#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ghi n GLU 3 N 0.00 0.52 -3.45 3.23 2.13 -1.26 -4.21 120.64 117.60 2ghi n GLU 3 Ca 0.00 0.23 -0.37 0.00 0.66 0.00 0.00 57.16 57.68 2ghi n GLU 3 Cb 0.00 -2.14 -0.07 0.00 0.27 0.00 0.00 31.44 29.51 2ghi n GLU 3 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2ghi s SER 4 N -1.55 6.56 0.24 4.31 0.01 -1.26 -1.21 113.70 120.78 2ghi s SER 4 Ca 0.72 0.66 -0.31 0.00 1.31 0.00 0.00 55.95 58.33 2ghi s SER 4 Cb -0.36 -2.23 -0.14 0.00 0.21 0.00 0.00 66.02 63.51 2ghi s SER 4 CO 0.51 0.08 1.39 0.33 0.41 0.00 0.00 173.24 175.96 2ghi n PHE 5 N 3.48 2.10 -4.02 2.43 7.35 -1.26 -5.01 117.46 122.52 2ghi n PHE 5 Ca -0.10 0.45 -0.09 0.00 -0.76 0.00 0.00 57.45 56.95 2ghi n PHE 5 Cb 0.52 -2.45 -0.11 0.00 0.35 0.00 0.00 39.48 37.80 2ghi n PHE 5 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 2ghi s SER 6 N 0.25 0.40 0.09 -2.13 1.04 -1.26 -4.96 113.70 107.12 2ghi s SER 6 Ca 0.68 -0.65 -0.05 0.00 0.48 0.00 0.00 55.95 56.41 2ghi s SER 6 Cb -0.66 0.12 -0.05 0.00 0.10 0.00 0.00 66.02 65.53 2ghi s SER 6 CO 0.50 -0.37 0.32 -0.76 0.98 0.00 0.00 173.24 173.91 2ghi s LEU 7 N -1.90 4.32 0.88 2.42 1.43 -1.26 -5.09 118.68 119.48 2ghi s LEU 7 Ca -0.09 0.54 -0.11 0.00 -1.03 0.00 0.00 54.13 53.44 2ghi s LEU 7 Cb -0.05 -3.05 0.12 0.00 0.03 0.00 0.00 46.19 43.24 2ghi s LEU 7 CO -0.03 0.14 1.09 0.42 0.23 0.00 0.00 176.35 178.20 2ghi s THR 8 N -1.52 2.72 0.30 5.49 -4.23 -1.26 -4.82 115.64 112.33 2ghi s THR 8 Ca 0.36 0.23 -0.01 0.00 -1.18 0.00 0.00 61.69 61.09 2ghi s THR 8 Cb -0.13 -2.72 0.23 0.00 1.34 0.00 0.00 72.50 71.21 2ghi s THR 8 CO 0.22 -0.31 1.93 0.77 -0.54 0.00 0.00 174.62 176.70 2ghi h SER 9 N -1.50 0.86 0.19 3.99 4.64 -1.99 -1.58 113.55 118.16 2ghi h SER 9 Ca -0.49 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 60.77 2ghi h SER 9 Cb 1.28 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 63.14 2ghi h SER 9 CO 0.54 0.69 -0.16 -0.74 -0.87 0.00 0.00 176.83 176.29 2ghi h HIS 10 N 0.97 -0.43 -0.54 4.77 -0.00 -1.96 -2.19 115.15 115.77 2ghi h HIS 10 Ca 0.25 0.00 0.11 0.00 -0.00 0.00 0.00 60.37 60.73 2ghi h HIS 10 Cb 0.02 0.16 -0.09 0.00 -0.00 0.00 0.00 27.41 27.50 2ghi h HIS 10 CO 0.01 -0.25 -0.04 0.93 -0.00 0.00 0.00 177.93 178.58 2ghi h GLU 11 N -0.37 0.08 -0.68 5.26 5.08 -1.66 0.75 114.58 123.03 2ghi h GLU 11 Ca -0.00 -0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.41 2ghi h GLU 11 Cb 0.34 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.52 2ghi h GLU 11 CO -0.03 0.05 0.38 0.87 -1.00 0.00 0.00 179.01 179.29 2ghi h LYS 12 N 0.08 0.69 -0.35 2.33 1.57 -1.25 0.41 116.57 120.05 2ghi h LYS 12 Ca 0.27 -0.04 -0.16 0.00 -1.87 0.00 0.00 60.65 58.85 2ghi h LYS 12 Cb 0.42 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 2ghi h LYS 12 CO -0.49 0.46 -0.41 0.87 -0.57 0.00 0.00 179.45 179.31 2ghi h LYS 13 N 0.71 0.88 0.00 3.15 1.57 -0.88 -3.42 116.57 118.58 2ghi h LYS 13 Ca 0.30 -0.47 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 2ghi h LYS 13 Cb 0.18 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.51 2ghi h LYS 13 CO -0.18 1.12 -0.63 1.19 -0.57 0.00 0.00 179.45 180.38 2ghi n PHE 14 N -4.05 0.00 0.00 -1.35 3.72 0.21 -4.57 117.46 111.42 2ghi n PHE 14 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 2ghi n PHE 14 Cb 0.55 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.09 2ghi n PHE 14 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2ghi n GLY 15 N 1.77 1.76 3.41 1.37 0.00 0.14 -2.94 105.19 110.70 2ghi n GLY 15 Ca 0.00 -2.16 -0.27 0.00 0.00 0.00 0.00 46.02 43.58 2ghi n GLY 15 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ghi s VAL 16 N -1.68 2.29 0.70 1.61 -7.23 -1.26 -4.15 120.40 110.69 2ghi s VAL 16 Ca 0.00 -1.93 -0.16 0.00 -1.81 0.00 0.00 61.98 58.08 2ghi s VAL 16 Cb 0.00 -2.06 0.02 0.00 0.56 0.00 0.00 36.38 34.90 2ghi s VAL 16 CO 0.00 -0.06 1.23 0.20 -0.31 0.00 0.00 175.10 176.16 2ghi s ASN 17 N -2.47 4.37 -0.04 4.85 0.02 -1.26 -3.97 114.94 116.44 2ghi s ASN 17 Ca 0.18 2.43 -0.02 0.00 -1.02 0.00 0.00 52.86 54.43 2ghi s ASN 17 Cb -0.09 -2.60 0.03 0.00 0.02 0.00 0.00 41.25 38.62 2ghi s ASN 17 CO 0.08 -2.15 0.09 -0.63 0.02 0.00 0.00 177.10 174.51 2ghi s ILE 18 N -1.80 -0.08 -0.04 0.60 1.01 -0.44 -0.93 121.20 119.52 2ghi s ILE 18 Ca 0.77 0.25 0.03 0.00 0.00 0.00 0.00 60.65 61.69 2ghi s ILE 18 Cb -0.31 -0.16 0.01 0.00 0.01 0.00 0.00 42.46 42.00 2ghi s ILE 18 CO 0.43 0.10 -0.11 -0.70 0.00 0.00 0.00 174.94 174.66 2ghi s GLU 19 N 1.36 1.34 -0.19 2.79 2.12 0.19 -0.20 118.70 126.10 2ghi s GLU 19 Ca -0.06 -0.37 -0.07 0.00 0.36 0.00 0.00 54.97 54.82 2ghi s GLU 19 Cb -0.12 -1.18 -0.04 0.00 0.26 0.00 0.00 34.13 33.05 2ghi s GLU 19 CO -0.04 0.09 0.06 -0.06 -0.54 0.00 0.00 175.26 174.77 2ghi s PHE 20 N 0.40 3.21 -0.23 5.30 0.40 -0.09 -0.83 117.98 126.15 2ghi s PHE 20 Ca -0.08 -0.02 0.01 0.00 -0.60 0.00 0.00 56.93 56.24 2ghi s PHE 20 Cb -0.12 -2.11 0.03 0.00 0.51 0.00 0.00 43.02 41.33 2ghi s PHE 20 CO 0.02 0.05 -0.13 -1.12 0.70 0.00 0.00 175.22 174.74 2ghi s SER 21 N 0.61 3.89 -1.51 1.36 0.01 0.11 -2.20 113.70 115.98 2ghi s SER 21 Ca 0.03 -0.95 -0.17 0.00 1.31 0.00 0.00 55.95 56.17 2ghi s SER 21 Cb -0.13 -1.56 0.16 0.00 0.21 0.00 0.00 66.02 64.71 2ghi s SER 21 CO 0.01 -0.10 0.57 0.47 0.41 0.00 0.00 173.24 174.60 2ghi n ASP 22 N 4.57 -2.48 -4.72 2.44 10.43 -1.07 -1.54 116.55 124.19 2ghi n ASP 22 Ca -0.17 -0.83 -0.42 0.00 2.57 0.00 0.00 54.79 55.94 2ghi n ASP 22 Cb 0.47 -2.10 -0.03 0.00 1.84 0.00 0.00 41.12 41.29 2ghi n ASP 22 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2ghi s VAL 23 N -3.05 4.00 -0.00 2.53 1.01 -1.11 -3.98 120.40 119.80 2ghi s VAL 23 Ca 0.64 1.47 0.04 0.00 0.00 0.00 0.00 61.98 64.14 2ghi s VAL 23 Cb -0.36 -3.94 -0.01 0.00 0.00 0.00 0.00 36.38 32.06 2ghi s VAL 23 CO 0.79 0.13 -0.14 0.20 0.00 0.00 0.00 175.10 176.08 2ghi s ASN 24 N 0.90 1.65 -0.16 3.32 0.01 -0.57 -0.03 114.94 120.07 2ghi s ASN 24 Ca 0.57 -0.30 -0.14 0.00 -0.71 0.00 0.00 52.86 52.29 2ghi s ASN 24 Cb -0.30 -0.17 0.04 0.00 0.41 0.00 0.00 41.25 41.24 2ghi s ASN 24 CO 0.30 0.14 0.41 0.12 -1.51 0.00 0.00 177.10 176.57 2ghi s PHE 25 N -0.43 -0.46 -0.04 2.20 5.36 0.26 -1.68 117.98 123.18 2ghi s PHE 25 Ca 0.05 1.12 0.03 0.00 -0.96 0.00 0.00 56.93 57.16 2ghi s PHE 25 Cb -0.06 0.16 0.01 0.00 -0.34 0.00 0.00 43.02 42.79 2ghi s PHE 25 CO -0.00 -0.23 -0.12 -1.12 -1.46 0.00 0.00 175.22 172.30 2ghi s SER 26 N 0.30 1.60 0.58 6.13 0.01 -1.26 0.45 113.70 121.50 2ghi s SER 26 Ca -0.01 -0.26 -0.19 0.00 1.31 0.00 0.00 55.95 56.81 2ghi s SER 26 Cb -0.03 -0.54 -0.04 0.00 0.21 0.00 0.00 66.02 65.61 2ghi s SER 26 CO -0.00 0.07 1.15 -0.31 0.41 0.00 0.00 173.24 174.56 2ghi s TYR 27 N 0.33 2.58 0.28 2.43 2.02 -1.26 -4.92 117.35 118.80 2ghi s TYR 27 Ca -0.07 1.54 -0.02 0.00 -0.37 0.00 0.00 57.07 58.15 2ghi s TYR 27 Cb -0.12 -3.33 0.62 0.00 -0.40 0.00 0.00 41.96 38.73 2ghi s TYR 27 CO 0.02 -1.78 1.61 -1.35 -1.57 0.00 0.00 175.55 172.48 2ghi h PRO 28 N 0.93 0.08 -0.03 -1.71 0.11 -2.01 -0.01 132.00 129.37 2ghi h PRO 28 Ca -0.50 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.62 2ghi h PRO 28 Cb 1.27 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 2ghi h PRO 28 CO 0.56 0.06 0.19 1.57 -0.21 0.00 0.00 178.00 180.17 2ghi h LYS 29 N 0.09 0.00 -6.14 1.05 2.10 -2.02 -3.42 116.57 108.22 2ghi h LYS 29 Ca 0.52 0.00 -0.55 0.00 -2.00 0.00 0.00 60.65 58.61 2ghi h LYS 29 Cb 1.00 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 32.29 2ghi h LYS 29 CO -0.77 0.00 0.12 -0.65 -2.00 0.00 0.00 179.45 176.15 2ghi s GLN 30 N -4.20 4.45 -0.26 0.07 -0.21 -0.02 -4.97 119.66 114.53 2ghi s GLN 30 Ca -0.04 0.96 -0.15 0.00 0.02 0.00 0.00 55.36 56.15 2ghi s GLN 30 Cb 0.11 -3.41 -0.15 0.00 1.00 0.00 0.00 33.01 30.56 2ghi s GLN 30 CO 0.37 0.15 -0.18 2.41 -2.12 0.00 0.00 175.29 175.91 2ghi n THR 31 N 3.39 1.54 0.23 -0.19 -1.04 -1.26 -4.80 114.28 112.15 2ghi n THR 31 Ca -0.02 -0.31 0.03 0.00 -2.04 0.00 0.00 64.05 61.71 2ghi n THR 31 Cb 0.51 -1.89 0.02 0.00 -1.82 0.00 0.00 70.33 67.15 2ghi n THR 31 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2ghi n ASN 32 N -4.22 1.49 -4.02 8.00 5.03 -1.26 -5.05 115.26 115.24 2ghi n ASN 32 Ca -0.48 -1.25 -0.08 0.00 0.87 0.00 0.00 54.58 53.64 2ghi n ASN 32 Cb 0.85 -0.00 -0.10 0.00 -1.02 0.00 0.00 39.78 39.50 2ghi n ASN 32 CO 0.00 0.00 0.00 -1.00 -1.83 0.00 0.00 177.26 174.43 2ghi s HIS 33 N -0.48 0.36 0.33 3.10 3.76 -1.26 -5.17 115.29 115.93 2ghi s HIS 33 Ca 0.07 -0.76 -0.02 0.00 -0.15 0.00 0.00 55.06 54.20 2ghi s