 174.49 1ona s ARG 90 N -3.50 1.04 0.07 4.82 0.52 -0.49 0.50 118.95 121.92 1ona s ARG 90 Ca 0.39 -1.11 0.10 0.00 -0.52 0.00 0.00 55.73 54.59 1ona s ARG 90 Cb 0.03 -1.24 -0.03 0.00 0.52 0.00 0.00 34.95 34.23 1ona s ARG 90 CO 0.26 0.28 -0.26 0.14 0.02 0.00 0.00 175.30 175.74 1ona s VAL 91 N -1.21 2.13 0.13 3.52 -7.23 -1.26 -1.59 120.40 114.89 1ona s VAL 91 Ca 0.04 -1.50 -0.14 0.00 -1.81 0.00 0.00 61.98 58.57 1ona s VAL 91 Cb -0.10 -1.85 0.05 0.00 0.56 0.00 0.00 36.38 35.04 1ona s VAL 91 CO 0.04 0.25 0.67 0.61 -0.31 0.00 0.00 175.10 176.36 1ona n GLY 92 N 1.48 0.87 3.46 2.32 0.00 -0.67 -0.89 105.19 111.77 1ona n GLY 92 Ca -0.17 -1.08 -0.30 0.00 0.00 0.00 0.00 46.02 44.47 1ona n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ona s LEU 93 N 0.00 2.62 0.07 0.99 1.43 0.14 -0.96 118.68 122.96 1ona s LEU 93 Ca 0.15 -0.50 -0.01 0.00 -1.03 0.00 0.00 54.13 52.73 1ona s LEU 93 Cb -0.02 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.65 1ona s LEU 93 CO 0.04 0.22 0.00 -0.55 0.23 0.00 0.00 176.35 176.29 1ona s SER 94 N -1.76 0.43 -0.09 2.29 0.15 0.09 -0.78 113.70 114.03 1ona s SER 94 Ca 0.16 -1.02 -0.30 0.00 0.70 0.00 0.00 55.95 55.49 1ona s SER 94 Cb -0.10 0.23 0.11 0.00 -1.71 0.00 0.00 66.02 64.54 1ona s SER 94 CO 0.07 -0.64 0.91 0.00 1.20 0.00 0.00 173.24 174.79 1ona s ALA 95 N -3.94 -1.87 0.21 5.45 0.00 -0.74 -1.41 121.76 119.45 1ona s ALA 95 Ca 0.10 1.36 -0.08 0.00 0.00 0.00 0.00 51.96 53.35 1ona s ALA 95 Cb 0.08 -0.25 -0.02 0.00 0.00 0.00 0.00 23.12 22.93 1ona s ALA 95 CO -0.08 -0.44 0.30 -1.54 0.00 0.00 0.00 175.76 174.01 1ona s SER 96 N -1.55 0.03 0.12 0.00 1.04 -1.20 -2.09 113.70 110.06 1ona s SER 96 Ca -0.01 -1.07 0.00 0.00 0.48 0.00 0.00 55.95 55.35 1ona s SER 96 Cb -0.01 0.47 -0.04 0.00 0.10 0.00 0.00 66.02 66.55 1ona s SER 96 CO -0.01 -0.97 0.01 0.42 0.98 0.00 0.00 173.24 173.68 1ona s THR 97 N -4.05 0.34 0.00 2.02 -4.23 -0.32 -0.79 115.64 108.60 1ona s THR 97 Ca 0.26 -1.91 0.00 0.00 -1.18 0.00 0.00 61.69 58.86 1ona s THR 97 Cb 0.03 -1.92 0.00 0.00 1.34 0.00 0.00 72.50 71.95 1ona s THR 97 CO 0.08 -0.62 0.00 0.61 -0.54 0.00 0.00 174.62 174.14 1ona n GLY 98 N -0.08 3.82 0.21 3.99 0.00 -1.26 0.17 105.19 112.04 1ona n GLY 98 Ca -0.08 -0.45 -0.12 0.00 0.00 0.00 0.00 46.02 45.37 1ona n GLY 98 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ona h LEU 99 N 0.00 0.72-10.01 0.99 5.85 -1.96 0.79 115.31 111.69 1ona h LEU 99 Ca 0.00 -0.43 -0.55 0.00 0.84 0.00 0.00 57.88 57.74 1ona h LEU 99 Cb 0.00 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.80 1ona h LEU 99 CO 0.00 0.99 -0.30 -0.31 -0.34 0.00 0.00 178.44 178.49 1ona s TYR 100 N -4.54 3.48 0.33 1.25 2.02 -1.26 -4.86 117.35 113.77 1ona s TYR 100 Ca -0.13 0.49 0.03 0.00 -0.37 0.00 0.00 57.07 57.09 1ona s TYR 100 Cb 0.09 -1.96 -0.04 0.00 -0.40 0.00 0.00 41.96 39.65 1ona s TYR 100 CO 0.82 0.38 0.14 -1.59 -1.57 0.00 0.00 175.55 173.72 1ona s LYS 101 N -3.04 1.67 -0.14 -0.62 -2.85 -1.24 -4.25 119.74 109.27 1ona s LYS 101 Ca 0.40 -1.96 -0.32 0.00 -1.00 0.00 0.00 55.97 53.09 1ona s LYS 101 Cb -0.11 -0.33 0.13 0.00 -2.06 0.00 0.00 37.83 35.45 1ona s LYS 101 CO 0.27 -0.41 1.10 -1.83 0.10 0.00 0.00 175.35 174.58 1ona s GLU 102 N -3.81 0.47 0.30 1.78 -1.05 -1.13 -3.36 118.70 111.90 1ona s GLU 102 Ca 0.33 -0.13 -0.23 0.00 -0.15 0.00 0.00 54.97 54.78 1ona s GLU 102 Cb 0.05 0.22 -0.09 0.00 -0.44 0.00 0.00 34.13 33.86 1ona s GLU 102 CO 0.16 -0.20 0.87 0.95 0.95 0.00 0.00 175.26 177.99 1ona s THR 103 N -2.41 4.35 -0.51 1.83 -4.23 0.45 -4.77 115.64 110.35 1ona s THR 103 Ca 0.07 1.60 0.07 0.00 -1.18 0.00 0.00 61.69 62.25 1ona s THR 103 Cb -0.01 -3.92 0.35 0.00 1.34 0.00 0.00 72.50 70.27 1ona s THR 103 CO -0.05 0.11 0.91 0.59 -0.54 0.00 0.00 174.62 175.64 1ona n ASN 104 N 0.48 3.55 -4.69 3.99 4.13 -1.26 -3.46 115.26 118.00 1ona n ASN 104 Ca 0.01 -3.50 -0.42 0.00 1.68 0.00 0.00 54.58 52.34 1ona n ASN 104 Cb 0.51 -0.57 -0.03 0.00 -1.54 0.00 0.00 39.78 38.16 1ona n ASN 104 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1ona s THR 105 N -4.02 4.70 -0.20 3.41 2.01 -1.15 -2.26 115.64 118.13 1ona s THR 105 Ca 0.46 1.97 -0.07 0.00 0.31 0.00 0.00 61.69 64.36 1ona s THR 105 Cb 0.31 -4.27 -0.03 0.00 0.01 0.00 0.00 72.50 68.52 1ona s THR 105 CO -0.12 0.02 0.05 -0.63 -0.69 0.00 0.00 174.62 173.24 1ona s ILE 106 N 1.96 4.47 -0.10 1.82 -1.09 0.59 -0.12 121.20 128.73 1ona s ILE 106 Ca 0.50 -0.14 0.22 0.00 -2.23 0.00 0.00 60.65 59.00 1ona s ILE 106 Cb -0.20 -3.03 -0.23 0.00 -1.58 0.00 0.00 42.46 37.42 1ona s ILE 106 CO 0.19 0.42 0.63 0.18 -1.23 0.00 0.00 174.94 175.14 1ona n LEU 107 N 4.01 0.29 -3.58 2.97 4.32 -0.20 -1.57 117.00 123.23 1ona n LEU 107 Ca -0.17 0.11 -0.07 0.00 -0.02 0.00 0.00 56.01 55.87 1ona n LEU 107 Cb 0.52 0.02 -0.02 0.00 -1.62 0.00 0.00 43.42 42.32 1ona n LEU 107 CO 0.33 -0.01 0.70 -0.94 -1.22 