#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ihi n HIS 22 N 0.00 2.51 0.18 -0.14 -0.00 -1.26 -4.89 115.22 111.62 3ihi n HIS 22 Ca 0.00 0.09 0.14 0.00 0.46 0.00 0.00 57.72 58.42 3ihi n HIS 22 Cb 0.00 -2.63 0.72 0.00 -0.12 0.00 0.00 29.99 27.96 3ihi n HIS 22 CO 0.00 0.00 0.00 0.78 0.46 0.00 0.00 176.34 177.58 3ihi h GLY 23 N 6.90 0.00 2.00 1.57 0.00 -1.98 -1.43 103.07 110.13 3ihi h GLY 23 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 3ihi h GLY 23 CO 0.93 0.00 0.00 -2.09 0.00 0.00 0.00 176.54 175.38 3ihi h GLU 24 N 0.00 0.00 -0.06 4.80 4.81 -1.96 -2.68 114.58 119.50 3ihi h GLU 24 Ca 0.09 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.28 3ihi h GLU 24 Cb 0.40 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 3ihi h GLU 24 CO -0.00 0.00 -0.16 -0.07 -0.73 0.00 0.00 179.01 178.04 3ihi h LEU 25 N 0.00 0.08 -0.74 1.64 3.38 -1.63 -1.67 115.31 116.36 3ihi h LEU 25 Ca 0.00 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.01 3ihi h LEU 25 Cb 0.47 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.15 3ihi h LEU 25 CO 0.00 0.26 0.45 1.56 0.09 0.00 0.00 178.44 180.79 3ihi h GLN 26 N 0.08 0.81 -0.33 1.13 4.20 -1.67 -0.37 115.11 118.96 3ihi h GLN 26 Ca 0.02 -0.05 -0.09 0.00 0.06 0.00 0.00 58.65 58.59 3ihi h GLN 26 Cb 0.34 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 3ihi h GLN 26 CO 0.02 0.54 -0.15 -0.92 -0.67 0.00 0.00 178.83 177.65 3ihi h TYR 27 N 0.83 0.79 -0.71 2.96 3.20 -1.49 -1.52 116.97 121.03 3ihi h TYR 27 Ca 0.32 -0.19 -0.02 0.00 3.14 0.00 0.00 58.73 61.98 3ihi h TYR 27 Cb 0.13 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.18 3ihi h TYR 27 CO -0.05 0.89 0.38 -0.07 -1.64 0.00 0.00 178.16 177.67 3ihi h LEU 28 N 0.46 0.89 -1.06 2.82 3.38 -1.27 -0.91 115.31 119.62 3ihi h LEU 28 Ca 0.07 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 3ihi h LEU 28 Cb 0.68 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 3ihi h LEU 28 CO 0.05 0.74 -0.18 0.03 0.09 0.00 0.00 178.44 179.16 3ihi h ARG 29 N 0.97 0.46 -0.33 1.13 3.08 -0.94 -1.81 114.38 116.94 3ihi h ARG 29 Ca 0.25 -0.15 0.03 0.00 0.07 0.00 0.00 59.98 60.18 3ihi h ARG 29 Cb 0.05 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.03 3ihi h ARG 29 CO -0.04 0.63 0.14 1.96 -1.07 0.00 0.00 179.97 181.59 3ihi h GLN 30 N 0.42 0.30 -0.28 0.04 4.20 -0.71 0.56 115.11 119.63 3ihi h GLN 30 Ca 0.07 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.76 3ihi h GLN 30 Cb 0.56 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 3ihi h GLN 30 CO 0.04 0.20 0.16 0.28 -0.67 0.00 0.00 178.83 178.84 3ihi h VAL 31 N 0.31 1.11 -0.74 -0.54 2.07 -0.94 -1.84 116.25 115.67 3ihi h VAL 31 Ca 0.14 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 3ihi h VAL 31 Cb 0.08 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 3ihi h VAL 31 CO -0.12 0.11 0.33 1.05 0.02 0.00 0.00 177.57 178.96 3ihi h GLU 32 N 0.35 1.08 -0.40 1.57 4.11 -1.19 -1.19 114.58 118.90 3ihi h GLU 32 Ca 0.10 -0.17 0.05 0.00 0.07 0.00 0.00 59.36 59.41 3ihi h GLU 32 Cb 0.04 -0.19 -0.05 0.00 0.50 0.00 0.00 28.75 29.05 3ihi h GLU 32 CO -0.02 0.86 0.13 1.25 0.07 0.00 0.00 179.01 181.30 3ihi h HIS 33 N 1.07 0.23 -0.66 2.06 2.76 -0.60 -1.00 115.15 119.01 3ihi h HIS 33 Ca 0.25 0.02 -0.08 0.00 -2.20 0.00 0.00 60.37 58.36 3ihi h HIS 33 Cb 0.16 -0.04 -0.03 0.00 1.55 0.00 0.00 27.41 29.05 3ihi h HIS 33 CO 0.01 0.08 0.10 0.82 -1.30 0.00 0.00 177.93 177.65 3ihi h ILE 34 N 0.29 1.26 -0.49 6.26 2.04 -0.95 0.31 117.51 126.23 3ihi h ILE 34 Ca 0.19 -1.04 -0.08 0.00 1.00 0.00 0.00 64.86 64.93 3ihi h ILE 34 Cb 0.18 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 3ihi h ILE 34 CO -0.20 0.39 -0.01 -0.07 0.00 0.00 0.00 178.15 178.25 3ihi h LEU 35 N 1.02 0.79 0.16 1.44 3.38 -0.68 0.59 115.31 122.01 3ihi h LEU 35 Ca 0.20 -0.20 -0.21 0.00 0.09 0.00 0.00 57.88 57.76 3ihi h LEU 35 Cb 0.44 -0.21 0.02 0.00 0.09 0.00 0.00 40.66 41.00 3ihi h LEU 35 CO 0.01 0.87 -0.92 -0.09 0.09 0.00 0.00 178.44 178.40 3ihi h ARG 36 N 0.76 0.33 -0.00 1.13 2.43 -1.04 -3.41 114.38 114.58 3ihi h ARG 36 Ca 0.14 -0.56 0.00 0.00 -0.81 0.00 0.00 59.98 58.75 3ihi h ARG 36 Cb 0.48 0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.24 3ihi h ARG 36 CO 0.02 1.27 -0.04 0.00 -1.51 0.00 0.00 179.97 179.71 3ihi s GLY 38 N -0.70 1.75 -0.01 0.00 0.00 0.20 -4.98 107.32 103.59 3ihi s GLY 38 Ca 0.01 0.24 -0.00 0.00 0.00 0.00 0.00 44.72 44.98 3ihi s GLY 38 CO 0.05 0.57 0.07 -1.36 0.00 0.00 0.00 173.10 172.44 3ihi s PHE 39 N -2.86 3.27 0.39 1.90 0.40 -0.60 -4.69 117.98 115.79 3ihi s PHE 39 Ca 0.61 0.20 -0.27 0.00 -0.60 0.00 0.00 56.93 56.86 3ihi s PHE 39 Cb -0.16 -1.73 -0.11 0.00 0.51 0.00 0.00 43.02 41.53 3ihi s PHE 39 CO 0.53 0.54 1.47 1.17 0.70 0.00 0.00 175.22 179.63 3ihi n LYS 40 N 1.22 2.58 -3.65 0.44 0.00 -1.26 -1.34 118.16 116.14 3ihi n LYS 40 Ca -0.13 0.91 -0.12 0.00 0.00 0.00 0.00 58.31 58.96 3ihi n LYS 40 Cb 0.53 -2.65 -0.08 0.00 0.00 0.00 0.00 35.03 32.83 3ihi n LYS 40 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 3ihi s LYS 41 N -2.16 0.73 0.28 1.64 2.20 -0.49 -4.92 119.74 117.03 3ihi s LYS 41 Ca 0.55 0.96 -0.05 0.00 -0.36 0.00 0.00 55.97 57.07 3ihi s LYS 41 Cb -0.47 0.31 -0.05 0.00 -1.51 0.00 0.00 37.83 36.10 3ihi s LYS 41 CO 0.63 -0.11 0.54 -1.21 -0.36 0.00 0.00 175.35 174.84 3ihi s GLU 42 N 0.65 3.62 0.00 4.03 2.02 -1.26 -0.93 118.70 126.83 3ihi s GLU 42 Ca -0.02 -0.02 0.00 0.00 0.02 0.00 0.00 54.97 54.94 3ihi s GLU 42 Cb -0.05 -2.66 0.00 0.00 0.10 0.00 0.00 34.13 31.52 3ihi s GLU 42 CO -0.04 0.23 0.00 -0.40 0.02 0.00 0.00 175.26 175.07 3ihi n ASP 43 N -0.92 0.00 0.23 -0.19 5.68 -0.63 -4.93 116.55 115.79 3ihi n ASP 43 Ca -0.02 -0.53 0.09 0.00 -0.50 0.00 0.00 54.79 53.83 3ihi n ASP 43 Cb 0.54 0.00 0.55 0.00 -1.14 0.00 0.00 41.12 41.07 3ihi n ASP 43 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 3ihi h ARG 44 N 0.00 0.00 -0.23 0.11 3.08 -2.00 -1.00 114.38 114.34 3ihi h ARG 44 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3ihi h ARG 44 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3ihi h ARG 44 CO 0.00 0.22 0.00 0.25 -1.07 0.00 0.00 179.97 179.37 3ihi n THR 45 N -3.67 0.29 -1.34 2.04 -2.24 -1.26 -4.91 114.28 103.20 3ihi n THR 45 Ca -0.01 -0.43 -0.10 0.00 -2.27 0.00 0.00 64.05 61.24 3ihi n THR 45 Cb 0.34 0.45 -0.04 0.00 -2.10 0.00 0.00 70.33 68.99 3ihi n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ihi n GLY 46 N 1.19 1.04 3.87 3.38 0.00 -0.38 -5.03 105.19 109.26 3ihi n GLY 46 Ca 0.16 -0.59 -0.36 0.00 0.00 0.00 0.00 46.02 45.24 3ihi n GLY 46 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3ihi s THR 47 N -2.36 5.18 0.32 2.61 -1.32 -1.26 -4.81 115.64 114.00 3ihi s THR 47 Ca 0.00 0.42 -0.18 0.00 -1.21 0.00 0.00 61.69 60.72 3ihi s THR 47 Cb 0.00 -3.61 -0.09 0.00 -1.51 0.00 0.00 72.50 67.28 3ihi s THR 47 CO 0.00 0.40 0.80 -0.83 -2.21 0.00 0.00 174.62 172.78 3ihi s GLY 48 N -1.53 2.45 0.20 6.08 0.00 -1.26 -1.60 107.32 111.65 3ihi s GLY 48 Ca 0.28 0.19 0.02 0.00 0.00 0.00 0.00 44.72 45.21 3ihi s GLY 48 CO 0.15 0.47 0.03 -0.51 0.00 0.00 0.00 173.10 173.24 3ihi s THR 49 N -1.89 0.66 -0.12 0.90 -4.23 -0.10 -2.43 115.64 108.43 3ihi s THR 49 Ca 0.53 -1.99 -0.04 0.00 -1.18 0.00 0.00 61.69 59.01 3ihi s THR 49 Cb -0.12 -2.28 -0.03 0.00 1.34 0.00 0.00 72.50 71.40 3ihi s THR 49 CO 0.18 -0.33 0.03 -0.76 -0.54 0.00 0.00 174.62 173.20 3ihi s LEU 50 N -3.22 3.70 0.02 4.79 1.43 -0.34 -1.39 118.68 123.67 3ihi s LEU 50 Ca 0.28 0.15 0.00 0.00 -1.03 0.00 0.00 54.13 53.54 3ihi s LEU 50 Cb 0.06 -1.88 -0.01 0.00 0.03 0.00 0.00 46.19 44.40 3ihi s LEU 50 CO 0.07 0.32 -0.03 -0.55 0.23 0.00 0.00 176.35 176.39 3ihi s SER 51 N -0.54 0.28 0.00 2.29 0.15 -0.45 -0.64 113.70 114.79 3ihi s SER 51 Ca 0.10 -0.33 0.02 0.00 0.70 0.00 0.00 55.95 56.44 3ihi s SER 51 Cb -0.12 0.05 -0.01 0.00 -1.71 0.00 0.00 66.02 64.23 3ihi s SER 51 CO 0.02 -0.17 -0.07 -0.69 1.20 0.00 0.00 173.24 173.53 3ihi s VAL 52 N -0.91 0.57 -0.28 4.45 1.01 -0.47 -1.55 120.40 123.21 3ihi s VAL 52 Ca -0.09 -0.39 -0.10 0.00 0.00 0.00 0.00 61.98 61.40 3ihi s VAL 52 Cb -0.06 -0.50 -0.04 0.00 0.00 0.00 0.00 36.38 35.78 3ihi s VAL 52 CO -0.00 0.11 0.17 0.12 0.00 0.00 0.00 175.10 175.49 3ihi s PHE 53 N -0.29 3.19 0.00 5.22 5.36 -1.26 -1.21 117.98 128.99 3ihi s PHE 53 Ca 0.02 -0.12 0.00 0.00 -0.96 0.00 0.00 56.93 55.87 3ihi s PHE 53 Cb -0.03 -2.36 0.00 0.00 -0.34 0.00 0.00 43.02 40.29 3ihi s PHE 53 CO -0.00 -0.26 0.00 0.41 -1.46 0.00 0.00 175.22 173.91 3ihi n GLY 54 N 5.03 -0.68 3.21 13.12 0.00 -0.01 -5.00 105.19 120.85 3ihi n GLY 54 Ca -0.14 -0.70 -0.10 0.00 0.00 0.00 0.00 46.02 45.07 3ihi n GLY 54 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3ihi s MET 55 N -0.29 1.03 -0.20 1.61 -1.94 -0.93 -4.98 119.30 113.60 3ihi s MET 55 Ca 0.00 -1.41 -0.14 0.00 -1.71 0.00 0.00 55.69 52.43 3ihi s MET 55 Cb 0.00 0.28 0.06 0.00 2.01 0.00 0.00 34.83 37.18 3ihi s MET 55 CO 0.00 -0.32 0.50 -1.14 -0.01 0.00 0.00 175.02 174.05 3ihi s GLN 56 N -4.05 0.53 0.17 2.03 0.74 -1.26 -1.20 119.66 116.63 3ihi s GLN 56 Ca 0.25 0.82 0.06 0.00 0.05 0.00 0.00 55.36 56.54 3ihi s GLN 56 Cb 0.06 0.14 -0.05 0.00 1.10 0.00 0.00 33.01 34.27 3ihi s GLN 56 CO 0.03 -0.12 -0.12 0.00 -0.55 0.00 0.00 175.29 174.54 3ihi s ALA 57 N 0.95 1.67 -0.17 1.58 0.00 -0.47 -4.99 121.76 120.33 3ihi s ALA 57 Ca -0.05 -1.56 0.00 0.00 0.00 0.00 0.00 51.96 50.35 3ihi s ALA 57 Cb -0.06 0.00 0.03 0.00 0.00 0.00 0.00 23.12 23.10 3ihi s ALA 57 CO -0.08 -0.04 -0.11 0.50 0.00 0.00 0.00 175.76 176.03 3ihi s ARG 58 N -3.71 2.02 -0.26 0.00 3.52 -1.26 -0.28 118.95 118.97 3ihi s ARG 58 Ca 0.19 -0.65 -0.06 0.00 -0.13 0.00 0.00 55.73 55.08 3ihi s ARG 58 Cb 0.01 -2.19 -0.00 0.00 -1.56 0.00 0.00 34.95 31.21 3ihi s ARG 58 CO 0.03 -0.34 0.03 0.71 -0.81 0.00 0.00 175.30 174.92 3ihi s TYR 59 N 1.48 3.08 0.35 5.12 2.02 0.62 -4.97 117.35 125.04 3ihi s TYR 59 Ca 0.02 -0.87 -0.28 0.00 -0.37 0.00 0.00 57.07 55.56 3ihi s TYR 59 Cb -0.15 -2.20 -0.11 0.00 -0.40 0.00 0.00 41.96 39.11 3ihi s TYR 59 CO -0.09 -0.53 1.37 0.45 -1.57 0.00 0.00 175.55 175.19 3ihi s SER 60 N 1.51 6.61 0.00 2.29 0.15 -1.26 -0.17 113.70 122.83 3ihi s SER 60 Ca 0.04 2.82 0.13 0.00 0.70 0.00 0.00 55.95 59.65 3ihi s SER 60 Cb -0.16 -2.66 0.28 0.00 -1.71 0.00 0.00 66.02 61.77 3ihi s SER 60 CO 0.01 -0.66 1.17 0.18 1.20 0.00 0.00 173.24 175.14 3ihi n LEU 61 N 0.69 2.78 -4.54 3.45 4.77 0.09 -4.59 117.00 119.65 3ihi n LEU 61 Ca 0.00 -1.62 -0.43 0.00 -0.03 0.00 0.00 56.01 53.94 3ihi n LEU 61 Cb 0.41 -0.18 -0.04 0.00 -2.33 0.00 0.00 43.42 41.28 3ihi n LEU 61 CO 0.61 0.64 0.87 -0.13 -1.33 0.00 0.00 177.39 178.05 3ihi s ARG 62 N -1.06 3.37 -2.04 3.23 0.52 -1.25 -3.73 118.95 118.00 3ihi s ARG 62 Ca 0.24 -0.13 0.00 0.00 -0.52 0.00 0.00 55.73 55.32 3ihi s ARG 62 Cb 0.14 -4.06 0.00 0.00 0.52 0.00 0.00 34.95 31.55 3ihi s ARG 62 CO 0.19 -1.59 0.00 -0.25 0.02 0.00 0.00 175.30 173.67 3ihi n ASP 63 N 7.86 -5.28 -3.60 0.23 8.00 -1.26 -4.93 116.55 117.56 3ihi n ASP 63 Ca 0.04 0.42 -0.08 0.00 0.71 0.00 0.00 54.79 55.87 3ihi n ASP 63 Cb 0.48 -4.64 -0.01 0.00 -0.02 0.00 0.00 41.12 36.92 3ihi n ASP 63 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 3ihi s GLU 64 N -3.89 1.90 -0.07 -1.24 -1.05 -1.24 -4.86 118.70 108.24 3ihi s GLU 64 Ca 0.00 -1.15 -0.01 0.00 -0.15 0.00 0.00 54.97 53.66 3ihi s GLU 64 Cb 0.00 0.60 0.03 0.00 -0.44 0.00 0.00 34.13 34.32 3ihi s GLU 64 CO 0.00 -0.87 -0.02 0.12 0.95 0.00 0.00 175.26 175.45 3ihi s PHE 65 N -3.46 0.76 -1.31 4.83 5.36 0.39 -4.50 117.98 120.05 3ihi s PHE 65 Ca 0.14 -0.23 -0.16 0.00 -0.96 0.00 0.00 56.93 55.72 3ihi s PHE 65 Cb -0.05 -0.80 0.09 0.00 -0.34 0.00 0.00 43.02 41.92 3ihi s PHE 65 CO 0.09 -0.31 1.76 -0.35 -1.46 0.00 0.00 175.22 174.95 3ihi n PRO 66 N 4.84 3.20 -3.64 10.12 -0.04 -1.26 -3.89 135.00 144.33 3ihi n PRO 66 Ca -0.12 -3.30 -0.39 0.00 -0.04 0.00 0.00 63.50 59.65 3ihi n PRO 66 Cb 0.50 -3.36 -0.12 0.00 -0.04 0.00 0.00 33.50 30.49 3ihi n PRO 66 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3ihi s LEU 67 N 3.25 4.19 0.65 1.53 2.96 -1.26 -4.40 118.68 125.60 3ihi s LEU 67 Ca 0.50 -0.55 -0.16 0.00 -0.22 0.00 0.00 54.13 53.70 3ihi s LEU 67 Cb 0.04 -2.02 -0.00 0.00 0.50 0.00 0.00 46.19 44.72 3ihi s LEU 67 CO 0.04 -0.21 1.16 -0.76 -1.32 0.00 0.00 176.35 175.26 3ihi s LEU 68 N 1.62 3.47 0.00 -0.68 1.43 -1.26 -4.70 118.68 118.55 3ihi s LEU 68 Ca 0.05 2.21 0.01 0.00 -1.03 0.00 0.00 54.13 55.37 3ihi s LEU 68 Cb -0.17 -4.58 -0.01 0.00 0.03 0.00 0.00 46.19 41.46 3ihi s LEU 68 CO 0.07 -1.77 0.12 0.35 0.23 0.00 0.00 176.35 175.34 3ihi n THR 69 N -2.21 0.00 0.74 5.49 -2.24 -1.26 -4.32 114.28 110.48 3ihi n THR 69 Ca 0.12 -0.47 0.13 0.00 -2.27 0.00 0.00 64.05 61.56 3ihi n THR 69 Cb 0.51 1.00 0.47 0.00 -2.10 0.00 0.00 70.33 70.21 3ihi n THR 69 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3ihi n THR 70 N -0.90 0.42 -3.70 4.28 -2.24 -1.26 -0.20 114.28 110.67 3ihi n THR 70 Ca 0.00 -0.20 -0.13 0.00 -2.27 0.00 0.00 64.05 61.46 3ihi n THR 70 Cb 0.02 -0.56 -0.09 0.00 -2.10 0.00 0.00 70.33 67.60 3ihi n THR 70 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3ihi s LYS 71 N -3.07 0.54 0.27 -0.78 2.20 -1.26 -4.63 119.74 113.00 3ihi s LYS 71 Ca 0.12 0.71 -0.31 0.00 -0.36 0.00 0.00 55.97 56.13 3ihi s LYS 71 Cb 0.14 0.22 -0.12 0.00 -1.51 0.00 0.00 37.83 36.56 3ihi s LYS 71 CO 0.58 -0.08 1.50 -2.13 -0.36 0.00 0.00 175.35 174.86 3ihi n ARG 72 N 3.10 2.37 -4.06 4.03 0.63 -1.26 -4.76 116.66 116.71 3ihi n ARG 72 Ca -0.15 0.84 -0.33 0.00 -0.92 0.00 0.00 57.85 57.29 3ihi n ARG 72 Cb 0.57 -2.56 -0.07 0.00 0.45 0.00 0.00 32.46 30.84 3ihi n ARG 72 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 3ihi s VAL 73 N -0.01 4.88 -1.33 5.15 1.01 -1.26 -5.03 120.40 123.81 3ihi s VAL 73 Ca 0.66 -0.32 -0.17 0.00 0.00 0.00 0.00 61.98 62.15 3ihi s VAL 73 Cb -0.57 -3.23 0.07 0.00 0.00 0.00 0.00 36.38 32.65 3ihi s VAL 73 CO 0.49 0.37 1.83 0.33 0.00 0.00 0.00 175.10 178.12 3ihi n PHE 74 N 1.23 4.39 -0.18 5.22 7.35 -1.26 -4.81 117.46 129.40 3ihi n PHE 74 Ca -0.13 -2.91 0.02 0.00 -0.76 0.00 0.00 57.45 53.66 3ihi n PHE 74 Cb 0.53 -2.57 0.28 0.00 0.35 0.00 0.00 39.48 38.07 3ihi n PHE 74 CO 0.00 0.00 0.00 2.35 -0.76 0.00 0.00 176.76 178.35 3ihi h TRP 75 N 7.13 0.86 -0.38 -5.13 2.91 -1.99 -1.09 115.95 118.27 3ihi h TRP 75 Ca 0.47 0.02 -0.03 0.00 1.13 0.00 0.00 58.89 60.48 3ihi h TRP 75 Cb 0.81 -0.29 -0.02 0.00 -0.51 0.00 0.00 29.16 29.15 3ihi h TRP 75 CO 1.41 0.54 0.14 -0.22 -1.03 0.00 0.00 178.44 179.28 3ihi h LYS 76 N 0.93 0.58 -0.84 2.65 3.64 -2.00 -0.13 116.57 121.40 3ihi h LYS 76 Ca 0.26 -0.11 -0.03 0.00 -1.27 0.00 0.00 60.65 59.49 3ihi h LYS 76 Cb -0.08 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.61 3ihi h LYS 76 CO -0.06 0.57 0.39 0.78 -2.27 0.00 0.00 179.45 178.86 3ihi h GLY 77 N 0.47 1.30 0.42 5.01 0.00 -1.70 -1.77 103.07 106.80 3ihi h GLY 77 Ca 0.13 -0.66 0.04 0.00 0.00 0.00 0.00 47.33 46.84 3ihi h GLY 77 CO -0.01 0.62 -0.19 -2.08 0.00 0.00 0.00 176.54 174.88 3ihi h VAL 78 N 1.20 0.52 -0.04 4.60 2.07 -0.42 -0.77 116.25 123.41 3ihi h VAL 78 Ca 0.29 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.80 3ihi h VAL 78 Cb 0.14 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 3ihi h VAL 78 CO -0.03 0.00 0.00 0.25 0.02 0.00 0.00 177.57 177.81 3ihi h LEU 79 N -0.26 0.06 -0.86 2.57 5.85 -0.97 -2.38 115.31 119.33 3ihi h LEU 79 Ca 0.09 -0.28 -0.06 0.00 0.84 0.00 0.00 57.88 58.47 3ihi h LEU 79 Cb 0.39 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.37 3ihi h LEU 79 CO -0.25 0.33 0.18 -0.33 -0.34 0.00 0.00 178.44 178.03 3ihi h GLU 80 N -0.20 1.03 -0.61 1.25 4.39 -1.35 -2.16 114.58 116.93 3ihi h GLU 80 Ca 0.01 -0.22 -0.00 0.00 0.34 0.00 0.00 59.36 59.48 3ihi h GLU 80 Cb 0.29 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.76 3ihi h GLU 80 CO 0.00 0.90 0.37 1.49 -1.16 0.00 0.00 179.01 180.61 3ihi h GLU 81 N 0.99 0.84 -0.59 2.33 4.81 -1.05 -1.91 114.58 120.00 3ihi h GLU 81 Ca 0.21 -0.08 -0.10 0.00 -0.13 0.00 0.00 59.36 59.27 3ihi h GLU 81 Cb 0.32 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.50 3ihi h GLU 81 CO -0.00 0.60 -0.01 1.25 -0.73 0.00 0.00 179.01 180.12 3ihi h LEU 82 N 0.83 1.02 -1.11 1.64 5.85 -1.09 -0.88 115.31 121.57 3ihi h LEU 82 Ca 0.22 -0.29 -0.03 0.00 0.84 0.00 0.00 57.88 58.62 3ihi h LEU 82 Cb -0.01 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.71 3ihi h LEU 82 CO -0.04 1.07 0.27 -0.07 -0.34 0.00 0.00 178.44 179.33 3ihi h LEU 83 N 0.95 0.81 -0.35 2.25 3.38 -1.13 -1.24 115.31 119.97 3ihi h LEU 83 Ca 0.17 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 3ihi h LEU 83 Cb 0.56 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 3ihi h LEU 83 CO 0.03 0.71 0.13 -0.25 0.09 0.00 0.00 178.44 179.15 3ihi h TRP 84 N 0.88 0.54 -0.32 1.13 7.01 -1.08 -1.55 115.95 122.55 3ihi h TRP 84 Ca 0.21 -0.05 0.04 0.00 2.11 0.00 0.00 58.89 61.21 3ihi h TRP 84 Cb 0.14 -0.16 -0.04 0.00 -2.10 0.00 0.00 29.16 27.00 3ihi h TRP 84 CO 0.01 0.51 0.09 0.74 -2.79 0.00 0.00 178.44 177.00 3ihi h PHE 85 N 0.41 0.15 -0.53 2.65 0.04 -0.81 -2.79 116.94 116.08 3ihi h PHE 85 Ca 0.11 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.88 3ihi h PHE 85 Cb 0.21 -0.02 -0.03 0.00 2.20 0.00 0.00 35.95 38.31 3ihi h PHE 85 CO 0.00 0.05 0.25 0.82 -0.60 0.00 0.00 178.31 178.83 3ihi h ILE 86 N 0.21 1.18 0.00 -0.55 2.04 -0.89 -0.22 117.51 119.27 3ihi h ILE 86 Ca 0.15 -0.50 0.00 0.00 1.00 0.00 0.00 64.86 65.50 3ihi h ILE 86 Cb 0.14 0.51 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 3ihi h ILE 86 CO -0.18 0.21 0.00 2.29 0.00 0.00 0.00 178.15 180.47 3ihi n LYS 87 N -4.37 0.70 -1.12 2.37 2.85 -0.61 -4.86 118.16 113.10 3ihi n LYS 87 Ca 0.04 0.00 -0.04 0.00 -1.05 0.00 0.00 58.31 57.26 3ihi n LYS 87 Cb 0.13 -1.43 -0.02 0.00 -0.65 0.00 0.00 35.03 33.06 3ihi n LYS 87 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3ihi n GLY 88 N 0.37 0.69 3.77 2.58 0.00 -0.10 -5.01 105.19 107.49 3ihi n GLY 88 Ca 0.14 -0.42 -0.38 0.00 0.00 0.00 0.00 46.02 45.36 3ihi n GLY 88 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ihi s SER 89 N -2.54 6.76 -0.09 1.61 0.15 -1.06 -3.89 113.70 114.63 3ihi s SER 89 Ca 0.00 2.26 0.13 0.00 0.70 0.00 0.00 55.95 59.04 3ihi s SER 89 Cb 0.00 -2.61 0.20 0.00 -1.71 0.00 0.00 66.02 61.89 3ihi s SER 89 CO 0.00 -0.50 1.09 0.35 1.20 0.00 0.00 173.24 175.37 3ihi n THR 90 N 0.31 1.44 -3.53 6.45 -2.24 -1.26 -4.40 114.28 111.05 3ihi n THR 90 Ca 0.03 -1.69 -0.40 0.00 -2.27 0.00 0.00 64.05 59.71 3ihi n THR 90 Cb 0.47 0.02 -0.11 0.00 -2.10 0.00 0.00 70.33 68.61 3ihi n THR 90 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3ihi s ASN 91 N -2.23 6.05 0.49 3.42 3.84 -1.26 -1.86 114.94 123.39 3ihi s ASN 91 Ca 0.22 -0.43 0.13 0.00 0.21 0.00 0.00 52.86 52.99 3ihi s ASN 91 Cb 0.19 -2.14 1.14 0.00 -0.55 0.00 0.00 41.25 39.90 3ihi s ASN 91 CO 0.02 -0.24 2.12 0.00 -2.79 0.00 0.00 177.10 176.21 3ihi h ALA 92 N 8.49 1.90 -0.08 1.71 0.00 -1.17 -1.59 119.26 