#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 1.48 0.26 -1.55 -0.00 -1.26 -4.86 115.22 109.29 3ihi n HIS 22 Ca 0.00 0.85 0.12 0.00 -0.00 0.00 0.00 57.72 58.69 3ihi n HIS 22 Cb 0.00 -2.28 0.77 0.00 -0.00 0.00 0.00 29.99 28.49 3ihi n HIS 22 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.34 177.12 3ihi h GLY 23 N 4.92 0.00 2.00 1.57 0.00 -1.99 -1.67 103.07 107.91 3ihi h GLY 23 Ca -0.47 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.84 3ihi h GLY 23 CO 0.84 0.00 -0.07 -2.09 0.00 0.00 0.00 176.54 175.22 3ihi h GLU 24 N 0.00 0.00 -0.51 4.80 4.81 -1.96 -2.58 114.58 119.14 3ihi h GLU 24 Ca 0.02 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.32 3ihi h GLU 24 Cb 0.10 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.45 3ihi h GLU 24 CO -0.00 0.07 0.34 -0.07 -0.73 0.00 0.00 179.01 178.62 3ihi h LEU 25 N 0.00 0.35 -0.01 1.64 3.38 -1.67 -1.96 115.31 117.05 3ihi h LEU 25 Ca -0.00 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.99 3ihi h LEU 25 Cb 0.51 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 3ihi h LEU 25 CO 0.01 0.23 -0.10 1.56 0.09 0.00 0.00 178.44 180.23 3ihi h GLN 26 N 0.40 -0.15 -0.11 1.13 4.20 -1.65 0.10 115.11 119.03 3ihi h GLN 26 Ca 0.23 0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.96 3ihi h GLN 26 Cb 0.38 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.18 3ihi h GLN 26 CO -0.06 -0.10 0.02 -0.92 -0.67 0.00 0.00 178.83 177.10 3ihi h TYR 27 N -0.16 0.03 -0.80 2.96 5.03 -1.53 -1.27 116.97 121.23 3ihi h TYR 27 Ca 0.04 0.01 0.05 0.00 2.58 0.00 0.00 58.73 61.40 3ihi h TYR 27 Cb 0.21 0.00 -0.05 0.00 1.55 0.00 0.00 36.73 38.44 3ihi h TYR 27 CO -0.16 0.01 0.50 -0.07 -1.32 0.00 0.00 178.16 177.12 3ihi h LEU 28 N 0.06 0.81 -1.45 2.82 3.38 -1.27 -0.13 115.31 119.52 3ihi h LEU 28 Ca 0.05 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 3ihi h LEU 28 Cb 0.05 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3ihi h LEU 28 CO -0.07 0.54 -0.27 -0.09 0.09 0.00 0.00 178.44 178.64 3ihi h ARG 29 N 0.95 0.01 -0.07 1.13 9.65 -0.63 -0.08 114.38 125.33 3ihi h ARG 29 Ca 0.34 -0.00 -0.24 0.00 -1.10 0.00 0.00 59.98 58.97 3ihi h ARG 29 Cb 0.09 -0.00 0.02 0.00 -1.39 0.00 0.00 29.97 28.69 3ihi h ARG 29 CO -0.14 0.28 -0.90 1.96 2.80 0.00 0.00 179.97 183.96 3ihi h GLN 30 N 0.01 0.74 -0.19 0.20 4.20 0.02 0.34 115.11 120.42 3ihi h GLN 30 Ca -0.00 -0.70 0.02 0.00 0.06 0.00 0.00 58.65 58.03 3ihi h GLN 30 Cb 0.48 0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.41 3ihi h GLN 30 CO 0.04 1.29 0.08 0.28 -0.67 0.00 0.00 178.83 179.84 3ihi h VAL 31 N 0.45 0.97 -0.17 -0.54 2.07 -0.54 -2.23 116.25 116.25 3ihi h VAL 31 Ca -0.09 -0.06 0.03 0.00 0.82 0.00 0.00 66.70 67.40 3ihi h VAL 31 Cb 1.54 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 