0.00 0.00 177.39 176.25 1ona s SER 108 N -4.89 -0.30 -0.28 -1.43 1.04 -1.24 -4.30 113.70 102.29 1ona s SER 108 Ca -0.06 -0.13 -0.20 0.00 0.48 0.00 0.00 55.95 56.05 1ona s SER 108 Cb 0.12 0.42 0.11 0.00 0.10 0.00 0.00 66.02 66.77 1ona s SER 108 CO 0.87 -0.71 0.89 0.86 0.98 0.00 0.00 173.24 176.12 1ona s TRP 109 N -3.17 -0.70 0.09 5.02 -0.00 -0.26 -2.29 118.94 117.64 1ona s TRP 109 Ca 0.07 1.50 0.01 0.00 -0.00 0.00 0.00 56.10 57.69 1ona s TRP 109 Cb -0.01 0.41 -0.04 0.00 -0.00 0.00 0.00 33.47 33.83 1ona s TRP 109 CO -0.05 -0.34 -0.06 -1.54 -0.00 0.00 0.00 176.95 174.95 1ona s SER 110 N 0.99 1.01 -0.12 5.86 1.04 0.60 -0.07 113.70 123.00 1ona s SER 110 Ca -0.05 -0.97 -0.20 0.00 0.48 0.00 0.00 55.95 55.21 1ona s SER 110 Cb -0.05 0.11 0.05 0.00 0.10 0.00 0.00 66.02 66.23 1ona s SER 110 CO -0.12 -0.47 0.51 0.12 0.98 0.00 0.00 173.24 174.26 1ona s PHE 111 N -3.51 -0.51 -0.04 5.02 5.36 -0.72 -1.22 117.98 122.36 1ona s PHE 111 Ca 0.09 1.09 -0.03 0.00 -0.96 0.00 0.00 56.93 57.12 1ona s PHE 111 Cb 0.05 0.22 0.02 0.00 -0.34 0.00 0.00 43.02 42.97 1ona s PHE 111 CO -0.05 -0.38 0.11 0.99 -1.46 0.00 0.00 175.22 174.43 1ona s THR 112 N -0.41 -0.02 -0.01 0.12 2.01 -0.79 -1.53 115.64 115.00 1ona s THR 112 Ca -0.06 0.08 0.01 0.00 0.31 0.00 0.00 61.69 62.03 1ona s THR 112 Cb -0.03 -0.17 0.01 0.00 0.01 0.00 0.00 72.50 72.31 1ona s THR 112 CO 0.04 0.03 -0.01 -0.55 -0.69 0.00 0.00 174.62 173.44 1ona s SER 113 N 0.53 0.25 -0.02 3.53 0.15 0.07 -1.64 113.70 116.57 1ona s SER 113 Ca -0.04 -0.03 0.01 0.00 0.70 0.00 0.00 55.95 56.59 1ona s SER 113 Cb -0.06 -0.07 0.02 0.00 -1.71 0.00 0.00 66.02 64.20 1ona s SER 113 CO -0.02 -0.01 -0.02 -0.54 1.20 0.00 0.00 173.24 173.84 1ona s LYS 114 N 0.26 0.44 -0.36 5.44 1.02 0.76 -0.78 119.74 126.52 1ona s LYS 114 Ca -0.02 -0.03 0.03 0.00 0.02 0.00 0.00 55.97 55.97 1ona s LYS 114 Cb -0.04 -0.52 0.10 0.00 -0.52 0.00 0.00 37.83 36.85 1ona s LYS 114 CO -0.01 -0.06 0.08 -1.17 -0.92 0.00 0.00 175.35 173.28 1ona s LEU 115 N 0.66 4.76 -0.08 3.17 2.96 -0.25 -1.09 118.68 128.82 1ona s LEU 115 Ca -0.07 -2.24 0.02 0.00 -0.22 0.00 0.00 54.13 51.62 1ona s LEU 115 Cb -0.10 -1.65 -0.02 0.00 0.50 0.00 0.00 46.19 44.92 1ona s LEU 115 CO -0.01 -0.38 -0.14 -1.59 -1.32 0.00 0.00 176.35 172.92 1ona s LYS 116 N 0.80 2.80 -0.12 1.98 -2.85 0.16 -1.35 119.74 121.16 1ona s LYS 116 Ca 0.11 -0.69 -0.01 0.00 -1.00 0.00 0.00 55.97 54.38 1ona s LYS 116 Cb -0.20 -2.46 0.04 0.00 -2.06 0.00 0.00 37.83 33.14 1ona s LYS 116 CO -0.07 0.48 -0.02 0.99 0.10 0.00 0.00 175.35 176.84 1ona s THR 123 N -0.36 0.66 -0.01 3.79 2.01 -1.26 -1.52 115.64 118.95 1ona s THR 123 Ca 0.04 -0.21 0.06 0.00 0.31 0.00 0.00 61.69 61.89 1ona s THR 123 Cb -0.12 -0.86 -0.03 0.00 0.01 0.00 0.00 72.50 71.50 1ona s THR 123 CO 0.02 0.18 -0.19 0.20 -0.69 0.00 0.00 174.62 174.14 1ona s ASN 124 N 1.84 3.69 0.02 3.53 -0.87 -0.46 -5.13 114.94 117.56 1ona s ASN 124 Ca 0.03 -0.36 -0.10 0.00 -1.57 0.00 0.00 52.86 50.87 1ona s ASN 124 Cb -0.14 -0.62 0.01 0.00 -0.02 0.00 0.00 41.25 40.47 1ona s ASN 124 CO -0.07 0.30 0.19 0.00 -2.57 0.00 0.00 177.10 174.96 1ona s ALA 125 N -0.78 -0.40 -0.02 0.60 0.00 -1.26 -1.09 121.76 118.81 1ona s ALA 125 Ca 0.12 -0.17 0.02 0.00 0.00 0.00 0.00 51.96 51.92 1ona s ALA 125 Cb -0.10 0.21 0.01 0.00 0.00 0.00 0.00 23.12 23.24 1ona s ALA 125 CO 0.02 -0.31 -0.06 -1.17 0.00 0.00 0.00 175.76 174.24 1ona s LEU 126 N -1.83 1.74 -0.13 0.00 2.96 0.04 -4.99 118.68 116.48 1ona s LEU 126 Ca -0.08 -0.12 -0.10 0.00 -0.22 0.00 0.00 54.13 53.60 1ona s LEU 126 Cb -0.03 -0.39 0.04 0.00 0.50 0.00 0.00 46.19 46.31 1ona s LEU 126 CO -0.02 0.03 0.34 -2.28 -1.32 0.00 0.00 176.35 173.10 1ona s HIS 127 N 0.27 -0.41 0.02 5.38 5.65 -1.26 -0.75 115.29 124.18 1ona s HIS 127 Ca -0.03 0.96 -0.05 0.00 0.25 0.00 0.00 55.06 56.19 1ona s HIS 127 Cb -0.07 0.14 -0.01 0.00 -1.18 0.00 0.00 32.58 31.46 1ona s HIS 127 CO -0.00 -0.22 0.08 -0.59 -0.65 0.00 0.00 174.74 173.35 1ona s PHE 128 N 0.64 0.15 -0.04 3.88 -0.12 -0.58 -5.01 117.98 116.90 1ona s PHE 128 Ca -0.04 -0.35 -0.02 0.00 -0.05 0.00 0.00 56.93 56.47 1ona s PHE 128 Cb -0.05 -0.12 0.02 0.00 -0.63 0.00 0.00 43.02 42.25 1ona s PHE 128 CO -0.04 -0.28 0.09 1.41 -0.05 0.00 0.00 175.22 176.35 1ona s MET 129 N -1.73 0.05 -0.38 1.99 1.75 -1.26 -1.75 119.30 117.97 1ona s MET 129 Ca -0.13 0.22 0.03 0.00 -1.25 0.00 0.00 55.69 54.56 1ona s MET 129 Cb -0.07 -0.12 0.11 0.00 2.84 0.00 0.00 34.83 37.60 1ona s MET 129 CO -0.01 -0.11 0.13 -0.06 -0.65 0.00 0.00 175.02 174.32 1ona s PHE 130 N 0.72 2.98 -2.33 4.11 0.08 0.90 -4.89 117.98 119.55 1ona s PHE 130 Ca -0.06 -2.69 0.28 0.00 0.12 0.00 0.00 56.93 54.58 1ona s PHE 130 Cb -0.08 -2.51 1.22 0.00 -0.57 0.00 0.00 43.02 41.08 1ona s PHE 130 CO -0.03 -0.87 1.83 0.09 -0.10 0.00 0.00 175.22 176.14 1ona n ASN 131 N 4.06 1.09 -3.56 1.36 3.02 -1.26 -1.10 115.26 118.88 1ona n ASN 131 Ca 0.03 -1.40 -0.08 0.00 -0.03 0.00 0.00 54.58 53.10 1ona n ASN 131 Cb 0.39 -0.01 -0.03 0.00 -0.61 0.00 0.00 39.78 39.51 1ona n ASN 131 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ona s GLN 132 N -1.97 0.58 -0.05 3.52 -2.07 -1.26 -4.82 119.66 113.58 1ona s GLN 132 Ca 0.39 -0.08 0.06 0.00 -1.82 0.00 0.00 55.36 53.91 1ona s GLN 132 Cb 0.20 0.27 -0.01 0.00 -1.09 0.00 0.00 33.01 32.38 1ona s GLN 132 CO 0.33 -0.23 -0.23 -0.06 -1.32 0.00 0.00 175.29 173.78 1ona s PHE 133 N -2.11 2.26 0.47 9.60 0.08 0.13 -5.03 117.98 123.38 1ona s PHE 133 Ca 0.04 -0.67 0.04 0.00 0.12 0.00 0.00 56.93 56.46 1ona s PHE 133 Cb -0.01 -1.49 0.01 0.00 -0.57 0.00 0.00 43.02 40.97 1ona s PHE 133 CO -0.04 -0.20 0.66 -1.54 -0.10 0.00 0.00 175.22 173.99 1ona s SER 134 N -0.12 5.57 0.23 1.36 1.04 -1.26 -3.79 113.70 116.74 1ona s SER 134 Ca -0.04 -0.10 -0.06 0.00 0.48 0.00 0.00 55.95 56.24 1ona s SER 134 Cb -0.13 -0.97 0.37 0.00 0.10 0.00 0.00 66.02 65.38 1ona s SER 134 CO 0.03 -0.86 1.78 0.07 0.98 0.00 0.00 173.24 175.24 1ona h LYS 135 N 0.40 0.60 -2.94 4.02 -0.00 -1.87 -2.81 116.57 113.96 1ona h LYS 135 Ca -0.43 -0.04 -0.61 0.00 -0.00 0.00 0.00 60.65 59.58 1ona h LYS 135 Cb 1.28 -0.13 -0.40 0.00 -0.00 0.00 0.00 32.23 32.97 1ona h LYS 135 CO 0.51 0.39 -0.73 0.34 -0.00 0.00 0.00 179.45 179.96 1ona s ASP 136 N -5.49 3.60 -1.07 7.07 2.15 -1.26 -4.57 116.67 117.10 1ona s ASP 136 Ca -0.12 -2.97 -0.21 0.00 0.43 0.00 0.00 52.55 49.67 1ona s ASP 136 Cb 0.19 -1.11 0.06 0.00 -0.30 0.00 0.00 42.92 41.76 1ona s ASP 136 CO 0.77 -0.21 1.47 -1.58 -0.17 0.00 0.00 175.17 175.45 1ona s GLN 137 N -0.11 3.67 0.61 4.34 2.00 -1.22 -4.87 119.66 124.09 1ona s GLN 137 Ca 0.21 -1.37 0.41 0.00 -2.00 0.00 0.00 55.36 52.61 1ona s GLN 137 Cb -0.16 -5.35 2.22 0.00 0.80 0.00 0.00 33.01 30.53 1ona s GLN 137 CO -0.06 -2.17 2.26 0.87 -0.50 0.00 0.00 175.29 175.69 1ona h LYS 138 N 9.25 0.00 -0.38 1.67 1.57 -1.95 -1.61 116.57 125.10 1ona h LYS 138 Ca 0.24 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 1ona h LYS 138 Cb 0.98 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.29 1ona h LYS 138 CO 1.40 0.00 0.00 -0.40 -0.57 0.00 0.00 179.45 179.88 1ona n ASP 139 N -2.95 2.40 -4.36 0.86 5.68 -1.26 -4.84 116.55 112.07 1ona n ASP 139 Ca -0.03 -1.93 -0.32 0.00 -0.50 0.00 0.00 54.79 52.01 1ona n ASP 139 Cb 0.07 -0.25 -0.15 0.00 -1.14 0.00 0.00 41.12 39.65 1ona n ASP 139 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1ona s LEU 140 N -1.20 2.48 -0.45 -2.12 1.43 -0.61 -0.58 118.68 117.63 1ona s LEU 140 Ca 0.32 -0.36 -0.14 0.00 -1.03 0.00 0.00 54.13 52.93 1ona s LEU 140 Cb 0.17 -1.51 0.07 0.00 0.03 0.00 0.00 46.19 44.96 1ona s LEU 140 CO 0.24 0.25 0.35 -0.63 0.23 0.00 0.00 176.35 176.79 1ona s ILE 141 N -0.15 4.98 0.06 -0.59 1.01 0.65 -4.87 121.20 122.30 1ona s ILE 141 Ca -0.02 -1.11 -0.21 0.00 0.00 0.00 0.00 60.65 59.31 1ona s ILE 141 Cb -0.14 -3.97 -0.06 0.00 0.01 0.00 0.00 42.46 38.29 1ona s ILE 141 CO 0.04 -0.54 0.61 -0.76 0.00 0.00 0.00 174.94 174.29 1ona s LEU 142 N 1.59 4.50 0.04 2.97 1.43 -1.26 -0.78 118.68 127.18 1ona s LEU 142 Ca 0.04 1.29 0.03 0.00 -1.03 0.00 0.00 54.13 54.46 1ona s LEU 142 Cb -0.24 -2.96 -0.02 0.00 0.03 0.00 0.00 46.19 43.00 1ona s LEU 142 CO 0.06 0.21 -0.10 -1.10 0.23 0.00 0.00 176.35 175.65 1ona s GLN 143 N -0.83 0.65 5.24 1.70 -0.21 0.28 -4.99 119.66 121.50 1ona s GLN 143 Ca 0.31 -0.74 0.00 0.00 0.02 0.00 0.00 55.36 54.95 1ona s GLN 143 Cb -0.20 -0.54 0.00 0.00 1.00 0.00 0.00 33.01 33.28 1ona s GLN 143 CO 0.20 0.12 0.00 0.41 -2.12 0.00 0.00 175.29 173.89 1ona n GLY 144 N 1.66 1.22 0.42 3.09 0.00 -1.26 -0.32 105.19 110.00 1ona n GLY 144 Ca -0.21 -0.68 0.10 0.00 0.00 0.00 0.00 46.02 45.24 1ona n GLY 144 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ona n ASP 145 N 4.07 1.26 -4.73 1.61 8.00 0.11 -4.91 116.55 121.96 1ona n ASP 145 Ca 0.00 -1.63 -0.42 0.00 0.71 0.00 0.00 54.79 53.46 1ona n ASP 145 Cb 0.00 -0.08 -0.03 0.00 -0.02 0.00 0.00 41.12 41.00 1ona n ASP 145 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ona s ALA 146 N -1.85 3.77 0.03 2.24 0.00 -1.05 -4.29 121.76 120.61 1ona s ALA 146 Ca 0.32 1.42 0.01 0.00 0.00 0.00 0.00 51.96 53.71 1ona s ALA 146 Cb 0.17 -3.62 -0.02 0.00 0.00 0.00 0.00 23.12 19.64 1ona s ALA 146 CO 0.26 -0.82 -0.05 0.95 0.00 0.00 0.00 175.76 176.10 1ona s THR 147 N 0.74 0.27 0.41 0.00 -4.23 -0.14 -4.70 115.64 107.99 1ona s THR 147 Ca 0.68 -0.90 0.07 0.00 -1.18 0.00 0.00 61.69 60.36 1ona s THR 147 Cb -0.45 -0.38 -0.06 0.00 1.34 0.00 0.00 72.50 72.95 1ona s THR 147 CO 0.36 -0.41 0.10 0.42 -0.54 0.00 0.00 174.62 174.56 1ona s THR 148 N -1.31 2.18 0.00 3.99 -4.23 -1.26 -1.03 115.64 113.98 1ona s THR 148 Ca -0.12 -1.83 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 1ona s THR 148 Cb -0.09 -2.99 