128.52 3ihi h ALA 92 Ca -0.31 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 3ihi h ALA 92 Cb 1.16 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 3ihi h ALA 92 CO 0.63 0.09 -0.16 0.87 0.00 0.00 0.00 179.25 180.68 3ihi h LYS 93 N 0.15 0.13 0.00 0.00 1.57 -1.90 -0.18 116.57 116.34 3ihi h LYS 93 Ca 0.04 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.75 3ihi h LYS 93 Cb 0.00 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 3ihi h LYS 93 CO -0.01 0.29 -0.23 1.49 -0.57 0.00 0.00 179.45 180.43 3ihi h GLU 94 N 0.12 0.00 0.16 3.15 4.81 -1.67 -1.84 114.58 119.30 3ihi h GLU 94 Ca 0.02 0.00 -0.36 0.00 -0.13 0.00 0.00 59.36 58.89 3ihi h GLU 94 Cb 0.36 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.73 3ihi h GLU 94 CO 0.02 0.23 -1.88 1.25 -0.73 0.00 0.00 179.01 177.90 3ihi h LEU 95 N 0.00 0.52 -1.73 1.64 5.85 -1.50 -3.35 115.31 116.75 3ihi h LEU 95 Ca -0.00 -0.95 0.10 0.00 0.84 0.00 0.00 57.88 57.87 3ihi h LEU 95 Cb 0.69 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.52 3ihi h LEU 95 CO 0.03 1.83 0.37 -1.28 -0.34 0.00 0.00 178.44 179.04 3ihi h SER 96 N 0.09 0.27 0.61 1.25 0.87 -0.87 0.48 113.55 116.25 3ihi h SER 96 Ca -0.38 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.18 3ihi h SER 96 Cb 2.07 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.98 3ihi h SER 96 CO 0.14 0.16 0.00 -1.54 -0.53 0.00 0.00 176.83 175.06 3ihi n SER 97 N -4.46 0.00 -0.61 6.23 3.41 -0.71 0.80 113.62 118.28 3ihi n SER 97 Ca 0.09 0.49 0.13 0.00 -0.26 0.00 0.00 58.87 59.32 3ihi n SER 97 Cb 0.39 -0.50 0.41 0.00 -0.26 0.00 0.00 64.21 64.25 3ihi n SER 97 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3ihi n LYS 98 N -1.50 1.82 -1.04 4.33 4.76 0.15 -4.90 118.16 121.79 3ihi n LYS 98 Ca 0.04 -1.21 0.00 0.00 -2.87 0.00 0.00 58.31 54.27 3ihi n LYS 98 Cb 0.21 -1.45 0.00 0.00 -1.84 0.00 0.00 35.03 31.94 3ihi n LYS 98 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3ihi n GLY 99 N 1.21 0.46 3.14 0.72 0.00 0.24 -5.03 105.19 105.92 3ihi n GLY 99 Ca 0.18 -0.96 -0.35 0.00 0.00 0.00 0.00 46.02 44.89 3ihi n GLY 99 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ihi s VAL 100 N -2.00 3.03 -1.44 1.61 1.01 -1.19 -4.97 120.40 116.45 3ihi s VAL 100 Ca 0.00 -1.74 0.18 0.00 0.00 0.00 0.00 61.98 60.42 3ihi s VAL 100 Cb 0.00 -2.92 0.64 0.00 0.00 0.00 0.00 36.38 34.11 3ihi s VAL 100 CO 0.00 -0.38 1.54 0.54 0.00 0.00 0.00 175.10 176.80 3ihi n ARG 101 N 4.57 3.22 0.26 2.72 3.00 -1.26 -2.90 116.66 126.27 3ihi n ARG 101 Ca -0.07 -2.57 0.14 0.00 -0.01 0.00 0.00 57.85 55.34 3ihi n ARG 101 Cb 0.42 -1.75 0.63 0.00 0.00 0.00 0.00 32.46 31.77 3ihi n ARG 101 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.63 176.79 3ihi h ILE 102 N 3.83 0.33 -0.33 0.55 3.07 -1.95 -2.26 117.51 120.74 3ihi h ILE 102 Ca 0.00 -0.73 0.00 0.00 1.55 0.00 0.00 64.86 65.68 3ihi h ILE 102 Cb 1.22 1.56 0.00 0.00 -0.27 0.00 0.00 36.82 39.32 3ihi h ILE 102 CO 0.15 0.11 0.00 0.79 -1.05 0.00 0.00 178.15 178.15 3ihi n TRP 103 N -3.31 0.42 -0.08 0.16 7.02 -1.26 -4.56 117.44 115.82 3ihi n TRP 103 Ca -0.00 -0.21 -0.12 0.00 -1.02 0.00 0.00 57.50 56.14 3ihi n TRP 103 Cb 0.33 -0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.22 3ihi n TRP 103 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 3ihi h ASP 104 N 4.51 0.90 -0.82 -0.99 3.32 -1.72 -2.76 116.42 118.86 3ihi h ASP 104 Ca 0.00 -0.43 0.01 0.00 0.02 0.00 0.00 57.03 56.63 3ihi h ASP 104 Cb 0.99 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 40.25 3ihi h ASP 104 CO 0.00 1.20 0.54 0.00 -1.72 0.00 0.00 179.24 179.26 3ihi h ALA 105 N 0.83 1.04 0.00 3.45 0.00 -1.80 -2.25 119.26 120.53 3ihi h ALA 105 Ca 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3ihi h ALA 105 Cb 1.01 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3ihi h ALA 105 CO 0.10 0.45 0.00 0.09 0.00 0.00 0.00 179.25 179.88 3ihi n ASN 106 N -4.52 0.69 -0.56 0.00 4.13 -1.05 -2.29 115.26 111.67 3ihi n ASN 106 Ca 0.08 0.69 0.05 0.00 1.68 0.00 0.00 54.58 57.09 3ihi n ASN 106 Cb 0.02 -0.83 0.13 0.00 -1.54 0.00 0.00 39.78 37.55 3ihi n ASN 106 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3ihi n GLY 107 N -0.23 2.36 3.75 7.41 0.00 -0.92 -4.62 105.19 112.95 3ihi n GLY 107 Ca 0.01 -0.34 -0.33 0.00 0.00 0.00 0.00 46.02 45.37 3ihi n GLY 107 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ihi s SER 108 N -0.98 4.63 0.27 1.61 1.04 -0.89 0.52 113.70 119.89 3ihi s SER 108 Ca 0.20 2.08 -0.02 0.00 0.48 0.00 0.00 55.95 58.69 3ihi s SER 108 Cb 0.11 -2.56 0.45 0.00 0.10 0.00 0.00 66.02 64.12 3ihi s SER 108 CO 0.14 -1.96 1.85 -0.09 0.98 0.00 0.00 173.24 174.17 3ihi h ARG 109 N -0.35 1.01 0.12 4.02 9.65 -1.92 -1.19 114.38 125.72 3ihi h ARG 109 Ca -0.46 -0.06 -0.28 0.00 -1.10 0.00 0.00 59.98 58.08 3ihi h ARG 109 Cb 1.26 -0.23 -0.00 0.00 -1.39 0.00 0.00 29.97 29.61 3ihi h ARG 109 CO 0.52 0.67 -1.30 -0.44 2.80 0.00 0.00 179.97 182.21 3ihi h ASP 110 N 1.04 0.39 -0.21 -3.80 3.32 -1.93 -1.78 116.42 113.44 3ihi h ASP 110 Ca 0.45 -0.44 -0.05 0.00 0.02 0.00 0.00 57.03 57.01 3ihi h ASP 110 Cb 0.31 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 3ihi h ASP 110 CO -0.22 1.35 -0.05 0.15 -1.72 0.00 0.00 179.24 178.75 3ihi h PHE 111 N 0.07 0.47 -0.65 4.55 3.57 -1.78 -2.26 116.94 120.91 3ihi h PHE 111 Ca -0.15 -0.10 0.03 0.00 3.53 0.00 0.00 57.97 61.28 3ihi h PHE 111 Cb 1.97 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 40.56 3ihi h PHE 111 CO 0.06 0.66 0.40 -0.07 -2.23 0.00 0.00 178.31 177.12 3ihi h LEU 112 N 0.14 0.64 -0.60 0.59 3.38 -1.24 -2.35 115.31 115.87 3ihi h LEU 112 Ca 0.05 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 3ihi h LEU 112 Cb 0.51 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 3ihi h LEU 112 CO 0.02 0.44 0.31 0.44 0.09 0.00 0.00 178.44 179.74 3ihi h ASP 113 N 0.77 0.77 0.02 -0.43 3.32 -1.31 -0.13 116.42 119.43 3ihi h ASP 113 Ca 0.27 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.21 3ihi h ASP 113 Cb 0.04 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.40 3ihi h ASP 113 CO -0.12 0.66 0.00 -1.54 -1.72 0.00 0.00 179.24 176.52 3ihi n SER 114 N -4.55 0.21 -0.74 6.45 3.41 -0.85 -0.56 113.62 116.98 3ihi n SER 114 Ca 0.04 0.59 0.08 0.00 -0.26 0.00 0.00 58.87 59.32 3ihi n SER 114 Cb 0.10 -0.62 0.12 0.00 -0.26 0.00 0.00 64.21 63.55 3ihi n SER 114 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3ihi n LEU 115 N -1.78 2.68 -0.23 1.04 4.77 -0.73 -4.98 117.00 117.78 3ihi n LEU 115 Ca -0.00 -1.34 -0.03 0.00 -0.03 0.00 0.00 56.01 54.61 3ihi n LEU 115 Cb 0.02 -0.11 -0.01 0.00 -2.33 0.00 0.00 43.42 40.99 3ihi n LEU 115 CO 0.04 0.56 -0.03 0.61 -1.33 0.00 0.00 177.39 177.24 3ihi n GLY 116 N 0.93 0.56 2.82 -0.72 0.00 0.28 -4.97 105.19 104.09 3ihi n GLY 116 Ca 0.12 -0.93 -0.37 0.00 0.00 0.00 0.00 46.02 44.84 3ihi n GLY 116 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3ihi n PHE 117 N -3.05 2.69 0.28 1.61 3.72 -0.14 -4.76 117.46 117.80 3ihi n PHE 117 Ca -0.03 -2.25 0.16 0.00 -0.05 0.00 0.00 57.45 55.28 3ihi n PHE 117 Cb 0.15 -1.23 0.78 0.00 -0.94 0.00 0.00 39.48 38.24 3ihi n PHE 117 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3ihi h SER 118 N 3.03 0.00 1.10 4.37 4.64 -1.86 -2.21 113.55 122.63 3ihi h SER 118 Ca 0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 3ihi h SER 118 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 3ihi h SER 118 CO 1.32 0.07 0.00 0.00 -0.87 0.00 0.00 176.83 177.35 3ihi n ALA 119 N -2.17 2.26 -1.75 5.18 0.00 -1.26 -4.85 120.51 117.91 3ihi n ALA 119 Ca -0.01 -0.07 -0.40 0.00 0.00 0.00 0.00 53.44 52.96 3ihi n ALA 119 Cb 0.25 -1.45 -0.06 0.00 0.00 0.00 0.00 19.45 18.19 3ihi n ALA 119 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3ihi s ARG 120 N -3.04 4.82 0.74 0.00 0.52 -0.83 -5.06 118.95 116.10 3ihi s ARG 120 Ca 0.12 1.49 -0.14 0.00 -0.52 0.00 0.00 55.73 56.69 3ihi s ARG 120 Cb 0.16 -3.23 0.04 0.00 0.52 0.00 0.00 34.95 32.44 3ihi s ARG 120 CO 0.53 0.48 1.15 -0.65 0.02 0.00 0.00 175.30 176.83 3ihi s GLN 121 N -1.27 2.23 0.31 3.54 -1.52 -1.26 -4.97 119.66 116.72 3ihi s GLN 121 Ca 0.42 1.52 -0.27 0.00 -1.95 0.00 0.00 55.36 55.08 3ihi s GLN 121 Cb -0.26 -1.87 -0.09 0.00 -0.22 0.00 0.00 33.01 30.57 3ihi s GLN 121 CO 0.32 -1.71 1.01 -2.00 -0.25 0.00 0.00 175.29 172.66 3ihi s GLU 122 N -4.21 4.57 0.00 2.91 2.12 -1.26 -2.44 118.70 120.38 3ihi s GLU 122 Ca 0.69 1.54 0.00 0.00 0.36 0.00 0.00 54.97 57.56 3ihi s GLU 122 Cb -0.24 -2.96 0.00 0.00 0.26 0.00 0.00 34.13 31.19 3ihi s GLU 122 CO 0.47 0.22 0.00 0.41 -0.54 0.00 0.00 175.26 175.82 3ihi n GLY 123 N 0.90 2.44 3.55 -1.50 0.00 0.18 -4.87 105.19 105.90 3ihi n GLY 123 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 3ihi n GLY 123 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3ihi s ASP 124 N -1.42 6.19 0.06 1.61 -1.08 -1.02 -0.56 116.67 120.46 3ihi s ASP 124 Ca 0.00 -0.40 0.26 0.00 -0.52 0.00 0.00 52.55 51.88 3ihi s ASP 124 Cb 0.00 -2.56 1.03 0.00 -1.46 0.00 0.00 42.92 39.94 3ihi s ASP 124 CO 0.00 -1.79 1.81 0.18 0.52 0.00 0.00 175.17 175.89 3ihi n LEU 125 N 9.23 0.23 0.00 -1.34 4.77 -0.77 -4.89 117.00 124.21 3ihi n LEU 125 Ca 0.03 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.54 3ihi n LEU 125 Cb 0.49 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 3ihi n LEU 125 CO 0.71 -0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 3ihi n GLY 126 N 1.14 -2.10 2.68 -0.72 0.00 -1.26 -0.31 105.19 104.62 3ihi n GLY 126 Ca 0.06 -1.57 -0.41 0.00 0.00 0.00 0.00 46.02 44.10 3ihi n GLY 126 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3ihi n PRO 127 N -0.09 2.86 0.00 1.61 -0.04 -1.26 -4.84 135.00 133.24 3ihi n PRO 127 Ca 0.00 -2.42 0.00 0.00 -0.04 0.00 0.00 63.50 61.04 3ihi n PRO 127 Cb 0.00 -3.14 0.00 0.00 -0.04 0.00 0.00 33.50 30.32 3ihi n PRO 127 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 3ihi n VAL 128 N 4.88 0.00 0.11 0.52 0.24 -1.26 -4.55 118.33 118.27 3ihi n VAL 128 Ca 0.57 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.72 3ihi n VAL 128 Cb 0.35 -1.28 -0.07 0.00 -1.47 0.00 0.00 33.84 31.37 3ihi n VAL 128 CO 0.00 0.00 0.00 1.88 -2.14 0.00 0.00 176.83 176.57 3ihi h TYR 129 N 0.00 -1.15 -0.73 6.34 -1.99 -1.90 -1.84 116.97 115.70 3ihi h TYR 129 Ca 0.00 0.03 0.15 0.00 2.00 0.00 0.00 58.73 60.90 3ihi h TYR 129 Cb 0.00 0.49 -0.10 0.00 2.00 0.00 0.00 36.73 39.12 3ihi h TYR 129 CO 0.00 -0.51 0.24 0.78 -0.00 0.00 0.00 178.16 178.67 3ihi h GLY 130 N -0.64 1.06 0.94 3.88 0.00 -1.77 -0.05 103.07 106.49 3ihi h GLY 130 Ca 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.24 3ihi h GLY 130 CO -0.24 -0.14 0.16 -2.75 0.00 0.00 0.00 176.54 173.57 3ihi h PHE 131 N 0.36 0.47 -0.37 5.60 3.57 -1.47 -2.37 116.94 122.73 3ihi h PHE 131 Ca 0.40 -0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.76 3ihi h PHE 131 Cb 0.64 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 3ihi h PHE 131 CO -0.21 0.41 -0.26 1.96 -2.23 0.00 0.00 178.31 177.99 3ihi h GLN 132 N 0.39 0.75 -0.83 1.11 1.08 -0.73 0.14 115.11 117.02 3ihi h GLN 132 Ca 0.11 -0.32 -0.03 0.00 -1.45 0.00 0.00 58.65 56.96 3ihi h GLN 132 Cb 0.12 -0.03 -0.04 0.00 -0.05 0.00 0.00 27.48 27.49 3ihi h GLN 132 CO -0.01 0.93 0.39 -1.49 -0.95 0.00 0.00 178.83 177.70 3ihi h TRP 133 N 0.65 1.20 0.00 2.96 4.06 -0.93 -2.70 115.95 121.19 3ihi h TRP 133 Ca 0.08 -0.06 0.00 0.00 2.06 0.00 0.00 58.89 60.97 3ihi h TRP 133 Cb 0.77 -0.37 0.00 0.00 -1.00 0.00 0.00 29.16 28.56 3ihi h TRP 133 CO 0.04 0.87 -1.85 0.54 -3.56 0.00 0.00 178.44 174.47 3ihi n ARG 134 N -4.30 0.60 -1.94 0.49 5.12 -0.90 -0.89 116.66 114.83 3ihi n ARG 134 Ca 0.08 -0.17 0.02 0.00 -1.93 0.00 0.00 57.85 55.85 3ihi n ARG 134 Cb 0.14 -1.48 0.03 0.00 -1.16 0.00 0.00 32.46 30.00 3ihi n ARG 134 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 3ihi n HIS 135 N -2.15 0.32 -1.65 -1.55 8.25 0.48 -3.36 115.22 115.55 3ihi n HIS 135 Ca -0.03 -1.08 -0.45 0.00 -0.26 0.00 0.00 57.72 55.90 3ihi n HIS 135 Cb 0.51 -0.06 -0.02 0.00 1.12 0.00 0.00 29.99 31.54 3ihi n HIS 135 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3ihi n PHE 136 N 0.02 1.96 0.00 4.41 -0.00 -0.54 -1.83 117.46 121.48 3ihi n PHE 136 Ca 0.03 0.53 0.00 0.00 -0.00 0.00 0.00 57.45 58.01 3ihi n PHE 136 Cb 0.99 -2.40 0.00 0.00 -0.00 0.00 0.00 39.48 38.08 3ihi n PHE 136 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3ihi n GLY 137 N 1.70 2.05 3.76 7.13 0.00 -1.26 -0.42 105.19 118.15 3ihi n GLY 137 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 3ihi n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ihi s ALA 138 N -2.53 2.03 -0.25 4.61 0.00 -0.76 -4.86 121.76 120.01 3ihi s ALA 138 Ca 0.00 0.01 -0.17 0.00 0.00 0.00 0.00 51.96 51.80 3ihi s ALA 138 Cb 0.00 -3.19 -0.03 0.00 0.00 0.00 0.00 23.12 19.90 3ihi s ALA 138 CO 0.00 -1.92 0.46 -1.21 0.00 0.00 0.00 175.76 173.09 3ihi s GLU 139 N -4.99 4.08 0.18 0.00 8.01 -1.26 -5.00 118.70 119.71 3ihi s GLU 139 Ca 0.62 0.24 -0.27 0.00 0.01 0.00 0.00 54.97 55.57 3ihi s GLU 139 Cb -0.16 -3.63 -0.08 0.00 -4.31 0.00 0.00 34.13 25.94 3ihi s GLU 139 CO 0.56 -0.28 0.83 -0.47 0.01 0.00 0.00 175.26 175.91 3ihi s TYR 140 N 2.08 3.92 0.00 1.61 5.04 -1.26 -4.95 117.35 123.79 3ihi s TYR 140 Ca 0.19 1.71 0.00 0.00 -2.44 0.00 0.00 57.07 56.54 3ihi s TYR 140 Cb -0.16 -2.84 0.00 0.00 0.35 0.00 0.00 41.96 39.32 3ihi s TYR 140 CO 0.09 0.48 0.00 1.63 -1.34 0.00 0.00 175.55 176.41 3ihi n LYS 141 N 1.66 0.00 -3.55 4.97 5.02 -1.26 -5.10 118.16 119.91 3ihi n LYS 141 Ca -0.04 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.12 3ihi n LYS 141 Cb 0.48 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.45 3ihi n LYS 141 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3ihi n ASP 142 N -1.29 -0.87 0.26 4.39 5.68 -1.26 -5.03 116.55 118.43 3ihi n ASP 142 Ca 0.00 -2.55 0.16 0.00 -0.50 0.00 0.00 54.79 51.90 3ihi n ASP 142 Cb 0.00 1.72 0.61 0.00 -1.14 0.00 0.00 41.12 42.31 3ihi n ASP 142 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3ihi h MET 143 N 0.00 0.00 0.00 0.11 -0.00 -1.95 -2.25 114.93 110.83 3ihi h MET 143 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.50 3ihi h MET 143 Cb 0.92 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.52 3ihi h MET 143 CO 0.28 0.00 -0.79 -0.25 -0.00 0.00 0.00 176.91 176.15 3ihi n ASP 144 N -3.03 0.68 -4.61 -0.10 8.00 -1.26 -4.76 116.55 111.47 3ihi n ASP 144 Ca 0.01 0.03 -0.34 0.00 0.71 0.00 0.00 54.79 55.20 3ihi n ASP 144 Cb 0.33 0.40 0.11 0.00 -0.02 0.00 0.00 41.12 41.94 3ihi n ASP 144 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3ihi n SER 145 N -2.10 0.15 -4.47 -2.24 7.64 -0.85 -4.95 113.62 106.80 3ihi n SER 145 Ca 0.03 0.55 -0.43 0.00 1.01 0.00 0.00 58.87 60.03 3ihi n SER 145 Cb 0.45 -1.41 -0.09 0.00 -1.01 0.00 0.00 64.21 62.15 3ihi n SER 145 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3ihi s ASP 146 N -1.97 6.17 -0.01 6.43 2.15 -1.26 -4.93 116.67 123.25 3ihi s ASP 146 Ca 0.70 -0.77 0.20 0.00 0.43 0.00 0.00 52.55 53.10 3ihi s ASP 146 Cb -0.29 -2.21 0.60 0.00 -0.30 0.00 0.00 42.92 40.71 3ihi s ASP 146 CO 0.54 -0.56 1.50 -1.22 -0.17 0.00 0.00 175.17 175.26 3ihi n TYR 147 N 5.49 0.95 -1.64 -5.34 4.01 -1.26 -5.00 117.16 114.37 3ihi n TYR 147 Ca -0.08 -0.46 -0.59 0.00 -0.16 0.00 0.00 57.90 56.61 3ihi n TYR 147 Cb 0.47 -0.03 -0.08 0.00 -0.31 0.00 0.00 39.34 39.39 3ihi n TYR 147 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 3ihi n SER 148 N 1.39 1.36 0.00 7.72 7.64 -1.26 -0.82 113.62 129.65 3ihi n SER 148 Ca 0.22 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.24 3ihi n SER 148 Cb 0.59 -1.04 0.00 0.00 -1.01 0.00 0.00 64.21 62.75 3ihi n SER 148 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3ihi n GLY 149 N 3.06 0.48 3.86 0.23 0.00 -1.26 -5.01 105.19 106.54 3ihi n GLY 149 Ca 0.24 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.90 3ihi n GLY 149 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ihi s GLN 150 N -0.56 3.79 1.21 1.61 -0.21 -0.00 -4.98 119.66 120.52 3ihi s GLN 150 Ca 0.00 0.24 0.00 0.00 0.02 0.00 0.00 55.36 55.62 3ihi s GLN 150 Cb 0.00 -3.10 0.00 0.00 1.00 0.00 0.00 33.01 30.91 3ihi s GLN 150 CO 0.00 0.63 0.00 0.41 -2.12 0.00 0.00 175.29 174.21 3ihi n GLY 151 N 1.33 -1.90 3.67 3.09 0.00 -1.26 -4.40 105.19 105.71 3ihi n GLY 151 Ca -0.11 -1.37 -0.36 0.00 0.00 0.00 0.00 46.02 44.18 3ihi n GLY 151 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ihi s VAL 152 N 0.00 5.35 -1.21 1.61 1.01 0.44 -4.73 120.40 122.87 3ihi s VAL 152 Ca 0.00 0.23 -0.19 0.00 0.00 0.00 0.00 61.98 62.02 3ihi s VAL 152 Cb 0.00 -3.52 0.08 0.00 0.00 0.00 0.00 36.38 32.94 3ihi s VAL 152 CO 0.00 0.35 1.63 -0.62 0.00 0.00 0.00 175.10 176.46 3ihi s ASP 153 N 0.94 6.77 0.22 3.32 -1.08 -1.21 -1.46 116.67 124.18 3ihi s ASP 153 Ca 0.09 -2.25 -0.08 0.00 -0.52 0.00 0.00 52.55 49.78 3ihi s ASP 153 Cb -0.13 -2.56 0.22 0.00 -1.46 0.00 0.00 42.92 38.99 3ihi s ASP 153 CO 0.04 -1.21 1.88 1.56 0.52 0.00 0.00 175.17 177.96 3ihi h GLN 154 N 8.10 1.01 -0.11 4.34 4.20 -1.27 -1.58 115.11 129.80 3ihi h GLN 154 Ca 0.37 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 59.01 3ihi h GLN 154 Cb 0.91 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 28.46 3ihi h GLN 154 CO 1.42 0.67 0.05 1.25 -0.67 0.00 0.00 178.83 181.55 3ihi h LEU 155 N 1.04 0.15 -0.82 1.46 5.85 -1.69 -0.95 115.31 120.35 3ihi h LEU 155 Ca 0.32 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.89 3ihi h LEU 155 Cb -0.03 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 40.92 3ihi h LEU 155 CO -0.10 0.26 0.55 -0.61 -0.34 0.00 0.00 178.44 178.20 3ihi h GLN 156 N 0.03 1.08 -0.56 1.25 5.75 -1.84 -2.21 115.11 118.62 3ihi h GLN 156 Ca 0.04 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 3ihi h GLN 156 Cb 0.15 -0.24 -0.03 0.00 1.07 0.00 0.00 27.48 28.43 3ihi h GLN 156 CO -0.00 0.72 0.35 -0.22 -2.65 0.00 0.00 178.83 177.02 3ihi h LYS 157 N 1.12 0.74 0.20 1.69 3.64 -0.98 -1.21 116.57 121.77 3ihi h LYS 157 Ca 0.30 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.62 3ihi h LYS 157 Cb -0.13 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.53 3ihi h LYS 157 CO -0.07 0.51 -0.10 0.28 -2.27 0.00 0.00 179.45 177.80 3ihi h VAL 158 N 0.76 0.82 -0.74 2.00 2.07 -0.71 0.28 116.25 120.73 3ihi h VAL 158 Ca 0.20 -0.09 0.09 0.00 0.82 0.00 0.00 66.70 67.71 3ihi h VAL 158 Cb -0.06 0.88 -0.07 0.00 -1.52 0.00 0.00 31.29 30.52 3ihi h VAL 158 CO -0.04 0.02 0.40 0.40 0.02 0.00 0.00 177.57 178.37 3ihi h ILE 159 N -0.32 0.90 0.00 4.57 2.04 -1.15 -0.55 117.51 122.99 3ihi h ILE 159 Ca -0.03 -0.23 -0.21 0.00 1.00 0.00 0.00 64.86 65.38 3ihi h ILE 159 Cb 0.25 0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.48 3ihi h ILE 159 CO 0.05 0.12 -0.91 0.44 0.00 0.00 0.00 178.15 177.85 3ihi h ASP 160 N 0.68 0.43 -0.45 1.72 3.32 -1.05 -2.23 116.42 118.84 3ihi h ASP 160 Ca 0.35 -0.35 -0.11 0.00 0.02 0.00 0.00 57.03 56.95 3ihi h ASP 160 Cb 0.32 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 