HIS 33 Cb 0.05 -0.27 -0.04 0.00 1.11 0.00 0.00 32.58 33.43 2ghi s HIS 33 CO 0.07 -0.31 0.56 1.03 -0.85 0.00 0.00 174.74 175.25 2ghi s ARG 34 N -2.76 3.54 -0.14 1.40 3.00 -1.26 -4.75 118.95 117.97 2ghi s ARG 34 Ca -0.04 -0.18 -0.06 0.00 0.00 0.00 0.00 55.73 55.45 2ghi s ARG 34 Cb -0.00 -2.64 -0.24 0.00 0.00 0.00 0.00 34.95 32.06 2ghi s ARG 34 CO -0.06 0.15 0.26 2.41 0.00 0.00 0.00 175.30 178.06 2ghi n THR 35 N -1.52 1.73 -4.98 0.02 -1.04 0.17 -4.93 114.28 103.74 2ghi n THR 35 Ca -0.03 -0.63 -0.28 0.00 -2.04 0.00 0.00 64.05 61.07 2ghi n THR 35 Cb 0.55 -1.69 -0.16 0.00 -1.82 0.00 0.00 70.33 67.21 2ghi n THR 35 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2ghi s LEU 36 N -6.98 1.96 -0.23 -4.42 1.43 -0.60 -3.80 118.68 106.03 2ghi s LEU 36 Ca -0.25 -0.42 -0.01 0.00 -1.03 0.00 0.00 54.13 52.42 2ghi s LEU 36 Cb 0.07 -1.12 0.07 0.00 0.03 0.00 0.00 46.19 45.24 2ghi s LEU 36 CO 0.74 0.17 0.03 -0.54 0.23 0.00 0.00 176.35 176.98 2ghi s LYS 37 N 0.07 0.91 -1.25 1.70 1.02 0.41 -0.58 119.74 122.02 2ghi s LYS 37 Ca -0.06 -0.72 -0.15 0.00 0.02 0.00 0.00 55.97 55.05 2ghi s LYS 37 Cb -0.13 -2.21 0.00 0.00 -0.52 0.00 0.00 37.83 34.97 2ghi s LYS 37 CO 0.04 -0.72 0.64 0.43 -0.92 0.00 0.00 175.35 174.82 2ghi n SER 38 N 4.91 -3.30 -4.59 2.83 7.64 -0.87 -4.50 113.62 115.73 2ghi n SER 38 Ca -0.08 -1.05 -0.43 0.00 1.01 0.00 0.00 58.87 58.32 2ghi n SER 38 Cb 0.45 -3.03 -0.02 0.00 -1.01 0.00 0.00 64.21 60.60 2ghi n SER 38 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2ghi s ILE 39 N -3.66 3.95 -0.20 0.44 -1.09 0.96 -4.75 121.20 116.84 2ghi s ILE 39 Ca 0.30 0.92 0.00 0.00 -2.23 0.00 0.00 60.65 59.65 2ghi s ILE 39 Cb -0.12 -4.40 0.02 0.00 -1.58 0.00 0.00 42.46 36.39 2ghi s ILE 39 CO 0.89 -0.97 -0.16 0.20 -1.23 0.00 0.00 174.94 173.67 2ghi s ASN 40 N 3.67 3.53 0.08 3.58 0.01 -1.26 -2.58 114.94 121.97 2ghi s ASN 40 Ca 0.55 -0.73 -0.19 0.00 -0.71 0.00 0.00 52.86 51.77 2ghi s ASN 40 Cb -0.11 -1.53 0.04 0.00 0.41 0.00 0.00 41.25 40.06 2ghi s ASN 40 CO 0.30 -0.04 0.45 0.72 -1.51 0.00 0.00 177.10 177.03 2ghi s PHE 41 N 1.29 -0.31 -0.10 2.20 -0.12 -0.93 -5.00 117.98 115.01 2ghi s PHE 41 Ca 0.03 0.18 0.01 0.00 -0.05 0.00 0.00 56.93 57.10 2ghi s PHE 41 Cb -0.14 0.29 0.02 0.00 -0.63 0.00 0.00 43.02 42.56 2ghi s PHE 41 CO -0.10 -0.66 -0.11 0.12 -0.05 0.00 0.00 175.22 174.42 2ghi s PHE 42 N -3.03 1.60 -0.25 3.49 5.36 -1.26 -0.91 117.98 122.97 2ghi s PHE 42 Ca -0.02 -0.74 -0.05 0.00 -0.96 0.00 0.00 56.93 55.16 2ghi s PHE 42 Cb 0.00 -1.24 -0.00 0.00 -0.34 0.00 0.00 43.02 41.44 2ghi s PHE 42 CO -0.06 -0.45 0.01 0.42 -1.46 0.00 0.00 175.22 173.68 2ghi s ILE 43 N 1.26 3.61 0.37 3.12 1.01 0.72 -4.99 121.20 126.30 2ghi s ILE 43 Ca -0.03 -0.58 -0.27 0.00 0.00 0.00 0.00 60.65 59.77 2ghi s ILE 43 Cb -0.14 -2.75 -0.09 0.00 0.01 0.00 0.00 42.46 39.49 2ghi s ILE 43 CO -0.04 0.27 1.18 -2.84 0.00 0.00 0.00 174.94 173.51 2ghi s PRO 44 N 1.48 4.22 0.44 2.79 0.02 -1.26 -1.32 135.00 141.37 2ghi s PRO 44 Ca 0.04 1.89 -0.24 0.00 0.02 0.00 0.00 61.00 62.71 2ghi s PRO 44 Cb -0.16 -2.84 -0.10 0.00 0.02 0.00 0.00 34.50 31.43 2ghi s PRO 44 CO -0.01 -0.19 1.06 -1.13 -0.33 0.00 0.00 177.00 176.41 2ghi n SER 45 N 0.40 1.49 0.00 2.53 3.41 -1.25 -2.14 113.62 118.07 2ghi n SER 45 Ca 0.03 1.02 0.00 0.00 -0.26 0.00 0.00 58.87 59.66 2ghi n SER 45 Cb 0.45 -1.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.01 2ghi n SER 45 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ghi n GLY 46 N 1.11 0.39 4.03 5.00 0.00 -1.22 -4.92 105.19 109.59 2ghi n GLY 46 Ca 0.09 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.92 2ghi n GLY 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ghi s THR 47 N -1.93 2.19 -0.18 2.61 -4.23 -0.91 -4.76 115.64 108.43 2ghi s THR 47 Ca 0.00 -1.00 -0.01 0.00 -1.18 0.00 0.00 61.69 59.50 2ghi s THR 47 Cb 0.00 -2.19 0.00 0.00 1.34 0.00 0.00 72.50 71.65 2ghi s THR 47 CO 0.00 0.00 -0.13 0.28 -0.54 0.00 0.00 174.62 174.23 2ghi s THR 48 N -2.65 2.74 -0.18 3.99 -1.32 -1.26 -1.02 115.64 115.94 2ghi s THR 48 Ca 0.61 -0.72 -0.01 0.00 -1.21 0.00 0.00 61.69 60.36 2ghi s THR 48 Cb -0.06 -2.19 -0.00 0.00 -1.51 0.00 0.00 72.50 68.74 2ghi s THR 48 CO 0.39 0.49 -0.12 0.00 -2.21 0.00 0.00 174.62 173.17 2ghi s ALA 50 N 1.10 3.55 -0.34 0.00 0.00 -0.77 -0.34 121.76 124.97 2ghi s ALA 50 Ca 0.00 -0.30 -0.09 0.00 0.00 0.00 0.00 51.96 51.58 2ghi s ALA 50 Cb -0.14 -2.51 0.02 0.00 0.00 0.00 0.00 23.12 20.48 2ghi s ALA 50 CO -0.03 0.10 0.16 -0.51 0.00 0.00 0.00 175.76 175.47 2ghi s LEU 51 N 0.35 4.38 0.23 0.00 1.43 0.19 -0.58 118.68 124.68 2ghi s LEU 51 Ca 0.22 -0.88 0.11 0.00 -1.03 0.00 0.00 54.13 52.54 2ghi s LEU 51 Cb -0.14 -1.97 -0.05 0.00 0.03 0.00 0.00 46.19 44.06 2ghi s LEU 51 CO 0.08 -0.30 -0.16 0.68 0.23 0.00 0.00 176.35 176.88 2ghi s VAL 52 N 1.53 2.76 0.00 -1.59 -7.23 0.37 -1.03 120.40 115.21 2ghi s VAL 52 Ca 0.02 -2.06 0.00 0.00 -1.81 0.00 0.00 61.98 58.13 2ghi s VAL 52 Cb -0.18 -2.40 0.00 0.00 0.56 0.00 0.00 36.38 34.35 2ghi s VAL 52 CO 0.05 -0.25 0.00 0.61 -0.31 0.00 0.00 175.10 175.20 2ghi n GLY 53 N -0.27 3.39 3.63 2.32 0.00 -1.26 -0.76 105.19 112.24 2ghi n GLY 53 Ca -0.09 -0.83 -0.30 0.00 0.00 0.00 0.00 46.02 44.80 2ghi n GLY 53 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2ghi s HIS 54 N -2.00 1.74 0.33 1.61 3.76 -1.26 -4.88 115.29 114.60 2ghi s HIS 54 Ca 0.00 1.44 -0.29 0.00 -0.15 0.00 0.00 55.06 56.06 2ghi s HIS 54 Cb 0.00 -3.20 -0.12 0.00 1.11 0.00 0.00 32.58 30.37 2ghi s HIS 54 CO 0.00 -3.02 1.48 2.41 -0.85 0.00 0.00 174.74 174.76 2ghi n THR 55 N -4.35 1.57 -0.39 1.30 -1.04 -1.26 -1.75 114.28 108.36 2ghi n THR 55 Ca 0.07 -0.39 0.00 0.00 -2.04 0.00 0.00 64.05 61.69 2ghi n THR 55 Cb 0.54 -1.85 0.00 0.00 -1.82 0.00 0.00 70.33 67.19 2ghi n THR 55 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2ghi n GLY 56 N 1.25 0.76 0.42 3.41 0.00 -1.26 -4.97 105.19 104.80 2ghi n GLY 56 Ca 0.05 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.19 2ghi n GLY 56 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ghi n SER 57 N 0.00 1.75 0.00 1.61 3.41 -0.72 -4.63 113.62 115.04 2ghi n SER 57 Ca 0.00 -1.34 0.00 0.00 -0.26 0.00 0.00 58.87 57.27 2ghi n SER 57 Cb 0.00 0.41 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 2ghi n SER 57 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ghi n GLY 58 N 1.40 0.87 0.15 5.00 0.00 -1.26 -1.51 105.19 109.84 2ghi n GLY 58 Ca 0.10 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.00 2ghi n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ghi h LYS 59 N 2.85 0.41 0.00 1.61 1.57 -1.92 -2.64 116.57 118.45 2ghi h LYS 59 Ca 0.00 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 2ghi h LYS 59 Cb 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.29 2ghi h LYS 59 CO 0.00 0.65 0.00 0.66 -0.57 0.00 0.00 179.45 180.19 2ghi h SER 60 N 0.14 0.00 -0.21 0.86 4.64 -1.98 -3.02 113.55 113.97 2ghi h SER 60 Ca 0.05 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.23 2ghi h SER 60 Cb 0.49 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 2ghi h SER 60 CO 0.02 0.00 -0.39 0.74 -0.87 0.00 0.00 176.83 176.33 2ghi h THR 61 N 0.00 1.29 -0.46 2.95 2.02 -1.90 -1.56 112.91 115.24 2ghi h THR 61 Ca 0.00 -1.56 0.07 0.00 0.77 0.00 0.00 66.41 65.69 2ghi h THR 61 Cb 0.73 1.46 -0.06 0.00 -1.74 0.00 0.00 68.15 68.54 2ghi h THR 61 CO 0.00 0.51 0.12 0.40 0.37 0.00 0.00 175.52 176.92 2ghi h ILE 62 N 0.62 0.79 -0.30 3.11 2.04 -1.35 0.72 117.51 123.14 2ghi h ILE 62 Ca 0.05 -0.09 0.01 0.00 1.00 0.00 0.00 64.86 65.82 2ghi h ILE 62 Cb 0.94 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 2ghi h ILE 62 CO 0.09 0.05 0.19 0.00 0.00 0.00 0.00 178.15 178.48 2ghi h ALA 63 N 1.33 0.38 -0.58 1.87 0.00 -1.54 0.04 119.26 120.76 2ghi h ALA 63 Ca 0.22 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 2ghi h ALA 63 Cb 0.26 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2ghi h ALA 63 CO -0.26 -0.17 0.22 0.87 0.00 0.00 0.00 179.25 179.90 2ghi h LYS 64 N 0.39 0.85 -0.28 0.00 1.57 -0.97 -0.05 116.57 118.08 2ghi h LYS 64 Ca 0.11 -0.14 -0.15 0.00 -1.87 0.00 0.00 60.65 58.60 2ghi h LYS 64 Cb -0.03 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 2ghi h LYS 64 CO -0.03 0.71 -0.45 -0.07 -0.57 0.00 0.00 179.45 179.03 2ghi h LEU 65 N 0.83 0.77 -0.83 2.94 3.38 -0.70 -0.55 115.31 121.16 2ghi h LEU 65 Ca 0.20 -0.37 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 2ghi h LEU 65 Cb 0.19 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2ghi h LEU 65 CO -0.02 1.11 0.26 0.25 