32.06 3ihi h VAL 31 CO 0.18 0.03 -0.03 -0.08 0.02 0.00 0.00 177.57 177.69 3ihi h GLU 32 N 0.17 0.01 -0.62 1.57 4.81 -0.94 -1.43 114.58 118.16 3ihi h GLU 32 Ca 0.08 -0.00 0.13 0.00 -0.13 0.00 0.00 59.36 59.44 3ihi h GLU 32 Cb 0.04 -0.00 -0.10 0.00 0.63 0.00 0.00 28.75 29.32 3ihi h GLU 32 CO -0.07 0.01 0.06 1.25 -0.73 0.00 0.00 179.01 179.53 3ihi h HIS 33 N 0.01 0.08 -0.33 0.92 2.76 -0.74 -0.04 115.15 117.80 3ihi h HIS 33 Ca 0.08 0.04 -0.11 0.00 -2.20 0.00 0.00 60.37 58.19 3ihi h HIS 33 Cb 0.12 0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.13 3ihi h HIS 33 CO -0.19 -0.11 -0.21 0.82 -1.30 0.00 0.00 177.93 176.94 3ihi h ILE 34 N 0.18 1.29 -0.74 6.26 2.04 -0.95 0.51 117.51 126.10 3ihi h ILE 34 Ca 0.33 -1.35 0.01 0.00 1.00 0.00 0.00 64.86 64.85 3ihi h ILE 34 Cb 0.52 1.44 -0.04 0.00 -0.74 0.00 0.00 36.82 38.00 3ihi h ILE 34 CO -0.48 0.44 0.48 -0.07 0.00 0.00 0.00 178.15 178.52 3ihi h LEU 35 N 0.50 0.85 0.15 1.44 3.38 -0.87 -0.99 115.31 119.76 3ihi h LEU 35 Ca 0.07 -0.03 -0.30 0.00 0.09 0.00 0.00 57.88 57.71 3ihi h LEU 35 Cb 0.76 -0.21 0.02 0.00 0.09 0.00 0.00 40.66 41.32 3ihi h LEU 35 CO 0.06 0.62 -1.31 0.03 0.09 0.00 0.00 178.44 177.93 3ihi h ARG 36 N 1.00 0.45 0.00 1.13 3.08 -0.78 -3.41 114.38 115.84 3ihi h ARG 36 Ca 0.27 -0.70 0.00 0.00 0.07 0.00 0.00 59.98 59.61 3ihi h ARG 36 Cb -0.11 0.25 0.00 0.00 0.08 0.00 0.00 29.97 30.20 3ihi h ARG 36 CO -0.06 1.32 0.00 0.00 -1.07 0.00 0.00 179.97 180.17 3ihi s GLY 38 N -0.72 2.30 0.01 0.00 0.00 -0.38 -4.96 107.32 103.57 3ihi s GLY 38 Ca 0.00 0.79 0.01 0.00 0.00 0.00 0.00 44.72 45.51 3ihi s GLY 38 CO 0.00 1.18 0.07 -1.36 0.00 0.00 0.00 173.10 172.99 3ihi s PHE 39 N -2.08 3.24 0.33 1.90 0.40 -0.51 -4.68 117.98 116.59 3ihi s PHE 39 Ca 0.72 0.16 -0.29 0.00 -0.60 0.00 0.00 56.93 56.93 3ihi s PHE 39 Cb -0.27 -1.71 -0.10 0.00 0.51 0.00 0.00 43.02 41.45 3ihi s PHE 39 CO 0.44 0.53 1.33 0.21 0.70 0.00 0.00 175.22 178.43 3ihi s LYS 40 N -1.84 4.33 -0.28 0.44 2.47 -1.26 -0.76 119.74 122.84 3ihi s LYS 40 Ca 0.24 2.25 -0.14 0.00 -1.56 0.00 0.00 55.97 56.76 3ihi s LYS 40 Cb -0.12 -3.06 0.10 0.00 -1.46 0.00 0.00 37.83 33.29 3ihi s LYS 40 CO 0.15 -0.23 0.66 0.21 0.16 0.00 0.00 175.35 176.31 3ihi s LYS 41 N -1.79 0.65 0.40 4.03 2.20 -0.43 -4.92 119.74 119.88 3ihi s LYS 41 Ca 0.49 1.29 -0.21 0.00 -0.36 0.00 0.00 55.97 57.18 3ihi s LYS 41 Cb -0.40 0.38 -0.11 0.00 -1.51 0.00 0.00 37.83 36.19 3ihi s LYS 41 CO 0.54 -0.17 0.92 -1.21 -0.36 0.00 0.00 175.35 175.07 3ihi s GLU 42 N 2.06 4.25 0.00 4.03 0.41 -1.26 -0.85 118.70 127.34 3ihi s GLU 42 Ca -0.09 1.10 0.00 0.00 -0.41 0.00 0.00 54.97 55.57 3ihi s GLU 42 Cb -0.08 -2.29 0.00 0.00 -1.78 0.00 0.00 34.13 29.98 3ihi s GLU 42 CO -0.19 0.03 0.00 -0.40 -0.49 