3ihi h ASP 160 CO -0.24 1.14 -0.15 0.74 -1.72 0.00 0.00 179.24 179.01 3ihi h THR 161 N 0.19 1.27 -0.78 0.35 2.02 -0.68 -1.84 112.91 113.43 3ihi h THR 161 Ca -0.07 -1.29 0.01 0.00 0.77 0.00 0.00 66.41 65.84 3ihi h THR 161 Cb 1.55 1.16 -0.04 0.00 -1.74 0.00 0.00 68.15 69.07 3ihi h THR 161 CO 0.15 0.44 0.51 0.40 0.37 0.00 0.00 175.52 177.40 3ihi h ILE 162 N 0.74 1.18 0.03 3.11 2.04 -0.91 0.30 117.51 123.99 3ihi h ILE 162 Ca 0.11 -0.35 -0.00 0.00 1.00 0.00 0.00 64.86 65.61 3ihi h ILE 162 Cb 0.71 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.84 3ihi h ILE 162 CO 0.05 0.19 -0.01 0.11 0.00 0.00 0.00 178.15 178.49 3ihi h LYS 163 N 1.03 -0.03 0.03 2.37 1.57 -1.29 -3.26 116.57 116.99 3ihi h LYS 163 Ca 0.29 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.78 3ihi h LYS 163 Cb -0.08 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 3ihi h LYS 163 CO -0.08 0.06 -1.72 1.79 -0.57 0.00 0.00 179.45 178.93 3ihi h THR 164 N -0.11 0.86 -2.10 -0.16 1.35 -1.24 -3.42 112.91 108.09 3ihi h THR 164 Ca -0.00 -2.68 -0.57 0.00 -0.55 0.00 0.00 66.41 62.61 3ihi h THR 164 Cb 0.10 2.48 -0.39 0.00 -1.73 0.00 0.00 68.15 68.61 3ihi h THR 164 CO 0.01 0.60 -1.00 -3.20 -0.25 0.00 0.00 175.52 171.68 3ihi n ASN 165 N -3.16 0.70 0.33 5.36 5.15 0.10 -4.98 115.26 118.76 3ihi n ASN 165 Ca -0.19 -2.78 0.22 0.00 -0.60 0.00 0.00 54.58 51.23 3ihi n ASN 165 Cb 1.05 -0.64 1.12 0.00 -0.53 0.00 0.00 39.78 40.78 3ihi n ASN 165 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 3ihi h PRO 166 N 4.27 0.00 0.00 1.20 0.13 -1.65 -1.55 132.00 134.40 3ihi h PRO 166 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3ihi h PRO 166 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 3ihi h PRO 166 CO 0.51 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.04 3ihi n ASP 167 N -3.14 0.00 -4.75 1.44 8.00 -1.26 -3.66 116.55 113.18 3ihi n ASP 167 Ca -0.02 -0.39 -0.41 0.00 0.71 0.00 0.00 54.79 54.67 3ihi n ASP 167 Cb 0.11 -0.20 -0.01 0.00 -0.02 0.00 0.00 41.12 41.00 3ihi n ASP 167 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 3ihi n ASP 168 N -1.20 3.92 -1.88 -2.24 2.03 -0.58 -4.89 116.55 111.71 3ihi n ASP 168 Ca 0.17 1.16 0.01 0.00 0.52 0.00 0.00 54.79 56.64 3ihi n ASP 168 Cb 0.19 -1.61 0.34 0.00 -0.72 0.00 0.00 41.12 39.33 3ihi n ASP 168 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3ihi n ARG 169 N 1.93 4.20 -0.56 -0.67 1.74 -1.26 -4.33 116.66 117.71 3ihi n ARG 169 Ca 0.07 -2.94 0.05 0.00 -0.77 0.00 0.00 57.85 54.27 3ihi n ARG 169 Cb 0.37 -2.20 0.09 0.00 -1.02 0.00 0.00 32.46 29.70 3ihi n ARG 169 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3ihi n ARG 170 N 0.28 0.70 -2.90 5.56 1.74 -1.26 -4.97 116.66 115.80 3ihi n ARG 170 Ca 0.32 -2.10 -0.44 0.00 -0.77 0.00 0.00 57.85 54.86 3ihi n ARG 170 Cb 1.23 -0.93 -0.03 0.00 -1.02 0.00 0.00 32.46 31.72 3ihi n ARG 170 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3ihi s ILE 171 N -1.50 4.67 -0.02 0.55 1.01 -1.26 -4.95 121.20 119.69 3ihi s ILE 171 Ca 0.23 -1.49 0.03 0.00 0.00 0.00 0.00 60.65 59.43 3ihi s ILE 171 Cb 0.23 -4.79 -0.00 0.00 0.01 0.00 0.00 42.46 37.90 3ihi s ILE 171 CO -0.03 -1.53 -0.12 -0.63 0.00 0.00 0.00 174.94 172.63 3ihi s ILE 172 N 2.87 0.94 -0.14 2.92 1.01 -1.26 -0.90 121.20 126.64 3ihi s ILE 172 Ca 0.33 -0.48 0.02 0.00 0.00 0.00 0.00 60.65 60.52 3ihi s ILE 172 Cb -0.05 -0.81 0.01 0.00 0.01 0.00 0.00 42.46 41.62 3ihi s ILE 172 CO -0.09 0.28 -0.21 -0.32 0.00 0.00 0.00 174.94 174.60 3ihi s MET 173 N -0.07 3.05 -0.14 2.79 -2.45 -0.60 -4.88 119.30 117.00 3ihi s MET 173 Ca 0.01 -0.84 0.01 0.00 -1.25 0.00 0.00 55.69 53.62 3ihi s MET 173 Cb -0.07 -2.46 0.02 0.00 1.25 0.00 0.00 34.83 33.57 3ihi s MET 173 CO 0.00 -0.01 -0.16 0.00 1.05 0.00 0.00 175.02 175.91 3ihi n ALA 175 N 4.50 3.03 -2.25 0.00 0.00 -0.52 -4.73 120.51 120.56 3ihi n ALA 175 Ca -0.18 -0.37 -0.43 0.00 0.00 0.00 0.00 53.44 52.46 3ihi n ALA 175 Cb 0.51 -0.98 -0.02 0.00 0.00 0.00 0.00 19.45 18.95 3ihi n ALA 175 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 3ihi s TRP 176 N -3.30 2.30 -0.39 0.00 -0.11 -0.88 -4.79 118.94 111.78 3ihi s TRP 176 Ca 0.01 0.68 0.01 0.00 1.22 0.00 0.00 56.10 58.01 3ihi s TRP 176 Cb 0.13 -4.08 0.12 0.00 -1.50 0.00 0.00 33.47 28.14 3ihi s TRP 176 CO 0.81 -2.34 0.19 1.21 -4.62 0.00 0.00 176.95 172.20 3ihi s ASN 177 N 4.04 3.71 0.46 5.86 3.84 -1.26 -5.00 114.94 126.59 3ihi s ASN 177 Ca 0.66 -2.26 0.23 0.00 0.21 0.00 0.00 52.86 51.69 3ihi s ASN 177 Cb -0.19 -0.92 1.23 0.00 -0.55 0.00 0.00 41.25 40.82 3ihi s ASN 177 CO 0.29 -0.32 1.86 -0.65 -2.79 0.00 0.00 177.10 175.50 3ihi h PRO 178 N 7.20 0.25 -0.25 0.43 0.11 -2.01 -0.23 132.00 137.49 3ihi h PRO 178 Ca -0.04 -0.02 -0.19 0.00 0.11 0.00 0.00 66.00 65.87 3ihi h PRO 178 Cb 0.96 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.01 3ihi h PRO 178 CO 0.45 0.17 -0.57 -0.22 -0.21 0.00 0.00 178.00 177.62 3ihi h LYS 179 N 0.26 0.81 0.00 1.05 3.11 -2.01 -3.22 116.57 116.55 3ihi h LYS 179 Ca 0.46 -0.53 0.00 0.00 -2.81 0.00 0.00 60.65 57.78 3ihi h LYS 179 Cb 1.38 0.07 0.00 0.00 -1.00 0.00 0.00 32.23 32.68 3ihi h LYS 179 CO -0.13 1.15 -0.37 -0.25 -2.81 0.00 0.00 179.45 177.05 3ihi n ASP 180 N -3.99 0.60 -0.23 4.20 8.00 -0.22 -4.47 116.55 120.45 3ihi n ASP 180 Ca -0.04 0.22 0.03 0.00 0.71 0.00 0.00 54.79 55.70 3ihi n ASP 180 Cb 0.64 -0.14 0.13 0.00 -0.02 0.00 0.00 41.12 41.73 3ihi n ASP 180 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3ihi h LEU 181 N 0.00 -0.31 -1.86 0.64 3.38 -1.24 0.60 115.31 116.51 3ihi h LEU 181 Ca 0.00 0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3ihi h LEU 181 Cb 0.67 0.30 0.00 0.00 0.09 0.00 0.00 40.66 41.72 3ihi h LEU 181 CO 0.00 -0.14 0.00 -0.65 0.09 0.00 0.00 178.44 177.74 3ihi h PRO 182 N 0.11 0.00 0.00 1.13 0.11 -1.81 -1.94 132.00 129.61 3ihi h PRO 182 Ca 0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.48 3ihi h PRO 182 Cb 0.62 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.73 3ihi h PRO 182 CO -0.59 0.00 -0.41 1.28 -0.21 0.00 0.00 178.00 178.07 3ihi n LEU 183 N -2.58 0.58 -4.80 2.35 4.77 0.20 -4.93 117.00 112.57 3ihi n LEU 183 Ca -0.01 0.27 -0.37 0.00 -0.03 0.00 0.00 56.01 55.87 3ihi n LEU 183 Cb 0.09 -0.26 -0.06 0.00 -2.33 0.00 0.00 43.42 40.85 3ihi n LEU 183 CO 0.15 -0.03 0.49 -0.04 -1.33 0.00 0.00 177.39 176.64 3ihi s MET 184 N -3.09 4.38 0.43 3.23 -1.94 -0.73 -4.36 119.30 117.21 3ihi s MET 184 Ca 0.09 1.03 0.19 0.00 -1.71 0.00 0.00 55.69 55.29 3ihi s MET 184 Cb 0.15 -2.90 0.97 0.00 2.01 0.00 0.00 34.83 35.06 3ihi s MET 184 CO 0.67 0.38 1.90 0.00 -0.01 0.00 0.00 175.02 177.96 3ihi h ALA 185 N 3.44 1.28 -2.83 3.03 0.00 -0.99 -3.43 119.26 119.77 3ihi h ALA 185 Ca -0.47 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.04 3ihi h ALA 185 Cb 1.19 -0.04 -0.26 0.00 0.00 0.00 0.00 17.79 18.68 3ihi h ALA 185 CO 0.65 0.34 -0.33 -1.17 0.00 0.00 0.00 179.25 178.74 3ihi s LEU 186 N -7.66 0.36 0.57 0.00 0.20 -1.26 -5.09 118.68 105.79 3ihi s LEU 186 Ca -0.02 0.74 -0.20 0.00 0.69 0.00 0.00 54.13 55.34 3ihi s LEU 186 Cb 0.13 1.17 -0.04 0.00 -0.43 0.00 0.00 46.19 47.02 3ihi s LEU 186 CO 0.67 -0.15 1.25 -2.84 -0.29 0.00 0.00 176.35 174.98 3ihi s PRO 187 N 0.79 3.07 0.34 0.98 0.02 -1.26 -4.93 135.00 134.01 3ihi s PRO 187 Ca -0.05 1.95 -0.28 0.00 0.02 0.00 0.00 61.00 62.63 3ihi s PRO 187 Cb -0.06 -2.06 -0.10 0.00 0.02 0.00 0.00 34.50 32.30 3ihi s PRO 187 CO -0.06 -1.16 1.28 -1.25 -0.33 0.00 0.00 177.00 175.48 3ihi s PRO 188 N -3.15 4.33 0.08 5.54 0.04 -1.26 -4.90 135.00 135.69 3ihi s PRO 188 Ca 0.75 2.15 0.04 0.00 0.04 0.00 0.00 61.00 63.98 3ihi s PRO 188 Cb -0.33 -3.03 -0.23 0.00 0.04 0.00 0.00 34.50 30.94 3ihi s PRO 188 CO 0.38 -0.19 1.15 0.00 0.04 0.00 0.00 177.00 178.38 3ihi s HIS 190 N -2.68 2.83 -0.09 0.00 3.76 -1.26 -1.12 115.29 116.73 3ihi s HIS 190 Ca -0.02 -1.04 -0.26 0.00 -0.15 0.00 0.00 55.06 53.60 3ihi s HIS 190 Cb 0.09 -4.43 -0.27 0.00 1.11 0.00 0.00 32.58 29.07 3ihi s HIS 190 CO 0.84 -1.68 0.86 0.00 -0.85 0.00 0.00 174.74 173.91 3ihi h ALA 191 N 9.30 -0.03 -2.81 -1.40 0.00 -1.45 -3.41 119.26 119.46 3ihi h ALA 191 Ca 0.09 -0.56 -0.04 0.00 0.00 0.00 0.00 54.91 54.40 3ihi h ALA 191 Cb 1.03 0.04 -0.12 0.00 0.00 0.00 0.00 17.79 18.74 3ihi h ALA 191 CO 1.23 0.15 -0.02 -0.48 0.00 0.00 0.00 179.25 180.12 3ihi s LEU 192 N -8.16 0.23 0.16 0.00 0.05 -1.23 -1.44 118.68 108.29 3ihi s LEU 192 Ca -0.16 -0.38 0.07 0.00 0.05 0.00 0.00 54.13 53.70 3ihi s LEU 192 Cb -0.01 1.98 -0.04 0.00 -2.05 0.00 0.00 46.19 46.07 3ihi s LEU 192 CO 0.75 -0.94 -0.16 0.00 -0.55 0.00 0.00 176.35 175.45 3ihi s GLN 194 N -2.97 1.12 0.29 0.00 0.74 0.23 -1.56 119.66 117.51 3ihi s GLN 194 Ca 0.15 -0.91 0.09 0.00 0.05 0.00 0.00 55.36 54.74 3ihi s GLN 194 Cb -0.04 -1.21 -0.05 0.00 1.10 0.00 0.00 33.01 32.82 3ihi s GLN 194 CO 0.05 0.30 0.01 -0.06 -0.55 0.00 0.00 175.29 175.04 3ihi s PHE 195 N -0.92 2.64 -0.21 1.67 0.08 -0.08 -0.30 117.98 120.86 3ihi s PHE 195 Ca 0.04 -0.30 -0.17 0.00 0.12 0.00 0.00 56.93 56.63 3ihi s PHE 195 Cb -0.09 -1.31 0.06 0.00 -0.57 0.00 0.00 43.02 41.11 3ihi s PHE 195 CO 0.02 0.55 0.55 -0.47 -0.10 0.00 0.00 175.22 175.77 3ihi s TYR 196 N -2.39 -0.69 -0.09 0.36 6.14 -0.47 -4.51 117.35 115.69 3ihi s TYR 196 Ca 0.33 1.57 0.03 0.00 0.64 0.00 0.00 57.07 59.64 3ihi s TYR 196 Cb -0.04 0.30 0.01 0.00 0.42 0.00 0.00 41.96 42.64 3ihi s TYR 196 CO 0.20 -0.35 -0.20 0.08 0.64 0.00 0.00 175.55 175.92 3ihi s VAL 197 N 0.78 1.77 -0.07 3.14 1.01 -1.24 -0.90 120.40 124.89 3ihi s VAL 197 Ca -0.04 -0.84 -0.19 0.00 0.00 0.00 0.00 61.98 60.91 3ihi s VAL 197 Cb -0.05 -1.55 0.04 0.00 0.00 0.00 0.00 36.38 34.82 3ihi s VAL 197 CO -0.06 0.50 0.43 0.54 0.00 0.00 0.00 175.10 176.51 3ihi s VAL 198 N 0.50 0.03 -1.54 2.92 0.11 -1.03 -4.68 120.40 116.71 3ihi s VAL 198 Ca -0.16 -0.23 -0.05 0.00 -2.93 0.00 0.00 61.98 58.61 3ihi s VAL 198 Cb -0.17 -0.70 0.01 0.00 -1.53 0.00 0.00 36.38 33.99 3ihi s VAL 198 CO 0.06 -0.13 0.63 -3.20 -3.33 0.00 0.00 175.10 169.14 3ihi n ASN 199 N 1.68 -5.99 -0.63 3.54 5.15 -1.26 -1.36 115.26 116.38 3ihi n ASN 199 Ca -0.18 -0.31 -0.08 0.00 -0.60 0.00 0.00 54.58 53.40 3ihi n ASN 199 Cb 0.56 -4.84 -0.04 0.00 -0.53 0.00 0.00 39.78 34.94 3ihi n ASN 199 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3ihi n GLY 200 N -1.53 0.99 3.21 8.20 0.00 -1.26 -5.00 105.19 109.80 3ihi n GLY 200 Ca -0.10 -0.43 -0.28 0.00 0.00 0.00 0.00 46.02 45.21 3ihi n GLY 200 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ihi s GLU 201 N -2.48 1.83 -0.24 1.61 2.02 -0.46 -1.97 118.70 119.01 3ihi s GLU 201 Ca 0.00 -0.74 -0.09 0.00 0.02 0.00 0.00 54.97 54.16 3ihi s GLU 201 Cb 0.00 -1.70 -0.04 0.00 0.10 0.00 0.00 34.13 32.49 3ihi s GLU 201 CO 0.00 0.40 0.11 -1.17 0.02 0.00 0.00 175.26 174.62 3ihi s LEU 202 N -0.35 3.75 0.30 1.80 2.96 0.21 -2.47 118.68 124.88 3ihi s LEU 202 Ca 0.04 -0.05 0.09 0.00 -0.22 0.00 0.00 54.13 53.99 3ihi s LEU 202 Cb -0.09 -2.00 -0.04 0.00 0.50 0.00 0.00 46.19 44.55 3ihi s LEU 202 CO 0.00 0.03 0.07 -0.44 -1.32 0.00 0.00 176.35 174.69 3ihi s SER 203 N 1.26 4.63 -0.01 3.68 0.01 -0.07 -0.16 113.70 123.05 3ihi s SER 203 Ca 0.06 -0.70 0.00 0.00 1.31 0.00 0.00 55.95 56.62 3ihi s SER 203 Cb -0.14 -0.81 0.01 0.00 0.21 0.00 0.00 66.02 65.28 3ihi s SER 203 CO 0.05 -0.14 0.00 0.00 0.41 0.00 0.00 173.24 173.56 3ihi s GLN 205 N 0.27 3.19 -0.19 0.00 0.74 0.59 -0.56 119.66 123.70 3ihi s GLN 205 Ca -0.02 -0.79 -0.10 0.00 0.05 0.00 0.00 55.36 54.50 3ihi s GLN 205 Cb -0.03 -2.49 -0.05 0.00 1.10 0.00 0.00 33.01 31.54 3ihi s GLN 205 CO -0.01 0.14 0.13 -1.17 -0.55 0.00 0.00 175.29 173.83 3ihi s LEU 206 N 0.49 4.21 -0.52 3.68 2.96 -0.63 -0.60 118.68 128.27 3ihi s LEU 206 Ca -0.12 0.25 -0.19 0.00 -0.22 0.00 0.00 54.13 53.84 3ihi s LEU 206 Cb -0.17 -2.08 0.06 0.00 0.50 0.00 0.00 46.19 44.51 3ihi s LEU 206 CO 0.05 0.21 0.66 -0.47 -1.32 0.00 0.00 176.35 175.48 3ihi s TYR 207 N 0.19 3.02 -0.37 5.38 5.04 -0.11 -1.01 117.35 129.49 3ihi s TYR 207 Ca 0.09 -0.55 -0.11 0.00 -2.44 0.00 0.00 57.07 54.06 3ihi s TYR 207 Cb -0.11 -3.64 0.03 0.00 0.35 0.00 0.00 41.96 38.58 3ihi s TYR 207 CO -0.01 -1.09 0.21 -1.14 -1.34 0.00 0.00 175.55 172.17 3ihi s GLN 208 N 2.75 2.85 0.57 4.97 0.74 0.36 -1.37 119.66 130.52 3ihi s GLN 208 Ca 0.16 -1.07 0.31 0.00 0.05 0.00 0.00 55.36 54.81 3ihi s GLN 208 Cb -0.19 -3.73 1.71 0.00 1.10 0.00 0.00 33.01 31.90 3ihi s GLN 208 CO 0.12 -0.69 2.17 0.07 -0.55 0.00 0.00 175.29 176.41 3ihi h ARG 209 N 8.43 0.00 -2.62 1.67 0.11 -1.41 0.14 114.38 120.70 3ihi h ARG 209 Ca -0.26 0.00 -0.12 0.00 0.10 0.00 0.00 59.98 59.70 3ihi h ARG 209 Cb 1.11 0.00 -0.28 0.00 1.11 0.00 0.00 29.97 31.91 3ihi h ARG 209 CO 0.67 0.06 -0.37 0.45 0.10 0.00 0.00 179.97 180.88 3ihi s SER 210 N -5.98 -0.28 -0.10 0.08 0.15 -1.26 -0.46 113.70 105.85 3ihi s SER 210 Ca -0.04 0.89 -0.01 0.00 0.70 0.00 0.00 55.95 57.50 3ihi s SER 210 Cb 0.13 1.03 0.03 0.00 -1.71 0.00 0.00 66.02 65.51 3ihi s SER 210 CO 0.54 -0.22 -0.02 -0.83 1.20 0.00 0.00 173.24 173.92 3ihi s GLY 211 N 2.10 0.60 -0.63 9.45 0.00 0.29 -4.91 107.32 114.22 3ihi s GLY 211 Ca -0.04 -0.31 -0.23 0.00 0.00 0.00 0.00 44.72 44.13 3ihi s GLY 211 CO -0.12 1.08 0.98 -0.35 0.00 0.00 0.00 173.10 174.69 3ihi s ASP 212 N 1.89 6.23 0.28 1.64 -1.08 -1.26 -0.26 116.67 124.10 3ihi s ASP 212 Ca 0.04 -0.74 0.01 0.00 -0.52 0.00 0.00 52.55 51.34 3ihi s ASP 212 Cb -0.13 -2.43 0.56 0.00 -1.46 0.00 0.00 42.92 39.46 3ihi s ASP 212 CO -0.06 -1.39 1.80 0.24 0.52 0.00 0.00 175.17 176.28 3ihi h MET 213 N 9.51 0.81 0.00 4.34 2.86 -1.38 -0.42 114.93 130.65 3ihi h MET 213 Ca -0.28 -0.05 -0.19 0.00 -2.06 0.00 0.00 59.70 57.12 3ihi h MET 213 Cb 1.07 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 32.53 3ihi h MET 213 CO 1.15 0.54 -0.86 0.78 1.06 0.00 0.00 176.91 179.58 3ihi h GLY 214 N 0.83 0.16 0.00 8.32 0.00 -1.92 -3.39 103.07 107.08 3ihi h GLY 214 Ca 0.49 -0.28 -0.04 0.00 0.00 0.00 0.00 47.33 47.50 3ihi h GLY 214 CO -0.31 0.25 -1.08 -0.10 0.00 0.00 0.00 176.54 175.30 3ihi n LEU 215 N -3.63 0.24 -0.05 3.11 7.94 -1.14 -4.90 117.00 118.56 3ihi n LEU 215 Ca -0.03 0.04 -0.22 0.00 -1.11 0.00 0.00 56.01 54.69 3ihi n LEU 215 Cb 0.80 -0.09 -0.13 0.00 0.53 0.00 0.00 43.42 44.53 3ihi n LEU 215 CO 0.47 0.01 -0.75 0.61 -1.11 0.00 0.00 177.39 176.61 3ihi n GLY 216 N 2.87 -0.65 0.27 -3.96 0.00 -0.51 -4.48 105.19 98.72 3ihi n GLY 216 Ca -0.05 -0.11 -0.00 0.00 0.00 0.00 0.00 46.02 45.86 3ihi n GLY 216 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3ihi h VAL 217 N -0.40 0.30 -0.94 1.61 2.07 -1.31 -0.45 116.25 117.13 3ihi h VAL 217 Ca -0.42 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.12 3ihi h VAL 217 Cb 1.73 0.30 -0.05 0.00 -1.52 0.00 0.00 31.29 31.75 3ihi h VAL 217 CO -0.06 0.00 0.62 -0.65 0.02 0.00 0.00 177.57 177.50 3ihi h PRO 218 N -0.01 1.23 -0.56 1.57 0.11 -1.81 -1.20 132.00 131.32 3ihi h PRO 218 Ca 0.32 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 66.28 3ihi h PRO 218 Cb 0.50 -0.28 -0.02 0.00 0.11 0.00 0.00 31.00 31.32 3ihi h PRO 218 CO -0.70 0.81 0.06 0.35 -0.21 0.00 0.00 178.00 178.31 3ihi h PHE 219 N 1.26 1.02 -0.36 0.65 3.04 -1.47 -2.44 116.94 118.64 3ihi h PHE 219 Ca 0.35 -0.15 -0.11 0.00 3.98 0.00 0.00 57.97 62.03 3ihi h PHE 219 Cb -0.13 -0.28 -0.01 0.00 2.56 0.00 0.00 35.95 38.09 3ihi h PHE 219 CO -0.00 0.90 -0.24 -0.91 -2.02 0.00 0.00 178.31 176.04 3ihi h ASN 220 N 0.84 0.74 -0.20 0.41 -0.26 -0.40 0.79 115.58 117.50 3ihi h ASN 220 Ca 0.17 -0.27 0.01 0.00 -0.56 0.00 0.00 56.30 55.65 3ihi h ASN 220 Cb 0.45 -0.20 -0.01 0.00 -1.06 0.00 0.00 38.32 37.50 3ihi h ASN 220 CO 0.02 0.95 0.11 0.40 -1.06 0.00 0.00 177.43 177.85 3ihi h ILE 221 N 0.63 1.02 -0.72 2.81 2.04 -1.17 -2.05 117.51 120.07 3ihi h ILE 221 Ca 0.09 -0.08 -0.07 0.00 1.00 0.00 0.00 64.86 65.80 3ihi h ILE 221 Cb 0.74 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 37.55 3ihi h ILE 221 CO 0.06 0.04 0.19 0.00 0.00 0.00 0.00 178.15 178.44 3ihi h ALA 222 N 1.09 0.98 -0.42 1.87 0.00 -0.97 -0.06 119.26 121.76 3ihi h ALA 222 Ca 0.08 -0.24 0.05 0.00 0.00 0.00 0.00 54.91 54.80 3ihi h ALA 222 Cb 0.00 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.47 3ihi h ALA 222 CO -0.04 0.66 0.17 1.03 0.00 0.00 0.00 179.25 181.07 3ihi h SER 223 N 1.08 0.20 1.17 0.00 0.87 -0.49 -0.52 113.55 115.86 3ihi h SER 223 Ca 0.23 0.04 -0.13 0.00 -1.23 0.00 0.00 61.79 60.70 3ihi h SER 223 Cb 0.35 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.30 3ihi h SER 223 CO -0.00 0.15 -0.87 1.88 -0.53 0.00 0.00 176.83 177.46 3ihi h TYR 224 N 0.34 0.00 -0.24 2.24 0.05 -1.19 -1.93 116.97 116.25 3ihi h TYR 224 Ca 0.19 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.87 3ihi h TYR 224 Cb 0.16 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.89 3ihi h TYR 224 CO -0.14 0.51 -0.30 0.00 -1.05 0.00 0.00 178.16 177.18 3ihi h ALA 225 N 1.49 1.03 -0.22 3.88 0.00 -0.84 -1.77 119.26 122.83 3ihi h ALA 225 Ca -0.06 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 3ihi h ALA 225 Cb 1.45 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 3ihi h ALA 225 CO 0.06 0.59 0.12 1.25 0.00 0.00 0.00 179.25 181.27 3ihi h LEU 226 N 0.42 0.28 -0.91 0.00 5.85 -0.86 -1.49 115.31 118.60 3ihi h LEU 226 Ca 0.05 -0.08 0.10 0.00 0.84 0.00 0.00 57.88 58.79 3ihi h LEU 226 Cb 0.75 -0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.63 3ihi h LEU 226 CO 0.06 0.28 0.56 0.25 -0.34 0.00 0.00 178.44 179.24 3ihi h LEU 227 N 0.25 0.82 -0.44 2.25 5.85 -1.26 -0.13 115.31 122.67 3ihi h LEU 227 Ca 0.08 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 3ihi h LEU 227 Cb 0.06 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 3ihi h LEU 227 CO -0.01 0.47 0.16 0.74 -0.34 0.00 0.00 178.44 179.46 3ihi h THR 228 N 0.93 1.21 -0.65 1.05 2.02 -0.97 -0.64 112.91 115.85 3ihi h THR 228 Ca 0.44 -0.66 0.03 0.00 0.77 0.00 0.00 66.41 66.99 3ihi h THR 228 Cb 0.37 0.83 -0.04 0.00 -1.74 0.00 0.00 68.15 67.56 3ihi h THR 228 CO -0.24 0.24 0.39 1.88 0.37 0.00 0.00 175.52 178.17 3ihi h TYR 229 N 0.56 0.73 -0.26 3.16 -1.99 -0.38 -1.27 116.97 117.53 3ihi h TYR 229 Ca 0.14 0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.86 3ihi h TYR 229 Cb 0.22 -0.24 -0.01 0.00 2.00 0.00 0.00 36.73 38.70 3ihi h TYR 229 CO 0.01 0.41 0.01 0.52 -0.00 0.00 0.00 178.16 179.10 3ihi h MET 230 N 0.76 0.45 -0.41 4.88 2.86 -0.67 -1.41 114.93 121.39 3ihi h MET 230 Ca 0.27 -0.14 -0.11 0.00 -2.06 0.00 0.00 59.70 57.66 3ihi h MET 230 Cb 0.05 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.65 3ihi h MET 230 CO -0.12 0.60 -0.19 0.82 1.06 0.00 0.00 176.91 179.08 3ihi h ILE 231 N 0.23 1.27 -0.44 -1.22 2.04 -1.01 -2.32 117.51 116.07 3ihi h ILE 231 Ca 0.07 -1.29 -0.06 0.00 1.00 0.00 0.00 64.86 64.58 3ihi h ILE 231 Cb 0.39 1.16 -0.02 0.00 -0.74 0.00 0.00 36.82 37.62 3ihi h ILE 231 CO 0.01 0.44 0.03 0.00 0.00 0.00 0.00 178.15 178.62 3ihi h ALA 232 N 1.09 0.58 -0.35 1.87 0.00 -1.10 -1.70 119.26 119.65 3ihi h ALA 232 Ca 