0.00 0.00 1.34 0.00 0.00 72.50 70.75 1ona s THR 148 CO -0.00 -0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.68 1ona n GLY 149 N -1.12 2.64 3.35 3.99 0.00 -1.06 -4.59 105.19 108.39 1ona n GLY 149 Ca -0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 1ona n GLY 149 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ona n THR 150 N -2.00 1.71 -0.96 2.61 -2.24 -1.20 -2.80 114.28 109.41 1ona n THR 150 Ca 0.00 -1.64 0.00 0.00 -2.27 0.00 0.00 64.05 60.14 1ona n THR 150 Cb 0.00 -2.23 0.00 0.00 -2.10 0.00 0.00 70.33 66.00 1ona n THR 150 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1ona n ASP 151 N 10.91 -2.81 0.00 3.42 8.00 -1.26 -2.85 116.55 131.96 1ona n ASP 151 Ca 0.47 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.97 1ona n ASP 151 Cb 0.43 -0.47 0.00 0.00 -0.02 0.00 0.00 41.12 41.06 1ona n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ona n GLY 152 N -2.92 0.84 3.93 0.44 0.00 -1.12 -4.99 105.19 101.37 1ona n GLY 152 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1ona n GLY 152 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ona s ASN 153 N -2.77 5.41 -0.25 1.61 0.01 -1.13 0.22 114.94 118.04 1ona s ASN 153 Ca 0.00 -0.52 -0.04 0.00 -0.71 0.00 0.00 52.86 51.58 1ona s ASN 153 Cb 0.00 -0.76 0.00 0.00 0.41 0.00 0.00 41.25 40.90 1ona s ASN 153 CO 0.00 -0.60 0.00 -0.22 -1.51 0.00 0.00 177.10 174.77 1ona s LEU 154 N -4.18 3.30 -0.37 0.60 2.96 -0.61 -2.84 118.68 117.55 1ona s LEU 154 Ca 0.48 -0.59 -0.11 0.00 -0.22 0.00 0.00 54.13 53.69 1ona s LEU 154 Cb -0.07 -1.78 0.02 0.00 0.50 0.00 0.00 46.19 44.86 1ona s LEU 154 CO 0.30 -0.10 0.21 -1.61 -1.32 0.00 0.00 176.35 173.83 1ona s GLU 155 N 1.46 3.00 0.21 1.98 0.41 -0.20 -0.30 118.70 125.25 1ona s GLU 155 Ca 0.03 -0.97 -0.05 0.00 -0.41 0.00 0.00 54.97 53.58 1ona s GLU 155 Cb -0.16 -3.74 0.16 0.00 -1.78 0.00 0.00 34.13 28.61 1ona s GLU 155 CO -0.01 -0.63 1.61 -0.07 -0.49 0.00 0.00 175.26 175.66 1ona h LEU 156 N 8.45 0.78 -9.24 1.80 3.38 -1.74 -0.34 115.31 118.42 1ona h LEU 156 Ca -0.27 -0.30 -0.59 0.00 0.09 0.00 0.00 57.88 56.80 1ona h LEU 156 Cb 1.12 -0.22 -0.14 0.00 0.09 0.00 0.00 40.66 41.51 1ona h LEU 156 CO 0.67 1.01 -0.73 0.42 0.09 0.00 0.00 178.44 179.89 1ona s THR 157 N -4.53 2.32 0.11 0.22 -4.23 -1.26 -2.52 115.64 105.74 1ona s THR 157 Ca -0.09 -2.33 -0.36 0.00 -1.18 0.00 0.00 61.69 57.73 1ona s THR 157 Cb 0.13 -2.38 -0.16 0.00 1.34 0.00 0.00 72.50 71.43 1ona s THR 157 CO 0.84 -0.36 1.33 0.54 -0.54 0.00 0.00 174.62 176.43 1ona n ARG 158 N -0.64 1.23 -3.88 3.99 5.12 -1.26 -4.80 116.66 116.42 1ona n ARG 158 Ca -0.05 0.44 -0.18 0.00 -1.93 0.00 0.00 57.85 56.14 1ona n ARG 158 Cb 0.61 -2.08 -0.16 0.00 -1.16 0.00 0.00 32.46 29.67 1ona n ARG 158 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1ona s VAL 159 N 0.42 0.15 0.53 1.55 1.01 -1.26 -1.61 120.40 121.19 1ona s VAL 159 Ca 0.82 0.13 -0.07 0.00 0.00 0.00 0.00 61.98 62.86 1ona s VAL 159 Cb -0.92 -0.27 -0.03 0.00 0.00 0.00 0.00 36.38 35.16 1ona s VAL 159 CO 0.47 0.15 0.87 -0.94 0.00 0.00 0.00 175.10 175.65 1ona s SER 160 N 1.19 6.21 0.03 3.32 1.04 0.10 -4.91 113.70 120.69 1ona s SER 160 Ca -0.07 1.06 -0.06 0.00 0.48 0.00 0.00 55.95 57.36 1ona s SER 160 Cb -0.13 -2.28 -0.01 0.00 0.10 0.00 0.00 66.02 63.70 1ona s SER 160 CO -0.02 -0.70 0.76 -1.54 0.98 0.00 0.00 173.24 172.72 1ona n SER 161 N -2.43 -0.20 0.00 7.02 3.41 -1.26 0.75 113.62 120.91 1ona n SER 161 Ca 0.02 0.81 0.00 0.00 -0.26 0.00 0.00 58.87 59.44 1ona n SER 161 Cb 0.55 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 64.22 1ona n SER 161 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1ona n ASN 162 N -3.29 0.00 0.00 4.04 0.23 -1.26 -4.70 115.26 110.28 1ona n ASN 162 Ca 0.00 0.07 0.00 0.00 -0.53 0.00 0.00 54.58 54.12 1ona n ASN 162 Cb 0.05 -0.07 0.00 0.00 -2.08 0.00 0.00 39.78 37.68 1ona n ASN 162 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1ona n GLY 163 N -0.87 0.75 3.82 4.83 0.00 0.23 -5.06 105.19 108.88 1ona n GLY 163 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1ona n GLY 163 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ona s SER 164 N -2.48 7.05 0.42 1.61 0.01 -1.23 -4.78 113.70 114.30 1ona s SER 164 Ca 0.00 1.35 -0.20 0.00 1.31 0.00 0.00 55.95 58.41 1ona s SER 164 Cb 0.00 -2.39 -0.11 0.00 0.21 0.00 0.00 66.02 63.73 1ona s SER 164 CO 0.00 0.11 0.92 -2.16 0.41 0.00 0.00 173.24 172.52 1ona s PRO 165 N -1.72 4.19 0.03 12.44 0.04 -1.26 0.02 135.00 148.73 1ona s PRO 165 Ca 0.39 1.05 0.02 0.00 0.04 0.00 0.00 61.00 62.49 1ona s PRO 165 Cb -0.18 -2.21 -0.04 0.00 0.04 0.00 0.00 34.50 32.11 1ona s PRO 165 CO 0.21 -0.01 0.04 -0.65 0.04 0.00 0.00 177.00 176.62 1ona s GLN 166 N -3.19 2.83 0.88 4.56 -0.21 -0.63 -4.85 119.66 119.05 1ona s GLN 166 Ca 0.61 -0.63 -0.14 0.00 0.02 0.00 0.00 55.36 55.22 1ona s GLN 166 Cb -0.09 -2.71 0.13 0.00 1.00 0.00 0.00 33.01 31.34 1ona s GLN 166 CO 0.14 0.60 1.23 0.20 -2.12 0.00 0.00 175.29 175.35 1ona s GLY 167 N -1.89 1.66 -1.63 3.09 0.00 -1.26 -4.27 107.32 103.01 1ona s GLY 167 Ca 0.23 -0.84 -0.15 0.00 0.00 0.00 0.00 44.72 43.96 1ona s GLY 167 CO 0.15 -0.24 0.75 1.44 0.00 0.00 0.00 173.10 175.20 1ona n SER 168 N -3.54 -3.03 -4.63 1.64 7.64 0.27 -4.85 113.62 107.12 1ona n SER 168 Ca 0.11 -0.98 -0.28 0.00 1.01 0.00 0.00 58.87 58.72 1ona n SER 168 Cb 0.60 -2.96 -0.09 0.00 -1.01 0.00 0.00 64.21 60.76 1ona n SER 168 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1ona s SER 169 N -3.47 4.64 -0.16 6.43 0.15 -1.22 -4.92 113.70 115.15 1ona s SER 169 Ca 0.61 -0.37 -0.11 0.00 0.70 0.00 0.00 55.95 56.78 1ona s SER 169 Cb -0.33 -0.96 0.05 0.00 -1.71 0.00 0.00 66.02 63.07 1ona s SER 169 CO 0.91 0.13 0.39 -0.69 1.20 0.00 0.00 173.24 175.18 1ona s VAL 170 N -1.49 -0.02 0.03 4.45 1.01 -1.26 -1.18 120.40 121.94 1ona s VAL 170 Ca 0.25 0.06 -0.23 0.00 0.00 0.00 0.00 61.98 62.05 1ona s VAL 170 Cb -0.10 -0.57 0.05 0.00 0.00 0.00 0.00 36.38 35.76 1ona s VAL 170 CO 0.17 0.02 0.53 -0.83 0.00 0.00 0.00 175.10 174.99 1ona s GLY 171 N 0.87 -0.43 0.12 4.51 0.00 -0.89 0.06 107.32 111.56 1ona s GLY 171 Ca -0.05 0.70 -0.03 0.00 0.00 0.00 0.00 44.72 45.33 1ona s GLY 171 CO -0.07 0.40 0.10 0.50 0.00 0.00 0.00 173.10 174.03 1ona s ARG 172 N -2.15 0.90 -0.09 2.90 0.52 0.56 -1.79 118.95 119.81 1ona s ARG 172 Ca -0.07 -1.29 -0.04 0.00 -0.52 0.00 0.00 55.73 53.82 1ona s ARG 172 Cb -0.01 0.27 0.05 0.00 0.52 0.00 0.00 34.95 35.78 1ona s ARG 172 CO 0.01 -0.26 0.17 0.00 0.02 0.00 0.00 175.30 175.24 1ona s ALA 173 N -3.99 -0.23 0.00 2.13 0.00 0.04 -0.56 121.76 119.16 1ona s ALA 173 Ca 0.17 0.63 0.05 0.00 0.00 0.00 0.00 51.96 52.81 1ona s ALA 173 Cb 0.06 -0.80 -0.03 0.00 0.00 0.00 0.00 23.12 22.35 1ona s ALA 173 CO -0.02 -0.53 -0.14 -0.51 0.00 0.00 0.00 175.76 174.56 1ona s LEU 174 N 2.17 2.76 0.29 0.00 1.02 0.04 -0.68 118.68 124.28 1ona s LEU 174 Ca 0.01 -0.29 -0.29 0.00 0.02 0.00 0.00 54.13 53.58 1ona s LEU 174 Cb -0.12 -1.59 -0.10 0.00 0.02 0.00 0.00 46.19 44.40 1ona s LEU 174 CO -0.06 0.29 1.20 0.12 0.02 0.00 0.00 176.35 177.93 1ona s PHE 175 N -0.87 3.33 0.21 0.29 5.36 -0.07 -0.25 117.98 125.98 1ona s PHE 175 Ca 0.14 1.53 -0.09 0.00 -0.96 0.00 0.00 56.93 57.55 1ona s PHE 175 Cb -0.11 -3.48 0.26 0.00 -0.34 0.00 0.00 43.02 39.36 1ona s PHE 175 CO 0.04 -1.21 1.78 -0.92 -1.46 0.00 0.00 175.22 173.45 1ona h TYR 176 N 3.84 0.57 -3.76 10.12 5.03 -1.18 -3.43 116.97 128.16 1ona h TYR 176 Ca -0.47 0.03 -0.49 0.00 2.58 0.00 0.00 58.73 60.38 1ona h TYR 176 Cb 1.22 -0.16 -0.03 0.00 1.55 0.00 0.00 36.73 39.31 1ona h TYR 176 CO 0.58 0.23 0.21 0.00 -1.32 0.00 0.00 178.16 177.85 1ona s ALA 177 N -6.09 3.28 0.50 1.82 0.00 -1.26 -5.02 121.76 114.99 1ona s ALA 177 Ca -0.13 0.28 -0.20 0.00 0.00 0.00 0.00 51.96 51.91 1ona s ALA 177 Cb 0.17 -2.96 -0.08 0.00 0.00 0.00 0.00 23.12 20.25 1ona s ALA 177 CO 0.75 0.26 1.06 -2.14 0.00 0.00 0.00 175.76 175.69 1ona s PRO 178 N -2.36 3.71 -0.13 0.00 0.02 -1.26 -4.77 135.00 130.20 1ona s PRO 178 Ca 0.50 1.44 0.01 0.00 0.02 0.00 0.00 61.00 62.97 1ona s PRO 178 Cb -0.15 -2.10 -0.01 0.00 0.02 0.00 0.00 34.50 32.27 1ona s PRO 178 CO 0.20 -0.52 -0.16 0.08 -0.33 0.00 0.00 177.00 176.26 1ona s VAL 179 N -1.91 2.70 -0.94 3.83 1.01 0.18 -4.92 120.40 120.35 1ona s VAL 179 Ca 0.68 -0.78 -0.24 0.00 0.00 0.00 0.00 61.98 61.64 1ona s VAL 179 Cb -0.19 -2.12 0.05 0.00 0.00 0.00 0.00 36.38 34.12 1ona s VAL 179 CO 0.22 0.53 1.39 -2.28 0.00 0.00 0.00 175.10 174.96 1ona s HIS 180 N 0.52 2.48 0.23 5.22 2.46 -1.26 -1.04 115.29 123.90 1ona s HIS 180 Ca -0.11 -0.65 0.00 0.00 0.47 0.00 0.00 55.06 54.78 1ona s HIS 180 Cb -0.16 -4.67 0.26 0.00 -0.13 0.00 0.00 32.58 27.88 1ona s HIS 180 CO 0.04 -1.96 1.61 0.97 -2.47 0.00 0.00 174.74 172.93 1ona h ILE 181 N 6.57 1.31 -3.51 0.89 6.09 -0.27 -3.45 117.51 125.13 1ona h ILE 181 Ca 0.07 -1.58 -0.04 0.00 -1.37 0.00 0.00 64.86 61.94 1ona h ILE 181 Cb 1.02 1.60 -0.10 0.00 0.47 0.00 0.00 36.82 39.82 1ona h ILE 181 CO 1.38 0.49 -0.07 -1.66 -3.07 0.00 0.00 178.15 175.23 1ona s TRP 182 N -4.20 0.16 -0.30 2.19 1.48 -1.12 -4.71 118.94 112.44 1ona s TRP 182 Ca -0.07 -0.52 -0.15 0.00 -1.06 0.00 0.00 56.10 54.30 1ona s TRP 182 Cb 0.12 0.27 0.17 0.00 -1.16 0.00 0.00 33.47 32.88 1ona s TRP 182 CO 0.81 -0.95 1.04 -2.00 -4.06 0.00 0.00 176.95 171.79 1ona s GLU 183 N -3.95 0.22 0.43 3.25 2.12 -1.26 -4.64 118.70 114.87 1ona s GLU 183 Ca 0.16 0.50 0.28 0.00 0.36 0.00 0.00 54.97 56.27 1ona s GLU 183 Cb -0.01 0.30 1.37 0.00 0.26 0.00 0.00 34.13 36.04 1ona s GLU 183 CO 0.04 -0.14 1.66 0.77 -0.54 0.00 0.00 175.26 177.04 1ona h SER 184 N 7.62 0.28 0.00 -1.70 0.02 -2.02 -0.43 113.55 117.32 1ona h SER 184 Ca -0.15 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1ona