0.09 0.00 0.00 178.44 180.13 2ghi h LEU 66 N 0.57 1.05 0.00 1.67 5.85 -0.61 -2.03 115.31 121.82 2ghi h LEU 66 Ca 0.04 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.58 2ghi h LEU 66 Cb 1.00 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.76 2ghi h LEU 66 CO 0.09 0.96 0.00 0.00 -0.34 0.00 0.00 178.44 179.15 2ghi n TYR 67 N -4.26 0.00 -2.20 1.25 9.36 -0.07 -4.88 117.16 116.36 2ghi n TYR 67 Ca 0.06 0.00 -0.16 0.00 3.32 0.00 0.00 57.90 61.12 2ghi n TYR 67 Cb 0.21 0.00 -0.01 0.00 -0.63 0.00 0.00 39.34 38.91 2ghi n TYR 67 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2ghi n ARG 68 N -0.61 -1.24 0.22 2.98 5.12 -0.76 -4.78 116.66 117.58 2ghi n ARG 68 Ca 0.05 0.80 0.09 0.00 -1.93 0.00 0.00 57.85 56.86 2ghi n ARG 68 Cb 0.02 -5.16 0.49 0.00 -1.16 0.00 0.00 32.46 26.65 2ghi n ARG 68 CO 0.00 0.00 0.00 0.74 -1.93 0.00 0.00 177.63 176.44 2ghi h PHE 69 N 0.00 0.00 -3.83 -1.55 0.04 -1.32 -3.46 116.94 106.82 2ghi h PHE 69 Ca -0.37 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.31 2ghi h PHE 69 Cb 1.25 0.00 -0.12 0.00 2.20 0.00 0.00 35.95 39.27 2ghi h PHE 69 CO 0.42 0.25 -0.30 0.71 -0.60 0.00 0.00 178.31 178.80 2ghi s TYR 70 N -3.83 0.32 0.13 -0.55 2.02 -1.26 -5.06 117.35 109.12 2ghi s TYR 70 Ca -0.01 -0.69 0.04 0.00 -0.37 0.00 0.00 57.07 56.04 2ghi s TYR 70 Cb 0.12 -0.02 -0.04 0.00 -0.40 0.00 0.00 41.96 41.62 2ghi s TYR 70 CO 0.64 -0.71 0.14 -0.51 -1.57 0.00 0.00 175.55 173.54 2ghi s ASP 71 N -2.95 5.66 0.24 2.29 1.11 -1.26 -4.78 116.67 116.97 2ghi s ASP 71 Ca 0.15 -0.03 0.10 0.00 0.18 0.00 0.00 52.55 52.95 2ghi s ASP 71 Cb 0.03 -1.53 -0.04 0.00 1.07 0.00 0.00 42.92 42.44 2ghi s ASP 71 CO -0.02 0.11 -0.11 0.00 1.18 0.00 0.00 175.17 176.33 2ghi s ALA 72 N -1.61 2.92 0.46 5.23 0.00 -1.26 -4.97 121.76 122.53 2ghi s ALA 72 Ca 0.31 -1.66 -0.24 0.00 0.00 0.00 0.00 51.96 50.37 2ghi s ALA 72 Cb -0.11 -0.58 -0.07 0.00 0.00 0.00 0.00 23.12 22.36 2ghi s ALA 72 CO 0.24 0.35 1.27 -1.21 0.00 0.00 0.00 175.76 176.40 2ghi s GLU 73 N -3.27 3.70 0.19 0.00 8.01 -0.68 -4.81 118.70 121.84 2ghi s GLU 73 Ca 0.28 2.05 0.00 0.00 0.01 0.00 0.00 54.97 57.31 2ghi s GLU 73 Cb -0.07 -2.52 0.00 0.00 -4.31 0.00 0.00 34.13 27.23 2ghi s GLU 73 CO 0.16 -0.68 0.00 0.41 0.01 0.00 0.00 175.26 175.16 2ghi n GLY 74 N 0.61 -2.36 3.24 -1.39 0.00 -1.26 -1.51 105.19 102.52 2ghi n GLY 74 Ca 0.06 -1.91 -0.29 0.00 0.00 0.00 0.00 46.02 43.89 2ghi n GLY 74 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ghi s ASP 75 N -3.03 2.65 -0.20 1.61 1.11 -0.59 -4.88 116.67 113.35 2ghi s ASP 75 Ca 0.00 -0.42 -0.02 0.00 0.18 0.00 0.00 52.55 52.30 2ghi s ASP 75 Cb 0.00 -0.41 0.00 0.00 1.07 0.00 0.00 42.92 43.58 2ghi s ASP 75 CO 0.00 0.26 -0.11 -0.63 1.18 0.00 0.00 175.17 175.87 2ghi s ILE 76 N -0.41 2.86 -0.07 0.77 1.01 -1.26 0.04 121.20 124.14 2ghi s ILE 76 Ca 0.05 -0.67 0.04 0.00 0.00 0.00 0.00 60.65 60.07 2ghi s ILE 76 Cb -0.10 -2.26 -0.02 0.00 0.01 0.00 0.00 42.46 40.09 2ghi s ILE 76 CO 0.00 0.48 -0.18 -0.54 0.00 0.00 0.00 174.94 174.70 2ghi s LYS 77 N 1.30 2.67 -0.18 2.79 1.02 -0.01 -1.56 119.74 125.77 2ghi s LYS 77 Ca 0.04 -0.77 -0.00 0.00 0.02 0.00 0.00 55.97 55.25 2ghi s LYS 77 Cb -0.14 -2.34 0.01 0.00 -0.52 0.00 0.00 37.83 34.84 2ghi s LYS 77 CO -0.06 0.46 -0.16 0.42 -0.92 0.00 0.00 175.35 175.09 2ghi s ILE 78 N -0.33 2.40 -1.28 2.17 1.01 0.42 0.53 121.20 126.12 2ghi s ILE 78 Ca 0.02 -0.83 -0.04 0.00 0.00 0.00 0.00 60.65 59.80 2ghi s ILE 78 Cb -0.13 -2.03 0.01 0.00 0.01 0.00 0.00 42.46 40.32 2ghi s ILE 78 CO 0.02 0.51 1.06 0.61 0.00 0.00 0.00 174.94 177.14 2ghi n GLY 79 N 4.57 -0.43 2.84 6.18 0.00 -0.10 -2.19 105.19 116.05 2ghi n GLY 79 Ca -0.20 0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2ghi n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ghi n GLY 80 N -1.51 0.19 3.41 -0.02 0.00 -1.26 -4.96 105.19 101.04 2ghi n GLY 80 Ca -0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.52 2ghi n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ghi s LYS 81 N -1.25 3.28 0.09 1.61 1.02 -0.93 -5.02 119.74 118.52 2ghi s LYS 81 Ca 0.00 -0.65 -0.31 0.00 0.02 0.00 0.00 55.97 55.03 2ghi s LYS 81 Cb 0.00 -2.64 -0.08 0.00 -0.52 0.00 0.00 37.83 34.59 2ghi s LYS 81 CO 0.00 0.30 1.59 1.21 -0.92 0.00 0.00 175.35 177.53 2ghi s ASN 82 N 0.14 6.64 0.39 2.83 3.84 -1.26 -0.44 114.94 127.08 2ghi s ASN 82 Ca -0.06 2.46 0.28 0.00 0.21 0.00 0.00 52.86 55.75 2ghi s ASN 82 Cb -0.15 -2.57 1.31 0.00 -0.55 0.00 0.00 41.25 39.29 2ghi s ASN 82 CO 0.04 -0.84 1.84 -0.37 -2.79 0.00 0.00 177.10 174.99 2ghi h VAL 83 N 4.61 0.00 0.00 -5.21 -1.51 -1.65 -2.53 116.25 109.95 2ghi h VAL 83 Ca -0.42 -0.19 0.00 0.00 -1.23 0.00 0.00 66.70 64.86 2ghi h VAL 83 Cb 1.20 0.94 0.00 0.00 -2.13 0.00 0.00 31.29 31.30 2ghi h VAL 83 CO 0.92 0.00 0.00 -0.55 -1.23 0.00 0.00 177.57 176.71 2ghi h ASN 84 N 0.00 0.00 0.52 4.19 7.08 -1.90 -2.92 115.58 122.55 2ghi h ASN 84 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 2ghi h ASN 84 Cb 0.24 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.48 2ghi h ASN 84 CO 0.00 0.00 0.00 0.29 -2.08 0.00 0.00 177.43 175.64 2ghi n LYS 85 N -2.40 0.33 -4.26 4.14 5.02 -0.95 -4.89 118.16 115.15 2ghi n LYS 85 Ca 0.02 0.05 -0.19 0.00 -2.02 0.00 0.00 58.31 56.16 2ghi n LYS 85 Cb 0.23 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 33.63 2ghi n LYS 85 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2ghi s TYR 86 N -2.61 1.53 0.51 2.13 2.02 -1.10 -4.14 117.35 115.68 2ghi s TYR 86 Ca 0.23 -0.52 -0.22 0.00 -0.37 0.00 0.00 57.07 56.19 2ghi s TYR 86 Cb 0.17 -0.80 -0.06 0.00 -0.40 0.00 0.00 41.96 40.87 2ghi s TYR 86 CO 0.40 0.19 1.24 0.54 -1.57 0.00 0.00 175.55 176.35 2ghi s ASN 87 N -2.42 5.71 0.21 2.29 2.20 -0.35 -4.90 114.94 117.68 2ghi s ASN 87 Ca 0.10 2.49 -0.09 0.00 -0.94 0.00 0.00 52.86 54.42 2ghi s ASN 87 Cb -0.06 -2.61 0.17 0.00 -2.00 0.00 0.00 41.25 36.74 2ghi s ASN 87 CO 0.04 -1.25 1.82 0.03 -2.94 0.00 0.00 177.10 174.81 2ghi h ARG 88 N 1.68 1.14 -0.44 3.55 3.08 -1.92 -3.10 114.38 118.36 2ghi h ARG 88 Ca -0.50 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 59.40 2ghi h ARG 88 Cb 1.27 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 31.09 2ghi h ARG 88 CO 0.58 0.85 0.25 -0.91 -1.07 0.00 0.00 179.97 179.68 2ghi h ASN 89 N 1.12 0.52 1.28 7.04 2.35 -1.97 -0.33 115.58 125.60 2ghi h ASN 89 Ca 0.28 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 56.00 2ghi h ASN 89 Cb 0.07 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.31 2ghi h ASN 89 CO -0.04 0.41 0.00 0.77 -1.65 0.00 0.00 177.43 176.92 2ghi h SER 90 N 0.60 0.00 0.11 5.81 4.64 -1.93 -2.10 113.55 120.67 2ghi h SER 90 Ca 0.16 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.26 2ghi h SER 90 Cb -0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2ghi h SER 90 CO -0.03 0.00 -1.07 0.40 -0.87 0.00 0.00 176.83 175.26 2ghi h ILE 91 N 0.00 1.25 -0.80 0.95 1.08 -1.21 -3.34 117.51 115.45 2ghi h ILE 91 Ca 0.00 -2.43 0.19 0.00 -0.39 0.00 0.00 64.86 62.23 2ghi h ILE 91 Cb 0.64 2.90 -0.05 0.00 -3.07 0.00 0.00 36.82 37.25 2ghi h ILE 91 CO 0.00 0.67 0.54 0.03 -0.69 0.00 0.00 178.15 178.70 2ghi h ARG 92 N -0.44 0.28 0.00 2.37 3.08 -1.07 -2.54 114.38 116.06 2ghi h ARG 92 Ca -0.23 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.81 2ghi h ARG 92 Cb 1.62 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.61 2ghi h ARG 92 CO 0.07 0.18 0.00 0.66 -1.07 0.00 0.00 179.97 179.81 2ghi h SER 93 N 0.29 0.00 0.01 7.04 4.64 -1.50 -2.15 113.55 121.87 2ghi h SER 93 Ca 0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.72 2ghi h SER 93 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 2ghi h SER 93 CO -0.11 0.00 -0.05 2.30 -0.87 0.00 0.00 176.83 178.10 2ghi n ILE 94 N -2.74 0.00 -4.63 0.95 -5.35 -0.96 -4.70 119.36 101.92 2ghi n ILE 94 Ca 0.03 -0.32 -0.33 0.00 -0.27 0.00 0.00 62.75 61.87 2ghi n ILE 94 Cb 0.41 0.84 -0.13 0.00 -1.74 0.00 0.00 39.64 39.02 2ghi n ILE 94 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 2ghi s ILE 95 N -2.08 3.42 -0.10 7.28 1.01 -0.81 -0.30 121.20 129.62 2ghi s ILE 95 Ca 0.32 -0.54 0.01 0.00 0.00 0.00 0.00 60.65 60.45 2ghi s ILE 95 Cb 0.20 -2.46 -0.02 0.00 0.01 0.00 0.00 42.46 40.20 2ghi s ILE 95 CO 0.36 0.52 -0.13 -0.83 0.00 0.00 0.00 174.94 174.85 2ghi s GLY 96 N 0.25 1.54 -0.17 6.18 0.00 0.27 -4.92 107.32 110.47 2ghi s GLY 96 Ca -0.06 -0.92 -0.04 0.00 0.00 0.00 0.00 44.72 43.70 2ghi s GLY 96 CO 0.04 -0.39 -0.03 -0.42 0.00 0.00 0.00 173.10 172.31 2ghi s ILE 97 N -0.02 3.88 -0.47 0.90 -1.09 -1.26 0.01 121.20 123.15 2ghi s ILE 97 Ca -0.03 -0.35 -0.09 0.00 -2.23 0.00 0.00 60.65 57.94 2ghi s ILE 97 Cb -0.14 -2.72 0.12 0.00 -1.58 0.00 0.00 42.46 38.14 2ghi s ILE 97 CO 0.04 0.47 0.34 -0.69 -1.23 0.00 0.00 174.94 173.87 2ghi s VAL 98 N 0.59 4.17 0.92 2.92 1.01 0.42 -4.91 120.40 125.52 2ghi s VAL 98 Ca -0.02 -1.81 -0.12 0.00 0.00 0.00 0.00 61.98 60.02 2ghi s VAL 98 Cb -0.14 -3.75 0.14 0.00 0.00 0.00 0.00 36.38 32.62 2ghi s VAL 98 CO 0.02 -0.78 1.11 -2.16 0.00 0.00 0.00 175.10 173.30 2ghi s PRO 99 N 1.34 1.08 0.07 2.72 0.04 -1.26 0.32 135.00 139.30 2ghi s PRO 99 Ca 0.06 0.46 -0.19 0.00 0.04 0.00 0.00 61.00 61.37 2ghi s PRO 99 Cb -0.26 -1.82 -0.10 0.00 0.04 0.00 0.00 34.50 32.36 2ghi s PRO 99 CO -0.01 -2.27 1.47 0.37 0.04 0.00 0.00 177.00 176.60 2ghi h GLN 100 N -1.56 0.41 -4.85 4.56 5.75 -1.92 -3.41 115.11 114.09 2ghi h GLN 100 Ca -0.51 -0.15 -0.67 0.00 -0.15 0.00 0.00 58.65 57.17 2ghi h GLN 100 Cb 1.32 -0.03 -0.37 0.00 1.07 0.00 0.00 27.48 29.47 2ghi h GLN 100 CO 0.60 0.64 -0.79 -0.51 -2.65 0.00 0.00 178.83 176.12 2ghi s ASP 101 N -5.99 4.50 -0.03 -0.69 1.01 -1.26 -4.83 116.67 109.39 2ghi s ASP 101 Ca -0.14 -1.41 -0.30 0.00 0.71 0.00 0.00 52.55 51.41 2ghi s ASP 101 Cb 0.07 -1.57 -0.03 0.00 1.01 0.00 0.00 42.92 42.40 2ghi s ASP 101 CO 0.75 -0.20 1.04 -0.89 0.21 0.00 0.00 175.17 176.07 2ghi s THR 102 N 1.11 4.67 0.06 -1.27 2.01 -1.26 -5.03 115.64 115.93 2ghi s THR 102 Ca -0.08 1.93 -0.31 0.00 0.31 0.00 0.00 61.69 63.54 2ghi s THR 102 Cb -0.20 -4.24 -0.06 0.00 0.01 0.00 0.00 72.50 68.02 2ghi s THR 102 CO -0.05 0.09 1.21 -0.63 -0.69 0.00 0.00 174.62 174.55 2ghi s ILE 103 N 1.46 4.00 -0.24 1.82 1.09 -1.26 -5.01 121.20 123.05 2ghi s ILE 103 Ca 0.52 1.43 -0.11 0.00 -1.10 0.00 0.00 60.65 61.39 2ghi s ILE 103 Cb -0.22 -3.92 -0.05 0.00 -1.06 0.00 0.00 42.46 37.22 2ghi s ILE 103 CO 0.24 0.11 0.20 -0.76 -0.10 0.00 0.00 174.94 174.63 2ghi s LEU 104 N 1.11 4.11 0.38 2.97 2.01 -1.26 -5.08 118.68 122.91 2ghi s LEU 104 Ca 0.59 0.15 -0.24 0.00 0.01 0.00 0.00 54.13 54.64 2ghi s LEU 104 Cb -0.30 -2.16 -0.10 0.00 0.01 0.00 0.00 46.19 43.64 2ghi s LEU 104 CO 0.29 0.03 0.99 -0.36 1.01 0.00 0.00 176.35 178.31 2ghi s PHE 105 N 1.21 3.41 -0.69 0.29 0.08 -1.26 -4.73 117.98 116.28 2ghi s PHE 105 Ca 0.09 1.68 -0.26 0.00 0.12 0.00 0.00 56.93 58.56 2ghi s PHE 105 Cb -0.14 -3.00 -0.05 0.00 -0.57 0.00 0.00 43.02 39.26 2ghi s PHE 105 CO 0.06 -0.25 2.02 -0.80 -0.10 0.00 0.00 175.22 176.16 2ghi s ASN 106 N -1.73 4.97 -0.01 1.36 -0.87 -1.26 -2.47 114.94 114.93 2ghi s ASN 106 Ca 0.56 0.15 -0.14 0.00 -1.57 0.00 0.00 52.86 51.86 2ghi s ASN 106 Cb -0.18 -2.54 0.05 0.00 -0.02 0.00 0.00 41.25 38.56 2ghi s ASN 106 CO 0.23 -2.70 0.63 -0.62 -2.57 0.00 0.00 177.10 172.07 2ghi n GLU 107 N 9.04 0.09 -1.54 -0.60 -0.58 -1.26 -4.81 120.64 120.97 2ghi n GLU 107 Ca 0.31 -0.38 -0.31 0.00 -0.42 0.00 0.00 57.16 56.37 2ghi n GLU 107 Cb 0.50 0.63 0.07 0.00 -0.57 0.00 0.00 31.44 32.07 2ghi n GLU 107 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 2ghi s THR 108 N -2.08 3.59 0.19 2.62 -4.23 -1.26 -0.47 115.64 113.98 2ghi s THR 108 Ca 0.15 0.51 -0.07 0.00 -1.18 0.00 0.00 61.69 61.11 2ghi s THR 108 Cb -0.00 -3.24 0.01 0.00 1.34 0.00 0.00 72.50 70.61 2ghi s THR 108 CO -0.00 -0.67 1.58 -0.29 -0.54 0.00 0.00 174.62 174.69 2ghi h ILE 109 N -0.90 1.27 -0.77 2.99 2.10 -0.57 -2.11 117.51 119.52 2ghi h ILE 109 Ca -0.45 -1.41 0.10 0.00 1.08 0.00 0.00 64.86 64.18 2ghi h ILE 109 Cb 1.24 1.24 -0.07 0.00 -1.09 0.00 0.00 36.82 38.13 2ghi h ILE 109 CO 0.57 0.47 0.41 0.50 -1.08 0.00 0.00 178.15 179.03 2ghi h LYS 110 N 0.73 0.66 -0.26 2.19 3.64 -1.72 -1.39 116.57 120.42 2ghi h LYS 110 Ca 0.09 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.48 2ghi h LYS 110 Cb 0.81 -0.15 -0.05 0.00 -0.41 0.00 0.00 32.23 32.43 2ghi h LYS 110 CO 0.07 0.44 -0.04 -0.92 -2.27 0.00 0.00 179.45 176.73 2ghi h TYR 111 N 0.68 -0.09 -0.99 1.91 3.20 -1.74 -0.09 116.97 119.86 2ghi h TYR 111 Ca 0.38 0.02 0.17 0.00 3.14 0.00 0.00 58.73 62.44 2ghi h TYR 111 Cb 0.38 0.08 -0.10 0.00 1.54 0.00 0.00 36.73 38.64 2ghi h TYR 111 CO -0.09 -0.09 0.62 -0.91 -1.64 0.00 0.00 178.16 176.05 2ghi h ASN 112 N 0.03 0.77 -0.03 -2.11 2.35 -0.60 -0.85 115.58 115.14 2ghi h ASN 112 Ca 0.13 0.08 -0.21 0.00 -0.55 0.00 0.00 56.30 55.75 2ghi h ASN 112 Cb 0.18 -0.07 0.02 0.00 0.05 0.00 0.00 38.32 38.50 2ghi h ASN 112 CO -0.25 0.32 -0.78 0.40 -1.65 0.00 0.00 177.43 175.46 2ghi h ILE 113 N 0.78 1.34 -0.03 2.81 2.04 -0.76 -3.24 117.51 120.46 2ghi h ILE 113 Ca 0.55 -2.10 0.01 0.00 1.00 0.00 0.00 64.86 64.31 2ghi h ILE 113 Cb 0.83 2.39 -0.00 0.00 -0.74 0.00 0.00 36.82 39.30 2ghi h ILE 113 CO -0.33 0.64 0.03 -0.07 0.00 0.00 0.00 178.15 178.41 2ghi h LEU 114 N 0.19 0.00 -1.50 1.44 3.38 -0.51 -1.26 115.31 117.05 2ghi h LEU 114 Ca -0.09 0.00 0.14 0.00 0.09 0.00 0.00 57.88 58.02 2ghi h LEU 114 Cb 1.45 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.18 2ghi h LEU 114 CO 0.16 0.00 0.72 1.88 0.09 0.00 0.00 178.44 181.29 2ghi h TYR 115 N 0.00 0.00 -0.03 1.13 0.05 -1.19 -1.47 116.97 115.46 2ghi h TYR 115 Ca 0.01 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.68 2ghi h TYR 115 Cb 0.06 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.79 2ghi h TYR 115 CO 0.00 0.00 -0.52 0.78 -1.05 0.00 0.00 178.16 177.37 2ghi h GLY 116 N 0.00 0.09 -6.00 3.88 0.00 -1.44 -3.42 103.07 96.19 2ghi h GLY 116 Ca 0.24 -0.10 0.15 0.00 0.00 0.00 0.00 47.33 47.61 2ghi h GLY 116 CO -0.00 0.09 -0.13 1.25 0.00 0.00 0.00 176.54 177.75 2ghi s LYS 117 N -3.87 0.35 0.51 4.80 2.20 -0.59 -3.65 119.74 119.49 2ghi s LYS 117 Ca -0.03 0.46 0.23 0.00 -0.36 0.00 0.00 55.97 56.27 2ghi s LYS 117 Cb 0.13 0.23 1.36 0.00 -1.51 0.00 0.00 37.83 38.04 2ghi s LYS 117 CO 0.76 -0.53 2.08 -0.07 -0.36 0.00 0.00 175.35 177.23 2ghi h LEU 118 N 7.78 0.00 -3.99 5.43 3.38 -1.72 -2.39 115.31 123.81 2ghi h LEU 118 Ca -0.11 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.35 2ghi h LEU 118 Cb 1.18 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 41.62 2ghi h LEU 118 CO 0.04 0.12 0.66 -0.90 0.09 0.00 0.00 178.44 178.44 2ghi n ASP 119 N -3.92 3.79 -4.76 -0.43 5.75 -1.26 -4.99 116.55 110.74 2ghi n ASP 119 Ca -0.02 -3.60 -0.40 0.00 -0.01 0.00 0.00 54.79 50.75 2ghi n ASP 119 Cb 0.21 -0.84 -0.05 0.00 -1.03 0.00 0.00 41.12 39.42 2ghi n ASP 119 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2ghi s ALA 120 N -3.28 3.39 0.00 2.12 0.00 -0.90 -5.14 121.76 117.95 2ghi s ALA 120 Ca 0.57 0.84 0.00 0.00 0.00 0.00 0.00 51.96 53.37 2ghi s ALA 120 Cb 0.48 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 20.29 2ghi s ALA 120 CO 0.11 -0.10 0.00 0.25 0.00 0.00 0.00 175.76 176.02 2ghi n THR 121 N 1.32 0.00 0.00 0.00 -2.24 -1.26 -4.83 114.28 107.27 2ghi n THR 121 Ca -0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 2ghi n THR 121 Cb 0.45 -0.66 0.00 0.00 -2.10 0.00 0.00 70.33 68.02 2ghi n THR 121 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2ghi n GLU 123 N 0.00 0.00 -0.36 -0.78 0.00 -1.26 -2.94 120.64 115.30 2ghi n GLU 123 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 57.16 57.13 2ghi n GLU 123 Cb 0.00 -0.44 0.10 0.00 0.00 0.00 0.00 31.44 31.10 2ghi n GLU 123 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 2ghi h GLU 124 N 0.00 1.28 -0.06 3.44 5.08 -2.00 -2.66 114.58 119.66 2ghi h GLU 124 Ca 0.00 -0.10 0.03 0.00 -1.00 0.00 0.00 59.36 58.30 2ghi h GLU 124 Cb 0.00 -0.28 -0.04 0.00 0.50 0.00 0.00 28.75 28.93 2ghi h GLU 124 CO 0.00 0.87 -0.19 0.28 -1.00 0.00 0.00 179.01 178.98 2ghi h VAL 125 N 1.31 0.54 -0.49 3.13 2.07 -1.85 -1.23 116.25 119.73 2ghi h VAL 125 Ca 0.35 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.84 2ghi h VAL 125 Cb -0.10 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.18 2ghi h VAL 125 CO -0.07 0.00 0.20 0.40 0.02 0.00 0.00 177.57 178.12 2ghi h ILE 126 N -0.27 1.18 0.50 4.57 2.04 -1.83 0.27 117.51 123.96 2ghi h ILE 126 Ca 0.08 -0.56 -0.02 0.00 1.00 0.00 0.00 64.86 65.35 2ghi h ILE 126 Cb 0.38 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 2ghi h ILE 126 CO -0.22 0.22 -0.24 0.50 0.00 0.00 0.00 178.15 178.41 2ghi h LYS 127 N 0.69 -0.64 -0.28 2.37 3.64 -1.34 0.50 116.57 121.51 2ghi h LYS 127 Ca 0.17 0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.65 2ghi h LYS 127 Cb 0.13 0.15 -0.05 0.00 -0.41 0.00 0.00 32.23 32.05 2ghi h LYS 127 CO -0.02 -0.37 -0.05 0.00 -2.27 0.00 0.00 179.45 176.74 2ghi h ALA 128 N -0.35 0.20 -0.30 5.00 0.00 -0.70 -1.01 119.26 122.10 2ghi h ALA 128 Ca -0.07 0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 2ghi h ALA 128 Cb 0.57 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2ghi h ALA 128 CO 0.11 -0.45 -0.22 1.79 0.00 0.00 0.00 179.25 180.48 2ghi h THR 129 N 0.02 1.26 -0.25 0.00 1.35 -0.53 -0.69 112.91 114.07 2ghi h THR 129 Ca 0.13 -1.25 -0.02 0.00 -0.55 0.00 0.00 66.41 64.73 2ghi h THR 129 Cb 0.20 1.27 -0.01 0.00 -1.73 0.00 0.00 68.15 67.87 2ghi h THR 129 CO -0.27 0.40 0.08 0.11 -0.25 0.00 0.00 175.52 175.59 2ghi h LYS 130 N 0.51 0.39 -0.31 4.72 1.57 -0.69 0.68 116.57 123.43 2ghi h LYS 130 Ca 0.08 -0.08 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2ghi h LYS 130 Cb 0.65 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.89 2ghi h LYS 130 CO 0.05 0.46 0.07 0.77 -0.57 0.00 0.00 179.45 180.23 2ghi h SER 131 N 0.24 0.41 -0.00 0.86 0.02 -1.03 -2.12 113.55 111.92 2ghi h SER 131 Ca 0.08 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 2ghi h SER 131 Cb 0.23 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.67 2ghi h SER 131 CO -0.00 0.43 0.00 0.00 -1.14 0.00 0.00 176.83 176.11 2ghi n ALA 132 N -2.48 2.67 -3.74 3.77 0.00 -0.28 -3.91 120.51 116.54 2ghi n ALA 132 Ca 0.01 -0.21 -0.27 0.00 0.00 0.00 0.00 53.44 52.98 2ghi n ALA 132 Cb 0.18 -1.46 0.05 0.00 0.00 0.00 0.00 19.45 18.22 2ghi n ALA 132 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2ghi n GLN 133 N -0.87 -6.76 0.00 0.00 1.13 -0.80 -4.81 117.38 105.27 2ghi n GLN 133 Ca 0.22 0.72 0.00 0.00 -1.94 0.00 0.00 57.00 56.00 2ghi n GLN 133 Cb 0.12 -5.69 0.00 0.00 0.11 0.00 0.00 30.24 24.79 2ghi n GLN 133 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2ghi n LEU 134 N -4.82 1.03 -0.00 1.08 4.77 0.20 -4.76 117.00 114.49 2ghi n LEU 134 Ca 0.01 -1.03 -0.12 0.00 -0.03 0.00 0.00 56.01 54.84 2ghi n LEU 134 Cb 0.55 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.57 2ghi n LEU 134 CO 0.70 0.26 0.81 0.22 -1.33 0.00 0.00 177.39 178.04 2ghi h TYR 135 N 0.00 0.10 -0.19 -1.77 5.03 -1.78 -1.10 116.97 117.26 2ghi h TYR 135 Ca 0.00 -0.01 -0.06 0.00 2.58 0.00 0.00 58.73 61.24 2ghi h TYR 135 Cb 0.26 -0.03 -0.00 0.00 1.55 0.00 0.00 36.73 38.51 2ghi h TYR 135 CO 0.00 0.23 -0.13 -0.44 -1.32 0.00 0.00 178.16 176.51 2ghi h ASP 136 N -0.07 0.45 -0.64 -2.11 3.32 -1.90 -1.86 116.42 113.61 2ghi h ASP 136 Ca 0.02 -0.44 0.13 0.00 0.02 0.00 0.00 57.03 56.77 2ghi h ASP 136 Cb 0.18 -0.12 -0.11 0.00 0.22 0.00 0.00 39.33 39.50 2ghi h ASP 136 CO -0.00 0.79 0.01 0.15 -1.72 0.00 0.00 179.24 178.47 2ghi h PHE 137 N 0.11 -0.02 -0.18 4.55 3.57 -1.86 -1.52 116.94 121.59 2ghi h PHE 137 Ca 0.04 0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 2ghi h PHE 137 Cb 0.64 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 2ghi h PHE 137 CO 0.07 -0.16 -0.17 0.82 -2.23 0.00 0.00 178.31 176.64 2ghi h ILE 138 N 0.13 1.21 -0.01 1.41 2.04 -0.69 -2.93 117.51 118.66 2ghi h ILE 138 Ca 0.34 -0.96 -0.10 0.00 1.00 0.00 0.00 64.86 65.14 2ghi h ILE 138 Cb 0.55 1.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.88 2ghi h ILE 138 CO -0.54 0.30 -0.44 -0.33 0.00 0.00 0.00 178.15 177.14 2ghi h GLU 139 N 0.29 0.03 -0.00 2.37 4.39 -0.48 -2.94 114.58 118.23 2ghi h GLU 139 Ca 0.05 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.74 2ghi h GLU 139 Cb 0.47 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 2ghi h GLU 139 CO 0.03 0.47 -0.05 0.00 -1.16 0.00 0.00 179.01 178.30 2ghi n ALA 140 N -2.46 2.66 -1.70 3.43 0.00 -0.95 -4.78 120.51 116.72 2ghi n ALA 140 Ca -0.02 -0.24 -0.34 0.00 0.00 0.00 0.00 53.44 52.85 2ghi n ALA 140 Cb 0.47 -1.40 0.01 0.00 0.00 0.00 0.00 19.45 18.53 2ghi n ALA 140 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2ghi s LEU 141 N -2.33 3.63 0.57 0.00 1.43 -1.11 -4.93 118.68 115.94 2ghi s LEU 141 Ca 0.35 2.02 0.26 0.00 -1.03 0.00 0.00 54.13 55.72 2ghi s LEU 141 Cb 0.21 -4.56 1.56 0.00 0.03 0.00 0.00 46.19 43.42 2ghi s LEU 141 CO 0.43 -1.22 2.11 -0.65 0.23 0.00 0.00 176.35 177.25 2ghi h PRO 142 N 0.84 0.00 0.00 1.29 0.11 -1.91 -2.68 132.00 129.65 2ghi h PRO 142 Ca -0.49 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.55 2ghi h PRO 142 Cb 1.24 0.00 -0.16 0.00 0.11 0.00 0.00 31.00 32.19 2ghi h PRO 142 CO 0.57 0.00 -0.67 1.63 -0.21 0.00 0.00 178.00 179.32 2ghi n LYS 143 N -4.04 0.72 0.00 1.05 5.02 -1.26 -5.02 118.16 114.63 2ghi n LYS 143 Ca 0.02 -2.43 0.00 0.00 -2.02 0.00 0.00 58.31 53.88 2ghi n LYS 143 Cb 0.31 -0.81 0.00 0.00 -0.02 0.00 0.00 35.03 34.51 2ghi n LYS 143 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2ghi n LYS 144 N -0.36 0.00 0.29 1.97 5.02 -1.01 -1.10 118.16 122.97 2ghi n LYS 144 Ca 0.11 0.00 0.17 0.00 -2.02 0.00 0.00 58.31 56.57 2ghi n LYS 144 Cb 0.87 0.00 0.88 0.00 -0.02 0.00 0.00 35.03 36.77 2ghi n LYS 144 CO 0.00 0.00 0.00 -1.49 -0.52 0.00 0.00 177.40 175.39 2ghi h TRP 145 N 0.00 0.00 -0.56 2.13 4.06 -1.94 -2.08 115.95 117.56 2ghi h TRP 145 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2ghi h TRP 145 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.16 2ghi h TRP 145 CO 0.00 0.05 0.00 -0.25 -3.56 0.00 0.00 178.44 174.68 2ghi n ASP 146 N -3.35 3.51 -4.71 -3.49 9.92 -0.26 -2.18 116.55 115.99 2ghi n ASP 146 Ca -0.02 -2.17 -0.42 0.00 -0.53 0.00 0.00 54.79 51.66 2ghi n ASP 146 Cb 0.19 -0.45 -0.03 0.00 -0.64 0.00 0.00 41.12 40.19 2ghi n ASP 146 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 2ghi s THR 147 N -1.48 2.71 0.02 -3.53 2.01 -0.79 -4.78 115.64 109.80 2ghi s THR 147 Ca 0.40 0.39 -0.30 0.00 0.31 0.00 0.00 61.69 62.49 2ghi s THR 147 Cb 0.23 -3.25 -0.04 0.00 0.01 0.00 0.00 72.50 69.45 2ghi s THR 147 CO 0.23 0.02 1.13 -0.63 -0.69 0.00 0.00 174.62 174.68 2ghi s ILE 148 N 1.81 4.33 -0.03 1.82 -1.09 -1.26 -0.08 121.20 126.69 2ghi s ILE 148 Ca 0.73 1.67 0.00 0.00 -2.23 0.00 0.00 60.65 60.81 2ghi s ILE 148 Cb -0.43 -4.07 -0.02 0.00 -1.58 0.00 0.00 42.46 36.36 2ghi s ILE 148 CO 0.32 0.10 -0.03 1.33 -1.23 0.00 0.00 174.94 175.43 2ghi n VAL 149 N 4.06 0.20 0.00 2.92 0.24 0.38 -2.03 118.33 124.10 2ghi n VAL 149 Ca 0.08 -0.07 0.00 0.00 -2.04 0.00 0.00 64.34 62.31 2ghi n VAL 149 Cb 0.48 -0.67 0.00 0.00 -1.47 0.00 0.00 33.84 32.18 2ghi n VAL 149 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2ghi n GLY 150 N 3.31 0.00 5.21 7.63 0.00 -1.03 -3.63 105.19 116.68 2ghi n GLY 150 Ca -0.06 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.01 2ghi n GLY 150 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ghi n GLY 153 N 0.00 -1.43 3.76 -0.02 0.00 -1.26 -4.80 105.19 101.44 2ghi n GLY 153 Ca 0.00 -1.13 -0.38 0.00 0.00 0.00 0.00 46.02 44.50 2ghi n GLY 153 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2ghi s MET 154 N -0.60 3.69 0.08 1.61 0.23 -0.86 -5.07 119.30 118.38 2ghi s MET 154 Ca 0.00 2.02 0.08 0.00 -1.03 0.00 0.00 55.69 56.76 2ghi s MET 154 Cb 0.00 -2.50 -0.03 0.00 -1.53 0.00 0.00 34.83 30.77 2ghi s MET 154 CO 0.00 -0.68 -0.20 0.15 -2.03 0.00 0.00 175.02 172.26 2ghi s LYS 155 N -2.57 1.16 0.00 3.16 3.01 -1.26 -4.35 119.74 118.89 2ghi s LYS 155 Ca 0.63 -1.07 0.00 0.00 -1.01 0.00 0.00 55.97 54.52 2ghi s LYS 155 Cb -0.35 -1.35 0.00 0.00 -1.01 0.00 0.00 37.83 35.12 2ghi s LYS 155 CO 0.43 0.32 0.00 -0.11 0.51 0.00 0.00 175.35 176.50 2ghi n LEU 156 N 1.35 0.00 0.00 3.17 7.94 -1.26 -5.19 117.00 123.01 2ghi n LEU 156 Ca -0.19 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.71 2ghi n LEU 156 Cb 0.54 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.49 2ghi n LEU 156 CO 0.22 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.11 2ghi n GLY 159 N 2.18 0.00 0.13 -3.96 0.00 -1.26 -4.70 105.19 97.58 2ghi n GLY 159 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 2ghi n GLY 159 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2ghi h GLU 160 N 0.00 0.18 -0.43 1.61 3.07 -2.00 -3.03 114.58 113.98 2ghi h GLU 160 Ca 0.00 -0.17 0.04 0.00 -0.50 0.00 0.00 59.36 58.73 2ghi h GLU 160 Cb 0.00 0.04 -0.04 0.00 -0.84 0.00 0.00 28.75 27.91 2ghi h GLU 160 CO 0.00 0.88 0.20 0.00 -1.40 0.00 0.00 179.01 178.69 2ghi h ARG 161 N 0.11 0.38 0.00 2.33 3.08 -1.96 -1.98 114.38 116.34 2ghi h ARG 161 Ca -0.03 -0.02 -0.15 0.00 0.07 0.00 0.00 59.98 59.84 2ghi h ARG 161 Cb 1.40 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 31.34 2ghi h ARG 161 CO 0.12 0.25 -0.73 0.37 -1.07 0.00 0.00 179.97 178.92 2ghi h GLN 162 N 0.40 0.00 0.00 0.04 4.15 -1.93 -2.58 115.11 115.19 2ghi h GLN 162 Ca 0.19 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.53 2ghi h GLN 162 Cb 0.13 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.80 