0.10 -0.25 0.06 0.00 0.00 0.00 0.00 54.91 54.82 3ihi h ALA 232 Cb 0.70 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 3ihi h ALA 232 CO 0.05 0.35 0.02 1.25 0.00 0.00 0.00 179.25 180.92 3ihi h HIS 233 N 0.60 0.02 0.00 0.00 -0.00 -1.09 -0.14 115.15 114.53 3ihi h HIS 233 Ca 0.13 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.52 3ihi h HIS 233 Cb 0.45 0.05 0.00 0.00 -0.00 0.00 0.00 27.41 27.91 3ihi h HIS 233 CO 0.03 -0.04 0.00 0.44 -0.00 0.00 0.00 177.93 178.36 3ihi n ILE 234 N -5.16 0.34 0.33 6.26 -5.35 -0.89 -2.99 119.36 111.90 3ihi n ILE 234 Ca 0.01 -0.06 0.08 0.00 -0.27 0.00 0.00 62.75 62.52 3ihi n ILE 234 Cb 0.18 -0.61 0.13 0.00 -1.74 0.00 0.00 39.64 37.60 3ihi n ILE 234 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 3ihi n THR 235 N -1.80 0.39 -1.69 7.28 -2.24 -0.66 -4.97 114.28 110.59 3ihi n THR 235 Ca 0.06 -0.70 -0.05 0.00 -2.27 0.00 0.00 64.05 61.10 3ihi n THR 235 Cb 0.35 1.02 -0.01 0.00 -2.10 0.00 0.00 70.33 69.59 3ihi n THR 235 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ihi n GLY 236 N 0.99 0.41 3.76 3.38 0.00 -0.57 -4.90 105.19 108.26 3ihi n GLY 236 Ca 0.13 -0.76 -0.26 0.00 0.00 0.00 0.00 46.02 45.13 3ihi n GLY 236 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ihi s LEU 237 N -1.21 2.97 -0.01 0.99 1.43 -0.17 -5.03 118.68 117.65 3ihi s LEU 237 Ca 0.00 -1.17 -0.02 0.00 -1.03 0.00 0.00 54.13 51.91 3ihi s LEU 237 Cb 0.00 -1.32 -0.04 0.00 0.03 0.00 0.00 46.19 44.86 3ihi s LEU 237 CO 0.00 -0.65 0.16 -1.10 0.23 0.00 0.00 176.35 174.99 3ihi s GLN 238 N -3.95 3.37 0.31 1.70 -1.52 -0.83 -4.22 119.66 114.52 3ihi s GLN 238 Ca 0.36 -0.35 -0.29 0.00 -1.95 0.00 0.00 55.36 53.13 3ihi s GLN 238 Cb 0.03 -3.06 -0.11 0.00 -0.22 0.00 0.00 33.01 29.66 3ihi s GLN 238 CO 0.20 0.67 1.45 -2.14 -0.25 0.00 0.00 175.29 175.23 3ihi s PRO 239 N -1.89 4.22 0.00 2.91 0.02 -1.26 -0.62 135.00 138.38 3ihi s PRO 239 Ca 0.26 2.40 0.00 0.00 0.02 0.00 0.00 61.00 63.69 3ihi s PRO 239 Cb -0.12 -3.05 0.00 0.00 0.02 0.00 0.00 34.50 31.35 3ihi s PRO 239 CO 0.18 -0.44 0.00 0.41 -0.33 0.00 0.00 177.00 176.82 3ihi n GLY 240 N 1.47 0.01 3.32 0.52 0.00 0.78 -4.20 105.19 107.08 3ihi n GLY 240 Ca 0.04 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.84 3ihi n GLY 240 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ihi s ASP 241 N -0.73 2.67 -0.23 1.61 1.01 -1.26 -0.73 116.67 119.00 3ihi s ASP 241 Ca 0.00 -0.81 -0.06 0.00 0.71 0.00 0.00 52.55 52.40 3ihi s ASP 241 Cb 0.00 -0.16 -0.02 0.00 1.01 0.00 0.00 42.92 43.75 3ihi s ASP 241 CO 0.00 -0.00 0.02 0.12 0.21 0.00 0.00 175.17 175.52 3ihi s PHE 242 N -1.76 3.03 -0.29 4.23 5.36 0.76 -1.60 117.98 127.72 3ihi s PHE 242 Ca 0.13 -0.60 -0.09 0.00 -0.96 0.00 0.00 56.93 55.41 3ihi s PHE 242 Cb -0.07 -2.16 -0.02 0.00 -0.34 0.00 0.00 43.02 40.44 3ihi s PHE 242 CO 0.06 -0.39 0.12 0.08 -1.46 0.00 0.00 175.22 173.63 3ihi s VAL 243 N 1.43 4.50 -0.32 3.12 1.01 0.28 -0.28 120.40 130.13 3ihi s VAL 243 Ca 0.05 -0.32 -0.12 0.00 0.00 0.00 0.00 61.98 61.59 3ihi s VAL 243 Cb -0.15 -3.22 -0.02 0.00 0.00 0.00 0.00 36.38 32.99 3ihi s VAL 243 CO 0.01 0.17 0.21 -2.28 0.00 0.00 0.00 175.10 173.21 3ihi s HIS 244 N 1.61 3.21 -0.16 5.22 2.46 0.61 -1.60 115.29 126.66 3ihi s HIS 244 Ca 0.05 -0.26 -0.01 0.00 0.47 0.00 0.00 55.06 55.31 3ihi s HIS 244 Cb -0.16 -2.43 -0.01 0.00 -0.13 0.00 0.00 32.58 29.85 3ihi s HIS 244 CO 0.05 -0.36 -0.12 0.99 -2.47 0.00 0.00 174.74 172.83 3ihi s THR 245 N 1.70 2.96 0.04 0.89 2.01 -0.18 -1.37 115.64 121.69 3ihi s THR 245 Ca 0.06 -0.67 0.02 0.00 0.31 0.00 0.00 61.69 61.41 3ihi s THR 245 Cb -0.17 -2.26 -0.04 0.00 0.01 0.00 0.00 72.50 70.04 3ihi s THR 245 CO 0.09 0.50 0.03 -0.76 -0.69 0.00 0.00 174.62 173.80 3ihi s LEU 246 N 0.73 3.63 0.00 4.42 1.43 -0.34 -0.49 118.68 128.07 3ihi s LEU 246 Ca -0.05 -0.03 0.00 0.00 -1.03 0.00 0.00 54.13 53.02 3ihi s LEU 246 Cb -0.15 -2.22 0.00 0.00 0.03 0.00 0.00 46.19 43.85 3ihi s LEU 246 CO 0.01 0.23 0.00 0.61 0.23 0.00 0.00 176.35 177.43 3ihi n GLY 247 N 0.92 1.03 3.55 -3.19 0.00 0.48 -2.18 105.19 105.81 3ihi n GLY 247 Ca -0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 3ihi n GLY 247 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3ihi s ASP 248 N -1.00 6.01 -0.25 1.61 -1.08 0.39 -0.83 116.67 121.53 3ihi s ASP 248 Ca 0.00 -0.65 -0.19 0.00 -0.52 0.00 0.00 52.55 51.18 3ihi s ASP 248 Cb 0.00 -2.56 -0.02 0.00 -1.46 0.00 0.00 42.92 38.88 3ihi s ASP 248 CO 0.00 -1.93 0.58 0.00 0.52 0.00 0.00 175.17 174.34 3ihi s ALA 249 N 6.52 3.59 0.10 3.66 0.00 -0.35 -0.55 121.76 134.73 3ihi s ALA 249 Ca 0.47 -0.49 -0.03 0.00 0.00 0.00 0.00 51.96 51.91 3ihi s ALA 249 Cb -0.06 -2.95 -0.03 0.00 0.00 0.00 0.00 23.12 20.07 3ihi s ALA 249 CO 0.07 -0.74 0.08 -3.38 0.00 0.00 0.00 175.76 171.79 3ihi s HIS 250 N 2.32 0.55 -0.09 0.00 -3.43 0.64 -1.36 115.29 113.92 3ihi s HIS 250 Ca 0.24 -1.00 0.01 0.00 -0.80 0.00 0.00 55.06 53.51 3ihi s HIS 250 Cb -0.16 -0.32 0.02 0.00 -1.43 0.00 0.00 32.58 30.69 3ihi s HIS 250 CO 0.09 -0.50 -0.11 0.42 -2.00 0.00 0.00 174.74 172.64 3ihi s ILE 251 N -3.96 1.15 0.30 -5.38 1.01 0.18 -0.86 121.20 113.64 3ihi s ILE 251 Ca 0.14 -0.43 -0.30 0.00 0.00 0.00 0.00 60.65 60.06 3ihi s ILE 251 Cb 0.07 -1.09 -0.11 0.00 0.01 0.00 0.00 42.46 41.34 3ihi s ILE 251 CO -0.05 0.37 1.52 -0.31 0.00 0.00 0.00 174.94 176.47 3ihi s TYR 252 N 1.13 2.81 0.37 3.97 1.51 -1.26 -1.20 117.35 124.69 3ihi s TYR 252 Ca -0.05 0.94 0.10 0.00 -1.01 0.00 0.00 57.07 57.05 3ihi s TYR 252 Cb -0.14 -3.97 0.84 0.00 -0.11 0.00 0.00 41.96 38.58 3ihi s TYR 252 CO -0.02 -3.15 1.89 -0.07 -1.11 0.00 0.00 175.55 173.08 3ihi h LEU 253 N 4.52 0.62 -2.23 -1.29 3.38 -1.81 0.13 115.31 118.63 3ihi h LEU 253 Ca -0.47 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.46 3ihi h LEU 253 Cb 1.22 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.84 3ihi h LEU 253 CO 0.76 0.32 0.09 0.59 0.09 0.00 0.00 178.44 180.29 3ihi n ASN 254 N -4.54 2.93 -0.31 -0.43 4.13 -1.26 -2.54 115.26 113.24 3ihi n ASN 254 Ca 0.16 -2.43 0.03 0.00 1.68 0.00 0.00 54.58 54.02 3ihi n ASN 254 Cb 0.45 -0.59 0.06 0.00 -1.54 0.00 0.00 39.78 38.16 3ihi n ASN 254 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 3ihi n HIS 255 N 0.10 0.13 -0.07 3.10 8.25 0.46 -4.88 115.22 122.32 3ihi n HIS 255 Ca 0.14 -0.25 -0.11 0.00 -0.26 0.00 0.00 57.72 57.24 3ihi n HIS 255 Cb 0.72 -0.02 -0.05 0.00 1.12 0.00 0.00 29.99 31.76 3ihi n HIS 255 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 3ihi h ILE 256 N 1.22 1.26 -0.04 1.59 2.04 -1.53 -2.26 117.51 119.78 3ihi h ILE 256 Ca 0.00 -0.88 -0.01 0.00 1.00 0.00 0.00 64.86 64.98 3ihi h ILE 256 Cb 0.45 1.44 -0.00 0.00 -0.74 0.00 0.00 36.82 37.96 3ihi h ILE 256 CO 0.00 0.27 0.00 -0.33 0.00 0.00 0.00 178.15 178.09 3ihi h GLU 257 N 0.12 0.07 -0.14 2.37 4.39 -1.90 -0.89 114.58 118.60 3ihi h GLU 257 Ca 0.06 -0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.78 3ihi h GLU 257 Cb 0.40 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.03 3ihi h GLU 257 CO 0.01 0.34 0.15 -1.35 -1.16 0.00 0.00 179.01 177.01 3ihi h PRO 258 N -0.20 0.00 0.16 2.33 0.11 -1.91 -2.46 132.00 130.03 3ihi h PRO 258 Ca 0.01 0.00 -0.30 0.00 0.11 0.00 0.00 66.00 65.83 3ihi h PRO 258 Cb 0.31 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.43 3ihi h PRO 258 CO 0.00 0.00 -1.31 -0.07 -0.21 0.00 0.00 178.00 176.42 3ihi h LEU 259 N 0.00 0.62 -1.77 2.35 3.38 -0.75 -2.66 115.31 116.48 3ihi h LEU 259 Ca 0.07 -0.64 -0.01 0.00 0.09 0.00 0.00 57.88 57.39 3ihi h LEU 259 Cb 0.37 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 3ihi h LEU 259 CO -0.00 1.49 0.04 0.11 0.09 0.00 0.00 178.44 180.17 3ihi h LYS 260 N 0.13 0.19 -0.07 1.13 1.57 -0.71 0.45 116.57 119.26 3ihi h LYS 260 Ca -0.18 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.51 3ihi h LYS 260 Cb 2.01 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 34.28 3ihi h LYS 260 CO 0.23 0.17 -0.25 0.82 -0.57 0.00 0.00 179.45 179.86 3ihi h ILE 261 N 0.19 1.43 -0.34 1.86 2.04 -1.57 -3.26 117.51 117.87 3ihi h ILE 261 Ca 0.05 -1.65 -0.00 0.00 1.00 0.00 0.00 64.86 64.26 3ihi h ILE 261 Cb 0.06 2.31 -0.02 0.00 -0.74 0.00 0.00 36.82 38.44 3ihi h ILE 261 CO -0.00 0.47 0.19 -0.61 0.00 0.00 0.00 178.15 178.19 3ihi h GLN 262 N -0.22 0.46 0.00 2.37 4.15 -1.00 -0.82 115.11 120.05 3ihi h GLN 262 Ca -0.01 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.37 3ihi h GLN 262 Cb 0.88 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.48 3ihi h GLN 262 CO 0.05 0.34 0.00 -0.07 -1.93 0.00 0.00 178.83 177.22 3ihi h LEU 263 N 0.47 0.00 0.00 -2.39 3.38 -0.16 -2.09 115.31 114.52 3ihi h LEU 263 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3ihi h LEU 263 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 3ihi h LEU 263 CO -0.02 0.00 -0.26 1.56 0.09 0.00 0.00 178.44 179.81 3ihi h GLN 264 N 0.00 0.00 -6.55 1.13 4.20 -1.19 -3.47 115.11 109.24 3ihi h GLN 264 Ca 0.00 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.18 3ihi h GLN 264 Cb 0.23 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.02 3ihi h GLN 264 CO 0.00 0.00 0.55 1.03 -0.67 0.00 0.00 178.83 179.74 3ihi s ARG 265 N -3.20 4.47 -0.05 1.46 3.00 -0.79 -5.02 118.95 118.82 3ihi s ARG 265 Ca 0.07 1.79 -0.30 0.00 0.00 0.00 0.00 55.73 57.29 3ihi s ARG 265 Cb 0.09 -3.31 -0.03 0.00 0.00 0.00 0.00 34.95 31.70 3ihi s ARG 265 CO 0.68 -0.17 1.15 -2.00 0.00 0.00 0.00 175.30 174.95 3ihi s GLU 266 N 0.57 4.39 0.44 3.54 2.12 -1.26 -4.99 118.70 123.50 