h SER 184 Cb 1.14 0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.78 1ona h SER 184 CO 0.02 -0.12 0.00 -1.54 -1.14 0.00 0.00 176.83 174.05 1ona n SER 185 N -4.66 0.00 -4.85 3.07 3.41 -1.26 -4.78 113.62 104.55 1ona n SER 185 Ca 0.35 -1.12 -0.37 0.00 -0.26 0.00 0.00 58.87 57.46 1ona n SER 185 Cb 1.32 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 65.21 1ona n SER 185 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ona s ALA 186 N -2.00 3.83 -0.04 7.33 0.00 -0.17 -5.00 121.76 125.71 1ona s ALA 186 Ca 0.05 -0.59 -0.20 0.00 0.00 0.00 0.00 51.96 51.22 1ona s ALA 186 Cb 0.02 -2.05 -0.32 0.00 0.00 0.00 0.00 23.12 20.77 1ona s ALA 186 CO 0.04 0.53 0.87 0.28 0.00 0.00 0.00 175.76 177.48 1ona h VAL 187 N 4.05 1.40 -3.19 0.00 2.07 -1.65 -3.45 116.25 115.48 1ona h VAL 187 Ca -0.53 -2.56 -0.45 0.00 0.82 0.00 0.00 66.70 63.99 1ona h VAL 187 Cb 1.22 3.11 -0.40 0.00 -1.52 0.00 0.00 31.29 33.70 1ona h VAL 187 CO 0.61 0.74 -0.75 -0.69 0.02 0.00 0.00 177.57 177.49 1ona s VAL 188 N -2.47 0.13 -0.10 2.57 1.01 -0.58 -4.80 120.40 116.17 1ona s VAL 188 Ca -0.13 -0.09 -0.01 0.00 0.00 0.00 0.00 61.98 61.75 1ona s VAL 188 Cb 0.02 -0.59 -0.03 0.00 0.00 0.00 0.00 36.38 35.78 1ona s VAL 188 CO 0.85 -0.08 -0.06 0.00 0.00 0.00 0.00 175.10 175.82 1ona s ALA 189 N 2.05 2.99 -0.05 5.51 0.00 -1.26 -0.67 121.76 130.34 1ona s ALA 189 Ca 0.02 -0.86 -0.29 0.00 0.00 0.00 0.00 51.96 50.84 1ona s ALA 189 Cb -0.15 -1.36 0.10 0.00 0.00 0.00 0.00 23.12 21.71 1ona s ALA 189 CO -0.07 0.43 0.84 -1.54 0.00 0.00 0.00 175.76 175.42 1ona s SER 190 N -0.34 -0.46 0.19 0.00 1.04 -0.25 0.44 113.70 114.31 1ona s SER 190 Ca 0.05 0.31 -0.10 0.00 0.48 0.00 0.00 55.95 56.69 1ona s SER 190 Cb -0.12 0.42 -0.00 0.00 0.10 0.00 0.00 66.02 66.41 1ona s SER 190 CO 0.02 -0.57 0.35 0.72 0.98 0.00 0.00 173.24 174.74 1ona s PHE 191 N -2.06 0.36 0.02 5.02 -0.12 -0.89 -0.17 117.98 120.14 1ona s PHE 191 Ca -0.02 -0.72 -0.26 0.00 -0.05 0.00 0.00 56.93 55.89 1ona s PHE 191 Cb -0.01 0.03 0.06 0.00 -0.63 0.00 0.00 43.02 42.47 1ona s PHE 191 CO -0.01 -0.80 0.60 -1.83 -0.05 0.00 0.00 175.22 173.13 1ona s GLU 192 N -3.98 1.07 0.05 1.99 -1.05 -0.65 -1.87 118.70 114.26 1ona s GLU 192 Ca 0.18 -0.04 -0.09 0.00 -0.15 0.00 0.00 54.97 54.88 1ona s GLU 192 Cb 0.02 0.50 0.00 0.00 -0.44 0.00 0.00 34.13 34.21 1ona s GLU 192 CO 0.02 -0.37 0.18 0.00 0.95 0.00 0.00 175.26 176.04 1ona s ALA 193 N -2.02 -0.30 -0.15 -0.84 0.00 -0.56 -1.88 121.76 116.01 1ona s ALA 193 Ca -0.07 -0.37 -0.13 0.00 0.00 0.00 0.00 51.96 51.39 1ona s ALA 193 Cb -0.01 0.31 0.04 0.00 0.00 0.00 0.00 23.12 23.46 1ona s ALA 193 CO 0.02 -0.38 0.38 0.99 0.00 0.00 0.00 175.76 176.78 1ona s THR 194 N -2.78 -0.00 -0.00 0.00 2.01 -0.35 -1.38 115.64 113.12 1ona s THR 194 Ca -0.03 0.02 -0.14 0.00 0.31 0.00 0.00 61.69 61.84 1ona s THR 194 Cb -0.00 -0.55 0.02 0.00 0.01 0.00 0.00 72.50 71.99 1ona s THR 194 CO -0.05 0.01 0.30 0.72 -0.69 0.00 0.00 174.62 174.91 1ona s PHE 195 N 0.41 -0.16 0.05 4.92 -0.12 -1.07 -0.29 117.98 121.72 1ona s PHE 195 Ca -0.02 0.20 0.05 0.00 -0.05 0.00 0.00 56.93 57.11 1ona s PHE 195 Cb -0.04 0.09 -0.04 0.00 -0.63 0.00 0.00 43.02 42.41 1ona s PHE 195 CO -0.02 -0.41 -0.10 0.95 -0.05 0.00 0.00 175.22 175.60 1ona s THR 196 N -1.55 3.39 0.19 -4.49 -4.23 -0.97 -1.62 115.64 106.35 1ona s THR 196 Ca -0.12 -1.03 -0.01 0.00 -1.18 0.00 0.00 61.69 59.35 1ona s THR 196 Cb -0.04 -2.50 -0.04 0.00 1.34 0.00 0.00 72.50 71.25 1ona s THR 196 CO 0.03 0.28 0.11 0.72 -0.54 0.00 0.00 174.62 175.22 1ona s PHE 197 N -1.06 1.11 -0.31 3.99 -0.71 -0.61 -1.04 117.98 119.36 1ona s PHE 197 Ca 0.18 -1.32 -0.03 0.00 -1.04 0.00 0.00 56.93 54.72 1ona s PHE 197 Cb -0.11 -0.57 0.11 0.00 -1.21 0.00 0.00 43.02 41.24 1ona s PHE 197 CO 0.09 -0.58 0.15 -1.17 -1.34 0.00 0.00 175.22 172.37 1ona s LEU 198 N -3.14 0.85 -0.39 -1.99 2.96 0.83 -1.22 118.68 116.58 1ona s LEU 198 Ca 0.35 -1.55 -0.16 0.00 -0.22 0.00 0.00 54.13 52.56 1ona s LEU 198 Cb 0.07 -0.43 0.01 0.00 0.50 0.00 0.00 46.19 46.34 1ona s LEU 198 CO 0.09 -0.41 0.36 -0.63 -1.32 0.00 0.00 176.35 174.44 1ona s ILE 199 N 1.79 5.18 -0.05 6.68 1.01 -1.26 -2.92 121.20 131.63 1ona s ILE 199 Ca 0.11 -0.30 0.00 0.00 0.00 0.00 0.00 60.65 60.46 1ona s ILE 199 Cb -0.18 -3.91 0.02 0.00 0.01 0.00 0.00 42.46 38.41 1ona s ILE 199 CO -0.27 -0.25 -0.03 -0.75 0.00 0.00 0.00 174.94 173.64 1ona s LYS 200 N 1.93 0.76 -0.04 2.79 2.20 -1.22 -0.79 119.74 125.37 1ona s LYS 200 Ca 0.09 -0.04 0.02 0.00 -0.36 0.00 0.00 55.97 55.68 1ona s LYS 200 Cb -0.17 -0.89 0.02 0.00 -1.51 0.00 0.00 37.83 35.28 1ona s LYS 200 CO 0.12 -0.16 -0.07 0.45 -0.36 0.00 0.00 175.35 175.33 1ona s SER 201 N 1.26 1.12 0.31 1.43 0.15 -1.26 -0.41 113.70 116.30 1ona s SER 201 Ca -0.06 -0.17 0.09 0.00 0.70 0.00 0.00 55.95 56.51 1ona s SER 201 Cb -0.14 -0.49 