2ghi h GLN 162 CO -0.15 0.73 -0.39 0.00 -1.93 0.00 0.00 178.83 177.09 2ghi h ARG 163 N 0.00 0.00 -0.21 1.69 3.08 -1.41 -1.60 114.38 115.93 2ghi h ARG 163 Ca -0.01 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.92 2ghi h ARG 163 Cb 1.38 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.42 2ghi h ARG 163 CO 0.09 0.39 -0.40 0.82 -1.07 0.00 0.00 179.97 179.80 2ghi h ILE 164 N 0.00 1.30 -0.19 2.04 2.04 -1.05 -0.78 117.51 120.88 2ghi h ILE 164 Ca -0.00 -1.54 -0.17 0.00 1.00 0.00 0.00 64.86 64.15 2ghi h ILE 164 Cb 0.76 1.57 -0.00 0.00 -0.74 0.00 0.00 36.82 38.41 2ghi h ILE 164 CO 0.05 0.48 -0.56 0.00 0.00 0.00 0.00 178.15 178.12 2ghi h ALA 165 N 1.18 0.66 -0.32 1.87 0.00 -1.06 -1.31 119.26 120.28 2ghi h ALA 165 Ca 0.04 -0.52 -0.09 0.00 0.00 0.00 0.00 54.91 54.33 2ghi h ALA 165 Cb 0.87 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2ghi h ALA 165 CO 0.07 0.69 -0.16 0.82 0.00 0.00 0.00 179.25 180.67 2ghi h ILE 166 N 0.45 1.29 -0.24 0.00 2.04 -1.12 -1.46 117.51 118.47 2ghi h ILE 166 Ca 0.01 -1.28 0.04 0.00 1.00 0.00 0.00 64.86 64.63 2ghi h ILE 166 Cb 1.12 1.44 -0.04 0.00 -0.74 0.00 0.00 36.82 38.59 2ghi h ILE 166 CO 0.11 0.41 -0.00 0.00 0.00 0.00 0.00 178.15 178.67 2ghi h ALA 167 N 0.76 0.21 -0.58 1.87 0.00 -0.99 0.45 119.26 120.98 2ghi h ALA 167 Ca 0.07 0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.09 2ghi h ALA 167 Cb 0.70 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 2ghi h ALA 167 CO 0.05 -0.42 0.33 0.00 0.00 0.00 0.00 179.25 179.21 2ghi h ARG 168 N 0.07 0.62 -0.51 0.00 3.08 -1.24 -1.00 114.38 115.39 2ghi h ARG 168 Ca 0.12 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 2ghi h ARG 168 Cb 0.15 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 2ghi h ARG 168 CO -0.20 0.41 0.27 0.00 -1.07 0.00 0.00 179.97 179.38 2ghi h LEU 170 N 0.68 0.95 -0.80 0.00 3.38 -0.54 -2.58 115.31 116.40 2ghi h LEU 170 Ca 0.18 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 58.00 2ghi h LEU 170 Cb 0.07 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 2ghi h LEU 170 CO -0.03 0.74 -0.04 -0.07 0.09 0.00 0.00 178.44 179.14 2ghi h LEU 171 N 1.08 0.84 -1.00 1.67 3.38 -0.28 -2.58 115.31 118.41 2ghi h LEU 171 Ca 0.28 -0.23 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 2ghi h LEU 171 Cb -0.02 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 2ghi h LEU 171 CO -0.05 0.93 0.27 0.50 0.09 0.00 0.00 178.44 180.18 2ghi h LYS 172 N 0.79 0.98 -3.86 1.13 3.64 -1.15 -3.44 116.57 114.66 2ghi h LYS 172 Ca 0.14 -0.16 -0.17 0.00 -1.27 0.00 0.00 60.65 59.19 2ghi h LYS 172 Cb 0.53 -0.17 0.09 0.00 -0.41 0.00 0.00 32.23 32.26 2ghi h LYS 172 CO 0.03 0.80 -0.39 -3.47 -2.27 0.00 0.00 179.45 174.15 2ghi n ASP 173 N -4.30 -2.05 -4.75 4.20 2.03 -0.98 -5.03 116.55 105.67 2ghi n ASP 173 Ca 0.06 -0.32 -0.30 0.00 0.52 0.00 0.00 54.79 54.75 2ghi n ASP 173 Cb 0.17 -2.86 0.12 0.00 -0.72 0.00 0.00 41.12 37.83 2ghi n ASP 173 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2ghi s PRO 174 N -4.71 1.64 0.00 -0.67 0.04 -1.26 -4.95 135.00 125.10 2ghi s PRO 174 Ca 0.00 0.82 0.21 0.00 0.04 0.00 0.00 61.00 62.08 2ghi s PRO 174 Cb -0.00 -1.85 -0.17 0.00 0.04 0.00 0.00 34.50 32.51 2ghi s PRO 174 CO 0.37 -1.97 0.95 1.63 0.04 0.00 0.00 177.00 178.02 2ghi n LYS 175 N -3.70 0.25 -4.52 4.56 4.76 0.59 -4.84 118.16 115.26 2ghi n LYS 175 Ca 0.07 -0.21 -0.22 0.00 -2.87 0.00 0.00 58.31 55.08 2ghi n LYS 175 Cb 0.55 -1.50 -0.16 0.00 -1.84 0.00 0.00 35.03 32.09 2ghi n LYS 175 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2ghi s ILE 176 N -2.89 0.98 -0.12 -0.18 1.01 -0.72 -0.90 121.20 118.38 2ghi s ILE 176 Ca 0.10 -0.45 0.03 0.00 0.00 0.00 0.00 60.65 60.33 2ghi s ILE 176 Cb 0.16 -0.87 0.01 0.00 0.01 0.00 0.00 42.46 41.77 2ghi s ILE 176 CO 0.81 0.30 -0.20 -0.69 0.00 0.00 0.00 174.94 175.16 2ghi s VAL 177 N 0.27 1.84 -0.31 2.92 1.01 -0.07 -0.56 120.40 125.50 2ghi s VAL 177 Ca -0.06 -0.86 -0.10 0.00 0.00 0.00 0.00 61.98 60.96 2ghi s VAL 177 Cb -0.11 -1.63 -0.02 0.00 0.00 0.00 0.00 36.38 34.62 2ghi s VAL 177 CO 0.01 0.51 0.17 -0.63 0.00 0.00 0.00 175.10 175.16 2ghi s ILE 178 N 0.76 4.84 -0.25 2.22 1.01 0.10 0.07 121.20 129.95 2ghi s ILE 178 Ca -0.10 -0.27 0.01 0.00 0.00 0.00 0.00 60.65 60.29 2ghi s ILE 178 Cb -0.16 -3.43 0.05 0.00 0.01 0.00 0.00 42.46 38.93 2ghi s ILE 178 CO 0.01 0.10 -0.09 0.12 0.00 0.00 0.00 174.94 175.07 2ghi s PHE 179 N 1.66 3.17 -0.83 3.97 5.36 0.19 -0.43 117.98 131.06 2ghi s PHE 179 Ca 0.05 -2.02 -0.16 0.00 -0.96 0.00 0.00 56.93 53.85 2ghi s PHE 179 Cb -0.17 -1.98 0.18 0.00 -0.34 0.00 0.00 43.02 40.71 2ghi s PHE 179 CO 0.08 -0.83 0.87 0.34 -1.46 0.00 0.00 175.22 174.21 2ghi s ASP 180 N 1.19 6.65 0.48 6.13 -1.08 0.15 -0.84 116.67 129.35 2ghi s ASP 180 Ca -0.05 -2.35 -0.23 0.00 -0.52 0.00 0.00 52.55 49.41 2ghi s ASP 180 Cb -0.18 -2.28 -0.07 0.00 -1.46 0.00 0.00 42.92 38.93 2ghi s ASP 180 CO -0.05 -0.79 1.22 -1.83 0.52 0.00 0.00 175.17 174.24 2ghi s GLU 181 N 1.24 3.60 -0.32 4.34 4.04 -1.15 -3.63 118.70 126.81 2ghi s GLU 181 Ca 0.22 1.92 0.18 0.00 0.04 0.00 0.00 54.97 57.32 2ghi s GLU 181 Cb -0.10 -2.38 0.46 0.00 0.02 0.00 0.00 34.13 32.12 2ghi s GLU 181 CO -0.07 -0.73 0.96 0.00 -1.84 0.00 0.00 175.26 173.58 2ghi n ALA 182 N -0.61 3.31 1.26 -0.84 0.00 -1.26 -4.68 120.51 117.69 2ghi n ALA 182 Ca 0.08 -3.07 0.13 0.00 0.00 0.00 0.00 53.44 50.57 2ghi n ALA 182 Cb 0.47 -0.94 0.34 0.00 0.00 0.00 0.00 19.45 19.32 2ghi n ALA 182 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2ghi n THR 183 N -0.07 0.00 0.23 0.00 -2.24 -1.26 -4.40 114.28 106.55 2ghi n THR 183 Ca 0.09 -0.21 0.07 0.00 -2.27 0.00 0.00 64.05 61.73 2ghi n THR 183 Cb 0.82 0.63 0.56 0.00 -2.10 0.00 0.00 70.33 70.24 2ghi n THR 183 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2ghi h SER 184 N 1.98 0.00 -0.45 3.42 0.02 -1.99 -2.81 113.55 113.72 2ghi h SER 184 Ca 0.00 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.84 2ghi h SER 184 Cb 0.58 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.06 2ghi h SER 184 CO 0.00 0.18 0.08 -1.54 -1.14 0.00 0.00 176.83 174.41 2ghi n SER 185 N -4.09 4.03 -4.85 3.07 3.41 -1.26 -4.95 113.62 108.98 2ghi n SER 185 Ca -0.02 -3.23 -0.31 0.00 -0.26 0.00 0.00 58.87 55.05 2ghi n SER 185 Cb 0.26 -0.64 -0.05 0.00 -0.26 0.00 0.00 64.21 63.52 2ghi n SER 185 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2ghi s LEU 186 N -2.97 4.08 0.85 1.04 1.43 -1.06 -4.96 118.68 117.09 2ghi s LEU 186 Ca 0.48 0.14 -0.09 0.00 -1.03 0.00 0.00 54.13 53.62 2ghi s LEU 186 Cb 0.39 -2.70 0.16 0.00 0.03 0.00 0.00 46.19 44.07 2ghi s LEU 186 CO 0.09 0.18 1.17 1.51 0.23 0.00 0.00 176.35 179.53 2ghi s ASP 187 N -2.41 3.74 0.22 2.29 -4.77 -1.26 -4.87 116.67 109.62 2ghi s ASP 187 Ca 0.32 0.04 0.02 0.00 -3.30 0.00 0.00 52.55 49.62 2ghi s ASP 187 Cb -0.13 -0.26 0.22 0.00 -1.09 0.00 0.00 42.92 41.66 2ghi s ASP 187 CO 0.24 -2.30 1.55 0.77 0.70 0.00 0.00 175.17 176.14 2ghi h SER 188 N -1.12 0.41 -0.10 2.11 4.64 -1.99 -1.29 113.55 116.20 2ghi h SER 188 Ca -0.41 -0.22 -0.23 0.00 -0.47 0.00 0.00 61.79 60.46 2ghi h SER 188 Cb 1.25 -0.12 0.01 0.00 -0.31 0.00 0.00 62.40 63.24 2ghi h SER 188 CO 0.41 0.88 -0.83 0.11 -0.87 0.00 0.00 176.83 176.54 2ghi h LYS 189 N 0.28 0.74 -0.35 4.77 6.56 -1.99 -1.97 116.57 124.61 2ghi h LYS 189 Ca 0.00 -0.66 -0.08 0.00 -1.06 0.00 0.00 60.65 58.85 2ghi h LYS 189 Cb 1.06 0.15 -0.02 0.00 -0.57 0.00 0.00 32.23 32.86 2ghi h LYS 189 CO 0.09 1.26 -0.13 0.00 -2.06 0.00 0.00 179.45 178.62 2ghi h THR 190 N 0.45 1.25 -0.15 -0.16 1.03 -1.94 -2.53 112.91 110.85 2ghi h THR 190 Ca -0.07 -1.11 -0.01 0.00 -0.01 0.00 0.00 66.41 65.21 2ghi h THR 190 Cb 1.47 1.11 -0.01 0.00 -1.07 0.00 0.00 68.15 69.65 2ghi h THR 190 CO 0.17 0.37 0.07 -0.33 -0.01 0.00 0.00 175.52 175.78 2ghi h GLU 191 N 0.57 0.22 -1.01 0.00 5.08 -1.23 -1.07 114.58 117.14 2ghi h GLU 191 Ca 0.10 -0.04 0.24 0.00 -1.00 0.00 0.00 59.36 58.66 2ghi h GLU 191 Cb 0.55 -0.04 -0.11 0.00 0.50 0.00 0.00 28.75 29.65 2ghi h GLU 191 CO 0.03 0.29 0.62 0.10 -1.00 0.00 0.00 179.01 179.05 2ghi h TYR 192 N 0.11 0.92 -0.17 4.33 -0.00 -1.05 -0.50 116.97 120.62 2ghi h TYR 192 Ca 0.05 0.03 -0.17 0.00 -0.00 0.00 0.00 58.73 58.64 2ghi h TYR 192 Cb 0.14 -0.27 -0.00 0.00 -0.00 0.00 0.00 36.73 36.60 2ghi h TYR 192 CO -0.02 0.11 -0.61 -0.07 -0.00 0.00 0.00 178.16 177.57 2ghi h LEU 193 N 0.57 0.64 -0.80 0.10 4.07 -0.98 -2.27 115.31 116.64 2ghi h LEU 193 Ca 0.61 -0.36 -0.07 0.00 0.08 0.00 0.00 57.88 58.13 2ghi h LEU 193 Cb 1.22 