3ihi s GLU 266 Ca 0.56 1.61 -0.25 0.00 0.36 0.00 0.00 54.97 57.25 3ihi s GLU 266 Cb -0.30 -3.53 -0.08 0.00 0.26 0.00 0.00 34.13 30.48 3ihi s GLU 266 CO 0.32 -0.38 1.34 -2.14 -0.54 0.00 0.00 175.26 173.86 3ihi s PRO 267 N 2.00 3.75 0.37 4.30 0.02 -1.26 -4.89 135.00 139.29 3ihi s PRO 267 Ca 0.54 2.23 -0.12 0.00 0.02 0.00 0.00 61.00 63.67 3ihi s PRO 267 Cb -0.24 -2.63 -0.07 0.00 0.02 0.00 0.00 34.50 31.58 3ihi s PRO 267 CO 0.22 -0.70 0.75 1.03 -0.33 0.00 0.00 177.00 177.97 3ihi s ARG 268 N -2.43 3.86 0.26 5.54 3.00 -1.26 -5.01 118.95 122.91 3ihi s ARG 268 Ca 0.61 0.53 -0.28 0.00 0.00 0.00 0.00 55.73 56.59 3ihi s ARG 268 Cb -0.40 -2.42 -0.15 0.00 0.00 0.00 0.00 34.95 31.98 3ihi s ARG 268 CO 0.50 0.05 0.78 -2.30 0.00 0.00 0.00 175.30 174.33 3ihi n PRO 269 N -0.90 0.74 -1.94 3.54 -0.02 -1.26 -4.84 135.00 130.31 3ihi n PRO 269 Ca 0.03 0.26 -0.36 0.00 -2.02 0.00 0.00 63.50 61.41 3ihi n PRO 269 Cb 0.54 -1.47 0.04 0.00 -0.02 0.00 0.00 33.50 32.59 3ihi n PRO 269 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3ihi s PHE 270 N -1.06 2.33 1.15 6.00 0.08 -1.26 -4.79 117.98 120.43 3ihi s PHE 270 Ca 0.61 1.52 -0.19 0.00 0.12 0.00 0.00 56.93 58.99 3ihi s PHE 270 Cb -0.79 -3.50 0.27 0.00 -0.57 0.00 0.00 43.02 38.42 3ihi s PHE 270 CO 0.58 -2.32 1.17 -1.25 -0.10 0.00 0.00 175.22 173.30 3ihi s PRO 271 N -3.38 -0.81 0.16 0.24 0.04 -1.25 -4.72 135.00 125.27 3ihi s PRO 271 Ca 0.78 -0.19 0.08 0.00 0.04 0.00 0.00 61.00 61.70 3ihi s PRO 271 Cb -0.31 -1.66 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 3ihi s PRO 271 CO 0.35 -3.42 -0.06 0.15 0.04 0.00 0.00 177.00 174.06 3ihi s LYS 272 N -5.56 2.20 -0.13 4.56 1.02 -0.35 -0.46 119.74 121.02 3ihi s LYS 272 Ca 0.72 -1.14 -0.01 0.00 0.02 0.00 0.00 55.97 55.57 3ihi s LYS 272 Cb -0.08 -2.27 -0.02 0.00 -0.52 0.00 0.00 37.83 34.94 3ihi s LYS 272 CO 0.55 0.46 -0.11 -1.17 -0.92 0.00 0.00 175.35 174.16 3ihi s LEU 273 N -2.69 2.84 -0.07 3.17 2.96 -1.26 -0.30 118.68 123.32 3ihi s LEU 273 Ca 0.25 -0.27 0.05 0.00 -0.22 0.00 0.00 54.13 53.93 3ihi s LEU 273 Cb -0.10 -1.65 -0.01 0.00 0.50 0.00 0.00 46.19 44.94 3ihi s LEU 273 CO 0.16 0.18 -0.22 -0.54 -1.32 0.00 0.00 176.35 174.61 3ihi s LYS 274 N 0.26 2.75 -0.24 1.98 -0.14 0.07 -4.98 119.74 119.44 3ihi s LYS 274 Ca -0.08 -0.84 -0.09 0.00 -1.36 0.00 0.00 55.97 53.60 3ihi s LYS 274 Cb -0.15 -2.28 -0.04 0.00 -1.68 0.00 0.00 37.83 33.68 3ihi s LYS 274 CO 0.05 0.35 0.11 0.42 -0.76 0.00 0.00 175.35 175.52 3ihi s ILE 275 N -0.07 4.80 -2.43 2.17 1.01 -1.26 -1.30 121.20 124.11 3ihi s ILE 275 Ca -0.05 -0.01 0.28 0.00 0.00 0.00 0.00 60.65 60.87 3ihi s ILE 275 Cb -0.14 -3.24 0.56 0.00 0.01 0.00 0.00 42.46 39.65 3ihi s ILE 275 CO 0.04 0.34 1.77 0.18 0.00 0.00 0.00 174.94 177.28 3ihi n LEU 276 N 4.58 1.37 -3.72 2.97 4.77 0.34 -4.86 117.00 122.45 3ihi n LEU 276 Ca -0.16 -0.45 -0.09 0.00 -0.03 0.00 0.00 56.01 55.28 3ihi n LEU 276 Cb 0.52 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.57 3ihi n LEU 276 CO 0.33 0.23 0.36 0.00 -1.33 0.00 0.00 177.39 176.97 3ihi s ARG 277 N -2.03 1.49 -0.01 3.23 1.70 -1.26 -5.07 118.95 116.99 3ihi s ARG 277 Ca 0.38 -0.83 -0.30 0.00 -0.47 0.00 0.00 55.73 54.51 3ihi s ARG 277 Cb 0.21 0.56 -0.05 0.00 -0.57 0.00 0.00 34.95 35.10 3ihi s ARG 277 CO 0.35 -0.65 1.38 0.21 -1.08 0.00 0.00 175.30 175.50 3ihi s LYS 278 N -3.87 4.29 0.01 3.89 2.47 -1.26 -5.01 119.74 120.26 3ihi s LYS 278 Ca 0.08 1.92 0.08 0.00 -1.56 0.00 0.00 55.97 56.50 3ihi s LYS 278 Cb -0.02 -3.59 -0.02 0.00 -1.46 0.00 0.00 37.83 32.74 3ihi s LYS 278 CO -0.02 -0.57 -0.25 0.08 0.16 0.00 0.00 175.35 174.76 3ihi s VAL 279 N 2.45 1.96 -0.17 4.02 1.01 -1.26 -5.05 120.40 123.35 3ihi s VAL 279 Ca 0.63 -1.16 0.09 0.00 0.00 0.00 0.00 61.98 61.54 3ihi s VAL 279 Cb -0.30 -1.64 -0.17 0.00 0.00 0.00 0.00 36.38 34.26 3ihi s VAL 279 CO 0.25 0.46 -0.03 -0.62 0.00 0.00 0.00 175.10 175.16 3ihi n GLU 280 N 2.21 1.07 -4.05 2.72 -0.58 -1.26 -4.63 120.64 116.11 3ihi n GLU 280 Ca -0.16 0.04 -0.13 0.00 -0.42 0.00 0.00 57.16 56.49 3ihi n GLU 280 Cb 0.52 -1.41 -0.11 0.00 -0.57 0.00 0.00 31.44 29.87 3ihi n GLU 280 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 3ihi s THR 281 N -2.39 0.49 0.35 2.62 -4.23 -1.26 -4.93 115.64 106.29 3ihi s THR 281 Ca -0.15 -1.07 0.05 0.00 -1.18 0.00 0.00 61.69 59.34 3ihi s THR 281 Cb 0.06 -0.58 0.29 0.00 1.34 0.00 0.00 72.50 73.61 3ihi s THR 281 CO 0.58 -0.40 1.94 -0.29 -0.54 0.00 0.00 174.62 175.92 3ihi h ILE 282 N 4.50 1.01 0.00 2.99 6.09 -1.94 -1.76 117.51 128.40 3ihi h ILE 282 Ca -0.35 -0.27 0.00 0.00 -1.37 0.00 0.00 64.86 62.87 3ihi h ILE 282 Cb 1.20 0.16 0.00 0.00 0.47 0.00 0.00 36.82 38.65 3ihi h ILE 282 CO 0.41 0.14 0.00 0.44 -3.07 0.00 0.00 178.15 176.07 3ihi h ASP 283 N 0.78 0.00 0.67 2.19 5.19 -1.97 -3.10 116.42 120.19 3ihi h ASP 283 Ca 0.33 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.74 3ihi h ASP 283 Cb 0.29 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.80 3ihi h ASP 283 CO -0.12 0.00 -0.41 -0.67 -3.12 0.00 0.00 179.24 174.93 3ihi n ASP 284 N -2.83 0.43 -4.77 6.45 2.03 -0.66 -4.91 116.55 112.29 3ihi n ASP 284 Ca -0.01 -0.03 -0.41 0.00 0.52 0.00 0.00 54.79 54.86 3ihi n ASP 284 Cb 0.17 0.06 -0.02 0.00 -0.72 0.00 0.00 41.12 40.62 3ihi n ASP 284 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 3ihi s PHE 285 N -3.02 2.95 0.12 -0.67 0.08 -1.18 -5.00 117.98 111.25 3ihi s PHE 285 Ca 0.11 1.34 0.04 0.00 0.12 0.00 0.00 56.93 58.54 3ihi s PHE 285 Cb 0.17 -3.76 -0.04 0.00 -0.57 0.00 0.00 43.02 38.82 3ihi s PHE 285 CO 0.67 -2.15 -0.10 0.15 -0.10 0.00 0.00 175.22 173.68 3ihi s LYS 286 N -1.76 0.94 0.33 0.44 1.02 -1.26 -5.05 119.74 114.39 3ihi s LYS 286 Ca 0.50 -1.27 0.11 0.00 0.02 0.00 0.00 55.97 55.34 3ihi s LYS 286 Cb -0.41 -0.59 0.98 0.00 -0.52 0.00 0.00 37.83 37.29 3ihi s LYS 286 CO 0.54 0.08 1.68 -0.39 -0.92 0.00 0.00 175.35 176.35 3ihi h VAL 287 N 3.27 0.36 0.00 3.17 -1.51 -1.96 0.62 116.25 120.19 3ihi h VAL 287 Ca -0.37 -0.13 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 3ihi h VAL 287 Cb 1.19 -0.04 0.00 0.00 -2.13 0.00 0.00 31.29 30.31 3ihi h VAL 287 CO 0.57 0.07 0.00 -0.62 -1.23 0.00 0.00 177.57 176.35 3ihi n GLU 288 N -5.04 0.20 0.02 5.19 4.71 -1.26 -1.97 120.64 122.48 3ihi n GLU 288 Ca 0.29 0.38 0.09 0.00 -0.01 0.00 0.00 57.16 57.91 3ihi n GLU 288 Cb 0.88 -1.85 0.37 0.00 -1.01 0.00 0.00 31.44 29.83 3ihi n GLU 288 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 3ihi n ASP 289 N -2.23 0.09 -4.48 1.62 8.00 0.21 -4.80 116.55 114.97 3ihi n ASP 289 Ca 0.03 0.52 -0.28 0.00 0.71 0.00 0.00 54.79 55.76 3ihi n ASP 289 Cb 0.26 -0.54 -0.11 0.00 -0.02 0.00 0.00 41.12 40.71 3ihi n ASP 289 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3ihi s PHE 290 N -3.04 2.48 -0.16 1.24 0.08 -0.83 0.13 117.98 117.87 3ihi s PHE 290 Ca 0.08 -0.29 -0.07 0.00 0.12 0.00 0.00 56.93 56.76 3ihi s PHE 290 Cb 0.11 -1.28 0.07 0.00 -0.57 0.00 0.00 43.02 41.34 3ihi s PHE 290 CO 0.32 0.42 0.36 -1.14 -0.10 0.00 0.00 175.22 175.08 3ihi s GLN 291 N -2.35 0.30 -0.09 0.44 0.74 -0.42 -4.96 119.66 113.32 3ihi s GLN 291 Ca 0.19 0.80 -0.17 0.00 0.05 0.00 0.00 55.36 56.23 3ihi s GLN 291 Cb -0.10 0.04 -0.05 0.00 1.10 0.00 0.00 33.01 34.01 3ihi s GLN 291 CO 0.10 -0.20 0.46 0.42 -0.55 0.00 0.00 175.29 175.52 3ihi s ILE 292 N 1.85 5.14 -0.11 -2.34 -1.09 -1.26 -0.75 121.20 122.64 3ihi s ILE 292 Ca -0.06 0.92 0.03 0.00 -2.23 0.00 0.00 60.65 59.31 3ihi s ILE 292 Cb -0.10 -3.79 0.00 0.00 -1.58 0.00 0.00 42.46 36.99 3ihi s ILE 292 CO -0.11 0.39 -0.23 -1.61 -1.23 0.00 0.00 174.94 172.15 3ihi s GLU 293 N 0.22 3.08 -0.77 2.79 2.02 0.58 -4.69 118.70 121.93 3ihi s GLU 293 Ca 0.25 -0.86 -0.02 0.00 0.02 0.00 0.00 54.97 54.36 3ihi s GLU 293 Cb -0.15 -2.35 0.00 0.00 0.10 0.00 0.00 34.13 31.72 3ihi s GLU 293 CO 0.11 0.15 0.24 0.41 0.02 0.00 0.00 175.26 176.19 3ihi n GLY 294 N 3.61 0.08 3.61 -1.39 0.00 -1.26 -1.21 105.19 108.62 3ihi n GLY 294 Ca -0.19 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.04 3ihi n GLY 294 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3ihi s TYR 295 N -2.78 3.12 -0.53 1.61 5.04 -1.26 -4.16 117.35 118.39 3ihi s TYR 295 Ca 0.12 0.81 0.07 0.00 -2.44 0.00 0.00 57.07 55.63 3ihi s TYR 295 Cb -0.05 -3.54 0.24 0.00 0.35 0.00 0.00 41.96 38.96 3ihi s TYR 295 CO 0.15 -0.76 0.62 0.09 -1.34 0.00 0.00 175.55 174.31 3ihi n ASN 296 N 6.63 2.01 -4.81 4.32 3.02 -1.26 -5.08 115.26 120.09 3ihi n ASN 296 Ca 0.07 -3.06 -0.33 0.00 -0.03 0.00 0.00 54.58 51.22 3ihi n ASN 296 Cb 0.48 -0.66 -0.02 0.00 -0.61 0.00 0.00 39.78 38.97 3ihi n ASN 296 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3ihi s PRO 297 N -1.76 3.71 0.80 3.52 0.04 -1.26 -4.78 135.00 135.27 3ihi s PRO 297 Ca 0.37 1.21 -0.14 0.00 0.04 0.00 0.00 61.00 62.47 3ihi s PRO 297 Cb 0.14 -2.09 0.03 0.00 0.04 0.00 0.00 34.50 32.63 3ihi s PRO 297 CO -0.07 -0.49 0.86 0.72 0.04 0.00 0.00 177.00 178.06 3ihi n HIS 298 N -1.40 0.18 -2.10 0.56 8.25 0.72 -4.91 115.22 116.51 3ihi n HIS 298 Ca 0.08 0.36 -0.31 0.00 -0.26 0.00 0.00 57.72 57.59 3ihi n HIS 298 Cb 0.53 -2.00 -0.00 0.00 1.12 0.00 0.00 29.99 29.64 3ihi n HIS 298 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3ihi s PRO 299 N -3.57 3.70 0.00 -0.41 0.04 -1.26 -4.07 135.00 129.43 3ihi s PRO 299 Ca 0.68 0.76 0.00 0.00 0.04 0.00 0.00 61.00 62.48 3ihi s PRO 299 Cb -0.30 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.11 3ihi s PRO 299 CO 0.55 -0.44 0.04 -2.37 0.04 0.00 0.00 177.00 174.83