0.50 0.00 -1.71 0.00 0.00 66.02 64.18 1ona s SER 201 CO -0.02 -0.01 1.71 1.55 1.20 0.00 0.00 173.24 177.67 1ona h PRO 202 N 6.96 0.14 -7.20 5.44 0.13 -1.98 -3.45 132.00 132.03 1ona h PRO 202 Ca -0.36 -0.07 -0.50 0.00 -0.87 0.00 0.00 66.00 64.20 1ona h PRO 202 Cb 1.16 -0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.34 1ona h PRO 202 CO 0.48 0.56 0.32 0.16 -0.23 0.00 0.00 178.00 179.29 1ona s ASP 203 N -6.89 6.31 0.62 1.44 1.47 -1.26 -4.95 116.67 113.41 1ona s ASP 203 Ca -0.04 1.30 0.42 0.00 1.18 0.00 0.00 52.55 55.41 1ona s ASP 203 Cb 0.13 -2.41 2.27 0.00 -0.34 0.00 0.00 42.92 42.57 1ona s ASP 203 CO 0.76 -0.73 2.28 0.77 0.68 0.00 0.00 175.17 178.93 1ona h SER 204 N 0.09 0.00 -3.03 2.11 4.64 -1.97 -3.36 113.55 112.01 1ona h SER 204 Ca -0.45 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.29 1ona h SER 204 Cb 1.19 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.89 1ona h SER 204 CO 0.62 0.00 -0.78 -2.28 -0.87 0.00 0.00 176.83 173.52 1ona s HIS 205 N -4.06 1.28 0.58 4.77 5.65 -1.26 -5.12 115.29 117.12 1ona s HIS 205 Ca -0.05 -1.76 -0.18 0.00 0.25 0.00 0.00 55.06 53.32 1ona s HIS 205 Cb 0.12 -1.40 -0.04 0.00 -1.18 0.00 0.00 32.58 30.07 1ona s HIS 205 CO 0.38 -0.83 1.10 -1.25 -0.65 0.00 0.00 174.74 173.50 1ona s PRO 206 N 1.18 3.24 0.01 2.88 0.04 -1.26 -4.39 135.00 136.70 1ona s PRO 206 Ca 0.14 1.47 -0.28 0.00 0.04 0.00 0.00 61.00 62.38 1ona s PRO 206 Cb -0.21 -2.00 0.08 0.00 0.04 0.00 0.00 34.50 32.41 1ona s PRO 206 CO -0.12 -0.91 0.72 0.00 0.04 0.00 0.00 177.00 176.73 1ona s ALA 207 N -2.04 -1.74 -0.01 8.56 0.00 -1.21 -4.03 121.76 121.28 1ona s ALA 207 Ca 0.69 1.04 0.04 0.00 0.00 0.00 0.00 51.96 53.74 1ona s ALA 207 Cb -0.21 0.26 -0.07 0.00 0.00 0.00 0.00 23.12 23.10 1ona s ALA 207 CO 0.31 -0.54 0.08 -0.25 0.00 0.00 0.00 175.76 175.37 1ona n ASP 208 N 0.31 3.96 0.00 0.00 9.92 0.03 -2.82 116.55 127.95 1ona n ASP 208 Ca -0.16 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.10 1ona n ASP 208 Cb 0.60 1.07 0.00 0.00 -0.64 0.00 0.00 41.12 42.16 1ona n ASP 208 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ona n GLY 209 N 2.35 0.55 3.21 0.44 0.00 -1.23 -1.88 105.19 108.63 1ona n GLY 209 Ca -0.02 -1.65 -0.17 0.00 0.00 0.00 0.00 46.02 44.17 1ona n GLY 209 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ona s ILE 210 N -1.51 1.18 -0.09 -0.61 1.01 -0.63 -3.22 121.20 117.34 1ona s ILE 210 Ca 0.00 -1.58 -0.17 0.00 0.00 0.00 0.00 60.65 58.91 1ona s ILE 210 Cb 0.00 -1.36 0.04 0.00 0.01 0.00 0.00 42.46 41.15 1ona s ILE 210 CO 0.00 -0.39 0.41 0.00 0.00 0.00 0.00 174.94 174.96 1ona s ALA 211 N -1.95 -1.02 -0.14 9.38 0.00 -0.50 -0.08 121.76 127.44 1ona s ALA 211 Ca 0.05 0.85 -0.07 0.00 0.00 0.00 0.00 51.96 52.79 1ona s ALA 211 Cb -0.06 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.72 1ona s ALA 211 CO 0.02 -0.24 0.12 0.12 0.00 0.00 0.00 175.76 175.78 1ona s PHE 212 N -0.58 3.48 0.09 0.00 5.36 -0.65 -0.73 117.98 124.96 1ona s PHE 212 Ca -0.07 0.41 -0.01 0.00 -0.96 0.00 0.00 56.93 56.30 1ona s PHE 212 Cb -0.04 -2.00 -0.04 0.00 -0.34 0.00 0.00 43.02 40.60 1ona s PHE 212 CO 0.03 0.55 0.01 -0.59 -1.46 0.00 0.00 175.22 173.76 1ona s PHE 213 N -0.52 0.72 -0.07 10.12 -0.71 -0.14 -0.83 117.98 126.55 1ona s PHE 213 Ca 0.12 -1.14 0.02 0.00 -1.04 0.00 0.00 56.93 54.89 1ona s PHE 213 Cb -0.12 -0.45 0.02 0.00 -1.21 0.00 0.00 43.02 41.26 1ona s PHE 213 CO 0.02 -0.43 -0.11 0.42 -1.34 0.00 0.00 175.22 173.78 1ona s ILE 214 N -3.96 1.08 0.33 -4.49 1.01 0.14 -1.67 121.20 113.64 1ona s ILE 214 Ca 0.16 -0.43 0.06 0.00 0.00 0.00 0.00 60.65 60.44 1ona s ILE 214 Cb 0.08 -1.01 -0.03 0.00 0.01 0.00 0.00 42.46 41.51 1ona s ILE 214 CO -0.04 0.35 0.24 -0.94 0.00 0.00 0.00 174.94 174.55 1ona s SER 215 N 0.83 1.65 0.58 3.58 1.04 -0.62 -2.01 113.70 118.75 1ona s SER 215 Ca -0.11 -1.71 -0.20 0.00 0.48 0.00 0.00 55.95 54.41 1ona s SER 215 Cb -0.15 0.53 -0.04 0.00 0.10 0.00 0.00 66.02 66.46 1ona s SER 215 CO 0.02 -1.02 1.25 0.54 0.98 0.00 0.00 173.24 175.01 1ona s ASN 216 N -3.38 5.17 0.45 7.02 4.22 -1.21 -1.39 114.94 125.82 1ona s ASN 216 Ca 0.38 2.51 0.19 0.00 -2.14 0.00 0.00 52.86 53.80 1ona s ASN 216 Cb 0.03 -2.61 1.15 0.00 1.28 0.00 0.00 41.25 41.10 1ona s ASN 216 CO 0.24 -1.62 1.92 0.40 -2.04 0.00 0.00 177.10 176.00 1ona h ILE 217 N 1.01 0.74 -0.87 0.54 2.04 -1.84 -1.97 117.51 117.17 1ona h ILE 217 Ca -0.51 -0.11 -0.51 0.00 1.00 0.00 0.00 64.86 64.74 1ona h ILE 217 Cb 1.30 0.41 -0.26 0.00 -0.74 0.00 0.00 36.82 37.53 1ona h ILE 217 CO 0.56 0.06 0.65 -0.90 0.00 0.00 0.00 178.15 178.51 1ona n ASP 218 N -4.45 5.14 -4.78 1.72 5.75 -1.26 -4.79 116.55 113.88 1ona n ASP 218 Ca 0.15 -3.48 -0.37 0.00 -0.01 0.00 0.00 54.79 51.08 1ona n ASP 218 Cb 0.61 -0.88 -0.04 0.00 -1.03 0.00 0.00 41.12 39.78 1ona n ASP 218 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1ona