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 42.75 2ghi h LEU 193 CO -0.40 1.10 0.07 -0.26 -1.08 0.00 0.00 178.44 177.87 2ghi h PHE 194 N 0.42 1.03 0.00 1.13 0.05 -0.19 -0.66 116.94 118.72 2ghi h PHE 194 Ca -0.01 -0.14 -0.07 0.00 3.82 0.00 0.00 57.97 61.58 2ghi h PHE 194 Cb 1.17 -0.28 -0.01 0.00 2.00 0.00 0.00 35.95 38.83 2ghi h PHE 194 CO 0.05 0.89 -0.32 1.96 -0.18 0.00 0.00 178.31 180.71 2ghi h GLN 195 N 0.91 0.00 0.20 1.51 4.20 -0.80 -0.49 115.11 120.64 2ghi h GLN 195 Ca 0.18 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.56 2ghi h GLN 195 Cb 0.43 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.23 2ghi h GLN 195 CO 0.01 0.32 -1.52 0.87 -0.67 0.00 0.00 178.83 177.84 2ghi h LYS 196 N 0.00 0.43 -0.93 1.46 6.56 -1.12 -2.67 116.57 120.30 2ghi h LYS 196 Ca -0.00 -0.73 0.12 0.00 -1.06 0.00 0.00 60.65 58.97 2ghi h LYS 196 Cb 0.77 0.27 -0.07 0.00 -0.57 0.00 0.00 32.23 32.63 2ghi h LYS 196 CO 0.04 1.33 0.60 0.00 -2.06 0.00 0.00 179.45 179.36 2ghi h ALA 197 N 0.26 1.64 0.04 3.86 0.00 -1.00 -2.95 119.26 121.09 2ghi h ALA 197 Ca -0.26 0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.42 2ghi h ALA 197 Cb 2.10 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.71 2ghi h ALA 197 CO 0.23 0.15 -1.02 0.28 0.00 0.00 0.00 179.25 178.88 2ghi h VAL 198 N 0.89 1.43 -0.01 0.00 2.07 -1.15 -2.55 116.25 116.92 2ghi h VAL 198 Ca 0.45 -2.62 -0.09 0.00 0.82 0.00 0.00 66.70 65.26 2ghi h VAL 198 Cb 0.50 2.56 -0.01 0.00 -1.52 0.00 0.00 31.29 32.82 2ghi h VAL 198 CO -0.21 0.78 -0.41 -0.33 0.02 0.00 0.00 177.57 177.41 2ghi h GLU 199 N 0.18 0.03 0.00 1.57 5.08 -1.50 -0.26 114.58 119.68 2ghi h GLU 199 Ca -0.09 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2ghi h GLU 199 Cb 1.68 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.93 2ghi h GLU 199 CO 0.17 0.43 0.00 -0.44 -1.00 0.00 0.00 179.01 178.18 2ghi h ASP 200 N 0.03 0.00 0.23 1.42 5.19 -1.53 -3.25 116.42 118.51 2ghi h ASP 200 Ca -0.00 0.00 -0.34 0.00 -0.62 0.00 0.00 57.03 56.07 2ghi h ASP 200 Cb 0.73 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 40.19 2ghi h ASP 200 CO 0.05 0.00 -2.06 -0.11 -3.12 0.00 0.00 179.24 174.01 2ghi n LEU 201 N -2.39 1.01 0.06 1.55 7.94 -0.96 -4.20 117.00 119.99 2ghi n LEU 201 Ca 0.05 0.19 0.05 0.00 -1.11 0.00 0.00 56.01 55.19 2ghi n LEU 201 Cb 0.43 0.01 0.47 0.00 0.53 0.00 0.00 43.42 44.87 2ghi n LEU 201 CO 0.30 0.54 1.14 -0.09 -1.11 0.00 0.00 177.39 178.18 2ghi h ARG 202 N 0.01 0.42 -6.43 1.96 2.43 -1.10 -3.44 114.38 108.23 2ghi h ARG 202 Ca -0.42 -0.03 -0.56 0.00 -0.81 0.00 0.00 59.98 58.16 2ghi h ARG 202 Cb 2.09 -0.09 0.04 0.00 -0.42 0.00 0.00 29.97 31.58 2ghi h ARG 202 CO 0.05 0.28 1.06 1.63 -1.51 0.00 0.00 179.97 181.47 2ghi n LYS 203 N -4.49 2.52 -2.54 0.20 5.02 -1.23 -3.24 118.16 114.41 2ghi n LYS 203 Ca 0.02 0.92 -0.14 0.00 -2.02 0.00 0.00 58.31 57.08 2ghi n LYS 203 Cb 0.07 -2.78 0.01 0.00 -0.02 0.00 0.00 35.03 32.31 2ghi n LYS 203 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2ghi n ASN 204 N 5.65 -4.44 -3.67 4.39 3.02 -1.26 -4.99 115.26 113.96 2ghi n ASN 204 Ca 0.19 -0.11 -0.12 0.00 -0.03 0.00 0.00 54.58 54.51 2ghi n ASN 204 Cb 0.34 -3.44 -0.06 0.00 -0.61 0.00 0.00 39.78 36.01 2ghi n ASN 204 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2ghi s ARG 205 N -5.03 0.95 -0.11 3.52 0.52 -1.15 -3.85 118.95 113.80 2ghi s ARG 205 Ca 0.11 -0.49 -0.22 0.00 -0.52 0.00 0.00 55.73 54.62 2ghi s ARG 205 Cb -0.05 0.42 -0.03 0.00 0.52 0.00 0.00 34.95 35.81 2ghi s ARG 205 CO 0.14 -0.34 0.64 0.99 0.02 0.00 0.00 175.30 176.75 2ghi s THR 206 N -2.90 5.06 -0.20 0.02 2.01 -0.08 -4.09 115.64 115.47 2ghi s THR 206 Ca -0.03 1.29 -0.02 0.00 0.31 0.00 0.00 61.69 63.24 2ghi s THR 206 Cb 0.00 -3.97 0.01 0.00 0.01 0.00 0.00 72.50 68.54 2ghi s THR 206 CO -0.05 0.22 -0.12 -0.22 -0.69 0.00 0.00 174.62 173.76 2ghi s LEU 207 N 1.10 2.54 -0.22 4.42 2.96 -0.19 -0.89 118.68 128.39 2ghi s LEU 207 Ca 0.33 -0.52 -0.08 0.00 -0.22 0.00 0.00 54.13 53.64 2ghi s LEU 207 Cb -0.17 -1.62 -0.04 0.00 0.50 0.00 0.00 46.19 44.87 2ghi s LEU 207 CO 0.14 -0.01 0.08 -0.63 -1.32 0.00 0.00 176.35 174.61 2ghi s ILE 208 N 1.39 4.64 -0.24 6.68 1.01 0.11 -0.22 121.20 134.57 2ghi s ILE 208 Ca 0.05 -0.07 -0.04 0.00 0.00 0.00 0.00 60.65 60.59 2ghi s ILE 208 Cb -0.14 -3.14 -0.00 0.00 0.01 0.00 0.00 42.46 39.20 2ghi s ILE 208 CO -0.08 0.38 -0.03 -0.63 0.00 0.00 0.00 174.94 174.59 2ghi s ILE 209 N 1.07 3.40 -0.44 2.92 1.01 0.54 0.55 121.20 130.25 2ghi s ILE 209 Ca 0.05 -0.60 -0.26 0.00 0.00 0.00 0.00 60.65 59.84 2ghi s ILE 209 Cb -0.14 -2.61 0.02 0.00 0.01 0.00 0.00 42.46 39.75 2ghi s ILE 209 CO 0.03 0.34 0.94 -0.63 0.00 0.00 0.00 174.94 175.62 2ghi s ILE 210 N 1.46 4.48 -0.03 2.92 1.01 -0.02 0.52 121.20 131.54 2ghi s ILE 210 Ca 0.04 0.87 0.02 0.00 0.00 0.00 0.00 60.65 61.58 2ghi s ILE 210 Cb -0.15 -4.43 -0.03 0.00 0.01 0.00 0.00 42.46 37.86 2ghi s ILE 210 CO -0.02 -0.79 -0.08 0.00 0.00 0.00 0.00 174.94 174.05 2ghi s ALA 211 N 3.75 2.95 -0.13 9.38 0.00 -0.20 -2.92 121.76 134.59 2ghi s ALA 211 Ca 0.38 -0.96 -0.08 0.00 0.00 0.00 0.00 51.96 51.30 2ghi s ALA 211 Cb -0.10 -1.14 -0.06 0.00 0.00 0.00 0.00 23.12 21.82 2ghi s ALA 211 CO 0.25 0.59 -0.19 0.72 0.00 0.00 0.00 175.76 177.13 2ghi n HIS 212 N 1.93 0.00 -2.97 0.00 8.25 -1.26 -4.48 115.22 116.69 2ghi n HIS 212 Ca -0.17 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.87 2ghi n HIS 212 Cb 0.53 -0.48 -0.05 0.00 1.12 0.00 0.00 29.99 31.11 2ghi n HIS 212 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2ghi s ARG 213 N -2.30 3.60 0.65 -0.41 1.81 -1.26 -4.94 118.95 116.10 2ghi s ARG 213 Ca -0.19 0.12 0.37 0.00 -1.72 0.00 0.00 55.73 54.30 2ghi s ARG 213 Cb 0.07 -3.86 2.04 0.00 -0.45 0.00 0.00 34.95 32.75 2ghi s ARG 213 CO 0.25 -0.95 2.19 -0.07 -0.68 0.00 0.00 175.30 176.04 2ghi h LEU 214 N 9.87 0.00 -0.59 2.53 4.07 -1.91 -1.84 115.31 127.45 2ghi h LEU 214 Ca -0.25 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.68 2ghi h LEU 214 Cb 1.09 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.83 2ghi h LEU 214 CO 0.92 0.00 -0.15 0.77 -1.08 0.00 0.00 178.44 178.91 2ghi h SER 215 N 0.00 0.00 0.30 -0.43 4.64 -1.92 -2.41 113.55 113.74 2ghi h SER 215 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2ghi h SER 215 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 2ghi h SER 215 CO -0.00 0.15 0.00 0.41 -0.87 0.00 0.00 176.83 176.52 2ghi n THR 216 N -3.19 1.07 -0.25 2.95 -1.04 -0.69 -3.65 114.28 109.49 2ghi n THR 216 Ca 0.02 0.49 0.00 0.00 -2.04 0.00 0.00 64.05 62.52 2ghi n THR 216 Cb 0.49 -1.45 0.00 0.00 -1.82 0.00 0.00 70.33 67.56 2ghi n THR 216 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 2ghi n ILE 217 N -2.11 0.00 0.28 12.58 -0.00 -0.92 -4.74 119.36 124.45 2ghi n ILE 217 Ca 0.00 -0.36 0.18 0.00 -0.00 0.00 0.00 62.75 62.58 2ghi n ILE 217 Cb 0.11 1.25 0.92 0.00 -0.00 0.00 0.00 39.64 41.92 2ghi n ILE 217 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.55 177.32 2ghi h SER 218 N 0.00 0.00 -0.44 4.38 4.64 -1.59 0.37 113.55 120.91 2ghi h SER 218 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ghi h SER 218 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 2ghi h SER 218 CO 0.00 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.42 2ghi n SER 219 N -2.77 3.48 -4.76 4.97 3.41 -1.26 -4.45 113.62 112.24 2ghi n SER 219 Ca -0.02 -1.97 -0.37 0.00 -0.26 0.00 0.00 58.87 56.25 2ghi n SER 219 Cb 0.09 -0.29 0.02 0.00 -0.26 0.00 0.00 64.21 63.78 2ghi n SER 219 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ghi s ALA 220 N -1.32 2.71 0.30 7.33 0.00 0.12 -4.93 121.76 125.96 2ghi s ALA 220 Ca 0.39 1.03 0.11 0.00 0.00 0.00 0.00 51.96 53.49 2ghi s ALA 220 Cb 0.22 -3.45 0.47 0.00 0.00 0.00 0.00 23.12 20.36 2ghi s ALA 220 CO 0.30 -1.04 1.68 0.93 0.00 0.00 0.00 175.76 177.63 2ghi h GLU 221 N 1.30 0.00 -3.13 0.00 5.08 -1.76 -3.43 114.58 112.65 2ghi h GLU 221 Ca -0.50 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 57.68 2ghi h GLU 221 Cb 1.28 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 30.26 2ghi h GLU 221 CO 0.57 0.54 -0.46 -1.54 -1.00 0.00 0.00 179.01 177.12 2ghi s SER 222 N -6.86 -0.25 -0.14 1.42 1.04 -1.16 -4.52 113.70 103.24 2ghi s SER 222 Ca -0.02 0.48 -0.03 0.00 0.48 0.00 0.00 55.95 56.87 2ghi s SER 222 Cb 0.13 0.45 -0.03 0.00 0.10 0.00 0.00 66.02 66.68 2ghi s SER 222 CO 0.75 -0.11 -0.05 -0.63 0.98 0.00 0.00 173.24 174.18 2ghi s ILE 223 N 0.46 3.80 -0.26 -1.02 1.01 0.11 -1.84 121.20 123.45 2ghi s ILE 223 Ca -0.03 -0.40 -0.03 