s SER 219 N -1.13 6.74 0.06 -1.12 0.15 -0.74 -5.06 113.70 112.60 1ona s SER 219 Ca 0.52 2.06 -0.08 0.00 0.70 0.00 0.00 55.95 59.16 1ona s SER 219 Cb 0.43 -2.59 -0.00 0.00 -1.71 0.00 0.00 66.02 62.14 1ona s SER 219 CO 0.05 -0.51 0.16 -0.94 1.20 0.00 0.00 173.24 173.21 1ona s SER 220 N -1.53 0.13 0.00 5.45 1.04 -1.26 -5.07 113.70 112.46 1ona s SER 220 Ca 0.58 -0.56 -0.32 0.00 0.48 0.00 0.00 55.95 56.13 1ona s SER 220 Cb -0.23 0.29 -0.10 0.00 0.10 0.00 0.00 66.02 66.09 1ona s SER 220 CO 0.28 -0.63 1.93 -0.38 0.98 0.00 0.00 173.24 175.42 1ona n ILE 221 N 0.33 0.66 -1.97 -1.02 5.41 -1.26 -4.92 119.36 116.59 1ona n ILE 221 Ca -0.17 -0.12 -0.39 0.00 1.00 0.00 0.00 62.75 63.08 1ona n ILE 221 Cb 0.60 -2.14 0.01 0.00 -0.71 0.00 0.00 39.64 37.40 1ona n ILE 221 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1ona s PRO 222 N 4.13 3.64 0.33 0.38 0.02 -1.26 -4.92 135.00 137.32 1ona s PRO 222 Ca 0.90 2.15 -0.29 0.00 0.02 0.00 0.00 61.00 63.77 1ona s PRO 222 Cb -0.53 -2.52 -0.11 0.00 0.02 0.00 0.00 34.50 31.36 1ona s PRO 222 CO 0.45 -0.76 1.45 -1.12 -0.33 0.00 0.00 177.00 176.69 1ona s SER 223 N -0.89 6.50 0.00 2.53 0.01 -1.26 -2.42 113.70 118.17 1ona s SER 223 Ca 0.63 2.89 0.00 0.00 1.31 0.00 0.00 55.95 60.78 1ona s SER 223 Cb -0.38 -2.65 0.00 0.00 0.21 0.00 0.00 66.02 63.20 1ona s SER 223 CO 0.47 -0.77 0.00 0.61 0.41 0.00 0.00 173.24 173.96 1ona n GLY 224 N 1.08 0.56 1.52 3.44 0.00 -1.26 -4.90 105.19 105.63 1ona n GLY 224 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1ona n GLY 224 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ona n SER 225 N -0.12 4.49 -3.07 1.61 3.41 -1.02 -4.81 113.62 114.11 1ona n SER 225 Ca 0.00 -2.19 -0.15 0.00 -0.26 0.00 0.00 58.87 56.28 1ona n SER 225 Cb 0.06 -0.94 0.10 0.00 -0.26 0.00 0.00 64.21 63.17 1ona n SER 225 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1ona n THR 226 N 1.49 0.00 -1.65 6.66 -2.24 -1.26 -1.05 114.28 116.23 1ona n THR 226 Ca 0.00 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 61.20 1ona n THR 226 Cb 0.43 -1.61 0.00 0.00 -2.10 0.00 0.00 70.33 67.05 1ona n THR 226 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ona n GLY 227 N 0.55 3.09 0.08 3.38 0.00 0.13 -2.93 105.19 109.47 1ona n GLY 227 Ca 0.09 -0.19 0.07 0.00 0.00 0.00 0.00 46.02 45.99 1ona n GLY 227 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1ona n ARG 228 N 14.00 0.08 0.00 1.61 1.85 -1.26 -2.17 116.66 130.77 1ona n ARG 228 Ca 0.00 0.51 0.14 0.00 -1.00 0.00 0.00 57.85 57.50 1ona n ARG 228 Cb 0.00 -1.73 0.57 0.00 -1.05 0.00 0.00 32.46 30.25 1ona n ARG 228 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1ona n LEU 229 N -1.90 0.89 -1.21 2.89 4.77 -1.15 -4.92 117.00 116.36 1ona n LEU 229 Ca 0.00 -0.23 -0.11 0.00 -0.03 0.00 0.00 56.01 55.64 1ona n LEU 229 Cb 0.07 -0.08 -0.05 0.00 -2.33 0.00 0.00 43.42 41.03 1ona n LEU 229 CO 0.08 0.16 -0.11 0.18 -1.33 0.00 0.00 177.39 176.37 1ona n LEU 230 N -0.50 -0.74 -0.38 2.23 4.77 -0.92 -0.63 117.00 120.82 1ona n LEU 230 Ca 0.17 0.27 -0.05 0.00 -0.03 0.00 0.00 56.01 56.37 1ona n LEU 230 Cb 0.30 -1.89 -0.02 0.00 -2.33 0.00 0.00 43.42 39.48 1ona n LEU 230 CO 0.21 -0.65 -0.05 0.61 -1.33 0.00 0.00 177.39 176.19 1ona n GLY 231 N -0.14 0.75 0.27 -0.72 0.00 -0.22 -3.84 105.19 101.28 1ona n GLY 231 Ca -0.11 -0.55 -0.10 0.00 0.00 0.00 0.00 46.02 45.26 1ona n GLY 231 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ona n LEU 232 N -0.56 2.21 -4.50 0.99 4.77 0.20 -4.47 117.00 115.64 1ona n LEU 232 Ca -0.05 0.01 -0.29 0.00 -0.03 0.00 0.00 56.01 55.66 1ona n LEU 232 Cb 0.20 -0.38 -0.11 0.00 -2.33 0.00 0.00 43.42 40.81 1ona n LEU 232 CO 0.07 0.53 -0.48 -0.36 -1.33 0.00 0.00 177.39 175.82 1ona s PHE 233 N -2.22 2.54 -0.59 -1.77 0.08 -1.12 -4.77 117.98 110.13 1ona s PHE 233 Ca -0.16 -0.26 0.25 0.00 0.12 0.00 0.00 56.93 56.89 1ona s PHE 233 Cb 0.05 -1.32 0.73 0.00 -0.57 0.00 0.00 43.02 41.91 1ona s PHE 233 CO 0.24 0.42 1.74 -1.00 -0.10 0.00 0.00 175.22 176.52 1ona h PRO 234 N 3.55 0.00 -3.11 0.24 0.13 -1.91 -3.43 132.00 127.47 1ona h PRO 234 Ca -0.49 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.61 1ona h PRO 234 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 1ona h PRO 234 CO 0.48 0.00 0.22 0.16 -0.23 0.00 0.00 178.00 178.63 1ona s ASP 235 N -4.99 0.05 -0.45 1.44 1.47 -1.26 -4.94 116.67 108.00 1ona s ASP 235 Ca 0.09 -1.11 0.02 0.00 1.18 0.00 0.00 52.55 52.73 1ona s ASP 235 Cb 0.10 0.82 0.54 0.00 -0.34 0.00 0.00 42.92 44.04 1ona s ASP 235 CO 0.59 -1.61 1.87 0.00 0.68 0.00 0.00 175.17 176.71 1ona n ALA 236 N -0.52 5.47 1.69 2.11 0.00 -1.26 -4.72 120.51 123.28 1ona n ALA 236 Ca -0.07 -2.71 0.15 0.00 0.00 0.00 0.00 53.44 50.81 1ona n ALA 236 Cb 0.60 -1.47 0.68 0.00 0.00 0.00 0.00 19.45 19.26 1ona n ALA 236 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59