0.00 0.00 0.00 0.00 60.65 60.19 2ghi s ILE 223 Cb -0.04 -2.64 0.02 0.00 0.01 0.00 0.00 42.46 39.81 2ghi s ILE 223 CO -0.02 0.52 -0.02 -0.63 0.00 0.00 0.00 174.94 174.78 2ghi s ILE 224 N 0.14 3.18 -0.25 2.92 1.01 0.26 -2.10 121.20 126.35 2ghi s ILE 224 Ca -0.02 -0.95 -0.14 0.00 0.00 0.00 0.00 60.65 59.54 2ghi s ILE 224 Cb -0.14 -2.63 -0.04 0.00 0.01 0.00 0.00 42.46 39.66 2ghi s ILE 224 CO 0.03 0.15 0.33 -0.22 0.00 0.00 0.00 174.94 175.24 2ghi s LEU 225 N 1.37 4.08 -0.00 2.97 2.96 -0.69 -0.48 118.68 128.89 2ghi s LEU 225 Ca 0.01 0.31 0.01 0.00 -0.22 0.00 0.00 54.13 54.23 2ghi s LEU 225 Cb -0.17 -2.38 -0.04 0.00 0.50 0.00 0.00 46.19 44.10 2ghi s LEU 225 CO -0.02 -0.10 0.01 -0.76 -1.32 0.00 0.00 176.35 174.15 2ghi s LEU 226 N 1.67 3.56 -0.10 -0.68 1.43 0.06 -1.21 118.68 123.41 2ghi s LEU 226 Ca 0.14 0.01 -0.03 0.00 -1.03 0.00 0.00 54.13 53.23 2ghi s LEU 226 Cb -0.15 -2.04 0.04 0.00 0.03 0.00 0.00 46.19 44.07 2ghi s LEU 226 CO 0.09 0.28 0.06 0.21 0.23 0.00 0.00 176.35 177.22 2ghi s ASN 227 N -1.56 1.74 -1.44 2.29 3.84 0.10 -4.27 114.94 115.64 2ghi s ASN 227 Ca 0.20 -0.24 -0.05 0.00 0.21 0.00 0.00 52.86 52.97 2ghi s ASN 227 Cb -0.12 -0.26 0.05 0.00 -0.55 0.00 0.00 41.25 40.38 2ghi s ASN 227 CO 0.10 -0.28 0.13 0.29 -2.79 0.00 0.00 177.10 174.56 2ghi n LYS 228 N 5.25 -0.90 -0.07 0.43 4.76 -1.26 -2.37 118.16 124.00 2ghi n LYS 228 Ca -0.05 0.09 0.00 0.00 -2.87 0.00 0.00 58.31 55.48 2ghi n LYS 228 Cb 0.49 -3.41 0.00 0.00 -1.84 0.00 0.00 35.03 30.28 2ghi n LYS 228 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2ghi n GLY 229 N -2.05 0.48 3.27 0.72 0.00 -0.57 -4.89 105.19 102.14 2ghi n GLY 229 Ca -0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.55 2ghi n GLY 229 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ghi s LYS 230 N -0.88 1.62 -0.10 1.61 2.20 -1.00 -0.45 119.74 122.75 2ghi s LYS 230 Ca 0.00 -0.92 -0.30 0.00 -0.36 0.00 0.00 55.97 54.40 2ghi s LYS 230 Cb 0.00 -1.68 -0.02 0.00 -1.51 0.00 0.00 37.83 34.62 2ghi s LYS 230 CO 0.00 0.44 1.07 0.42 -0.36 0.00 0.00 175.35 176.92 2ghi s ILE 231 N -0.69 4.63 -0.16 5.43 1.01 -1.26 -0.72 121.20 129.43 2ghi s ILE 231 Ca 0.09 1.91 -0.00 0.00 0.00 0.00 0.00 60.65 62.65 2ghi s ILE 231 Cb -0.09 -4.23 -0.10 0.00 0.01 0.00 0.00 42.46 38.05 2ghi s ILE 231 CO 0.01 -0.01 -0.15 1.33 0.00 0.00 0.00 174.94 176.12 2ghi n VAL 232 N 4.63 0.91 -4.37 2.92 0.24 -0.35 -4.95 118.33 117.35 2ghi n VAL 232 Ca 0.10 -0.33 -0.19 0.00 -2.04 0.00 0.00 64.34 61.87 2ghi n VAL 232 Cb 0.48 -1.14 -0.14 0.00 -1.47 0.00 0.00 33.84 31.57 2ghi n VAL 232 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2ghi s GLU 233 N -2.32 0.86 -0.03 7.34 2.02 -1.24 -5.06 118.70 120.27 2ghi s GLU 233 Ca -0.22 -0.59 -0.02 0.00 0.02 0.00 0.00 54.97 54.16 2ghi s GLU 233 Cb 0.06 -0.83 0.02 0.00 0.10 0.00 0.00 34.13 33.47 2ghi s GLU 233 CO 0.36 0.21 0.08 0.21 0.02 0.00 0.00 175.26 176.14 2ghi s LYS 234 N -0.79 0.06 0.00 1.61 2.20 -1.26 -1.71 119.74 119.85 2ghi s LYS 234 Ca 0.02 0.18 0.00 0.00 -0.36 0.00 0.00 55.97 55.80 2ghi s LYS 234 Cb -0.06 -0.07 0.00 0.00 -1.51 0.00 0.00 37.83 36.18 2ghi s LYS 234 CO 0.00 -0.08 0.00 0.41 -0.36 0.00 0.00 175.35 175.33 2ghi n GLY 235 N 3.55 -0.95 3.80 5.54 0.00 -0.89 -4.96 105.19 111.28 2ghi n GLY 235 Ca -0.19 -1.30 -0.30 0.00 0.00 0.00 0.00 46.02 44.24 2ghi n GLY 235 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ghi s THR 236 N -2.90 3.09 0.21 2.61 -4.23 -1.26 0.04 115.64 113.20 2ghi s THR 236 Ca 0.00 0.35 -0.10 0.00 -1.18 0.00 0.00 61.69 60.76 2ghi s THR 236 Cb 0.00 -3.09 0.15 0.00 1.34 0.00 0.00 72.50 70.90 2ghi s THR 236 CO 0.00 -0.46 1.87 -0.74 -0.54 0.00 0.00 174.62 174.75 2ghi h HIS 237 N -1.08 0.90 0.03 3.99 2.76 -1.82 0.15 115.15 120.09 2ghi h HIS 237 Ca -0.47 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 57.72 2ghi h HIS 237 Cb 1.27 -0.30 0.00 0.00 1.55 0.00 0.00 27.41 29.92 2ghi h HIS 237 CO 0.47 0.55 -0.02 0.87 -1.30 0.00 0.00 177.93 178.51 2ghi h LYS 238 N 0.96 -0.04 -0.43 5.26 6.56 -1.92 -1.18 116.57 125.77 2ghi h LYS 238 Ca 0.28 0.00 0.07 0.00 -1.06 0.00 0.00 60.65 59.93 2ghi h LYS 238 Cb -0.07 0.01 -0.06 0.00 -0.57 0.00 0.00 32.23 31.54 2ghi h LYS 238 CO -0.07 0.23 0.11 -0.44 -2.06 0.00 0.00 179.45 177.21 2ghi h ASP 239 N -0.31 0.06 0.21 0.86 3.32 -1.94 -1.11 116.42 117.52 2ghi h ASP 239 Ca -0.00 0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.08 2ghi h ASP 239 Cb 0.29 0.08 -0.00 0.00 0.22 0.00 0.00 39.33 39.91 2ghi h ASP 239 CO 0.01 0.06 -0.16 -0.07 -1.72 0.00 0.00 179.24 177.36 2ghi h LEU 240 N 0.25 0.00 0.15 1.55 3.38 -0.64 -0.72 115.31 119.28 2ghi h LEU 240 Ca 0.21 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.89 2ghi h LEU 240 Cb 0.24 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.00 2ghi h LEU 240 CO -0.26 0.16 -1.36 -0.07 0.09 0.00 0.00 178.44 177.01 2ghi h LEU 241 N 0.00 0.49 -0.73 1.67 3.38 -0.95 -3.30 115.31 115.87 2ghi h LEU 241 Ca -0.00 -0.56 -0.06 0.00 0.09 0.00 0.00 57.88 57.36 2ghi h LEU 241 Cb 0.32 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 2ghi h LEU 241 CO 0.02 1.44 0.24 0.50 0.09 0.00 0.00 178.44 180.73 2ghi h LYS 242 N 0.09 1.13 -0.16 1.13 3.64 -0.84 -1.76 116.57 119.80 2ghi h LYS 242 Ca -0.18 -0.24 0.05 0.00 -1.27 0.00 0.00 60.65 59.01 2ghi h LYS 242 Cb 2.02 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 33.67 2ghi h LYS 242 CO 0.21 0.96 0.47 1.25 -2.27 0.00 0.00 179.45 180.07 2ghi h LEU 243 N 1.07 0.00 -1.63 5.20 5.85 -1.21 -3.46 115.31 121.13 2ghi h LEU 243 Ca 0.24 0.00 -0.58 0.00 0.84 0.00 0.00 57.88 58.38 2ghi h LEU 243 Cb 0.29 0.00 -0.21 0.00 0.37 0.00 0.00 40.66 41.11 2ghi h LEU 243 CO -0.01 0.00 -0.91 -3.20 -0.34 0.00 0.00 178.44 173.98 2ghi n ASN 244 N -3.10 -0.92 0.00 1.25 4.05 -0.66 -4.94 115.26 110.95 2ghi n ASN 244 Ca 0.02 -1.15 0.00 0.00 0.45 0.00 0.00 54.58 53.90 2ghi n ASN 244 Cb 0.56 -2.20 0.00 0.00 1.23 0.00 0.00 39.78 39.37 2ghi n ASN 244 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2ghi n GLY 245 N -1.85 1.96 0.28 8.20 0.00 -1.26 -4.89 105.19 107.63 2ghi n GLY 245 Ca -0.14 -0.18 -0.10 0.00 0.00 0.00 0.00 46.02 45.61 2ghi n GLY 245 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2ghi h GLU 246 N 0.00 0.98 0.20 1.61 4.39 -1.92 -0.66 114.58 119.18 2ghi h GLU 246 Ca 0.00 -0.34 -0.01 0.00 0.34 0.00 0.00 59.36 59.35 2ghi h GLU 246 Cb 0.00 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.58 2ghi h GLU 246 CO 0.00 1.01 -0.09 -0.92 -1.16 0.00 0.00 179.01 177.85 2ghi h TYR 247 N 0.85 -0.25 -0.90 4.33 3.20 -1.96 -0.80 116.97 121.45 2ghi h TYR 247 Ca 0.14 -0.01 0.24 0.00 3.14 0.00 0.00 58.73 62.25 2ghi h TYR 247 Cb 0.61 0.08 -0.14 0.00 1.54 0.00 0.00 36.73 38.82 2ghi h TYR 247 CO 0.04 0.12 0.29 0.00 -1.64 0.00 0.00 178.16 176.98 2ghi h ALA 248 N 0.00 1.37 -0.22 1.82 0.00 -1.67 0.23 119.26 120.81 2ghi h ALA 248 Ca -0.03 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2ghi h ALA 248 Cb 0.48 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2ghi h ALA 248 CO 0.04 -0.47 0.13 1.49 0.00 0.00 0.00 179.25 180.45 2ghi h GLU 249 N 0.24 0.29 -0.43 0.00 4.57 -0.95 0.14 114.58 118.43 2ghi h GLU 249 Ca 0.57 -0.02 0.01 0.00 -1.18 0.00 0.00 59.36 58.75 2ghi h GLU 249 Cb 1.17 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 29.68 2ghi h GLU 249 CO -0.64 0.22 0.27 0.52 -1.18 0.00 0.00 179.01 178.20 2ghi h MET 250 N 0.27 0.52 -0.31 1.92 2.86 0.25 -2.02 114.93 118.42 2ghi h MET 250 Ca 0.08 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.70 2ghi h MET 250 Cb 0.00 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.52 2ghi h MET 250 CO -0.02 0.35 0.17 2.35 1.06 0.00 0.00 176.91 180.82 2ghi h TRP 251 N 0.54 0.32 -0.08 -0.22 2.91 -0.43 0.64 115.95 119.63 2ghi h TRP 251 Ca 0.17 0.01 -0.11 0.00 1.13 0.00 0.00 58.89 60.09 2ghi h TRP 251 Cb -0.01 -0.10 -0.01 0.00 -0.51 0.00 0.00 29.16 28.52 2ghi h TRP 251 CO -0.06 0.19 -0.45 -0.91 -1.03 0.00 0.00 178.44 176.17 2ghi h ASN 252 N 0.36 0.21 0.54 2.65 2.35 -0.56 -2.85 115.58 118.28 2ghi h ASN 252 Ca 0.12 -0.10 -0.03 0.00 -0.55 0.00 0.00 56.30 55.75 2ghi h ASN 252 Cb 0.01 -0.06 0.01 0.00 0.05 0.00 0.00 38.32 38.32 2ghi h ASN 252 CO -0.06 0.64 -0.26 0.24 -1.65 0.00 0.00 177.43 176.34 2ghi h MET 253 N 0.17 -0.70 0.00 0.81 2.86 -1.18 -3.51 114.93 113.37 2ghi h MET 253 Ca 0.01 0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2ghi h MET 253 Cb 0.87 0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.68 2ghi h MET 253 CO 0.07 -0.47 0.00 1.04 1.06 0.00 0.00 176.91 178.61