0.00 0.00 175.26 174.21 3ihi n ASP 43 N -0.44 0.00 -0.14 -0.19 3.85 -0.75 -4.92 116.55 113.96 3ihi n ASP 43 Ca 0.06 -0.10 0.02 0.00 -0.71 0.00 0.00 54.79 54.06 3ihi n ASP 43 Cb 0.53 0.00 0.31 0.00 -1.35 0.00 0.00 41.12 40.61 3ihi n ASP 43 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.20 176.10 3ihi h ARG 44 N 0.00 0.83 -0.61 0.11 2.43 -1.99 -1.64 114.38 113.50 3ihi h ARG 44 Ca 0.00 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 3ihi h ARG 44 Cb 0.00 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 3ihi h ARG 44 CO 0.00 0.55 0.01 0.25 -1.51 0.00 0.00 179.97 179.27 3ihi n THR 45 N -4.44 2.62 -3.80 0.20 -2.24 -1.26 -4.93 114.28 100.43 3ihi n THR 45 Ca 0.06 -1.33 -0.29 0.00 -2.27 0.00 0.00 64.05 60.22 3ihi n THR 45 Cb 0.04 -0.30 -0.02 0.00 -2.10 0.00 0.00 70.33 67.95 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 0.56 -0.46 3.88 3.38 0.00 -0.62 -5.00 105.19 106.93 3ihi n GLY 46 Ca 0.27 0.10 -0.36 0.00 0.00 0.00 0.00 46.02 46.03 3ihi n GLY 46 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ihi s THR 47 N -3.05 5.44 0.42 2.61 2.01 -1.26 -4.75 115.64 117.06 3ihi s THR 47 Ca 0.57 0.16 -0.15 0.00 0.31 0.00 0.00 61.69 62.59 3ihi s THR 47 Cb -0.31 -3.47 -0.08 0.00 0.01 0.00 0.00 72.50 68.65 3ihi s THR 47 CO 0.70 0.52 0.86 -0.83 -0.69 0.00 0.00 174.62 175.18 3ihi s GLY 48 N -1.31 2.14 0.13 4.40 0.00 -1.26 -1.81 107.32 109.61 3ihi s GLY 48 Ca 0.20 0.07 0.03 0.00 0.00 0.00 0.00 44.72 45.01 3ihi s GLY 48 CO 0.09 0.30 -0.06 -0.51 0.00 0.00 0.00 173.10 172.92 3ihi s THR 49 N -2.33 0.85 -0.14 0.90 -4.23 -0.03 -2.40 115.64 108.26 3ihi s THR 49 Ca 0.56 -1.98 -0.09 0.00 -1.18 0.00 0.00 61.69 58.99 3ihi s THR 49 Cb -0.10 -1.83 -0.05 0.00 1.34 0.00 0.00 72.50 71.87 3ihi s THR 49 CO 0.25 -0.75 0.18 -0.76 -0.54 0.00 0.00 174.62 173.00 3ihi s LEU 50 N -3.11 4.32 -0.00 4.79 1.43 -0.56 -1.32 118.68 124.22 3ihi s LEU 50 Ca 0.16 0.43 0.00 0.00 -1.03 0.00 0.00 54.13 53.70 3ihi s LEU 50 Cb 0.05 -2.15 0.00 0.00 0.03 0.00 0.00 46.19 44.11 3ihi s LEU 50 CO -0.01 0.29 -0.01 -0.55 0.23 0.00 0.00 176.35 176.30 3ihi s SER 51 N -0.40 0.16 0.02 2.29 0.15 0.06 -0.99 113.70 114.99 3ihi s SER 51 Ca 0.14 -0.02 0.05 0.00 0.70 0.00 0.00 55.95 56.81 3ihi s SER 51 Cb -0.12 -0.03 -0.02 0.00 -1.71 0.00 0.00 66.02 64.14 3ihi s SER 51 CO 0.03 0.01 -0.15 -0.69 1.20 0.00 0.00 173.24 173.63 3ihi s VAL 52 N 0.05 1.19 -0.24 4.45 1.01 -0.21 -1.42 120.40 125.22 3ihi s VAL 52 Ca -0.00 -0.89 -0.08 0.00 0.00 0.00 0.00 61.98 61.01 3ihi s VAL 52 Cb -0.01 -1.04 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 3ihi s VAL 52 CO -0.00 0.14 0.10 0.12 0.00 0.00 0.00 175.10 175.46 3ihi s PHE 53 N -0.66 3.14 0.00 5.22 5.36 -1.26 -1.30 117.98 128.48 3ihi s PHE 53 Ca 0.04 -0.21 0.00 0.00 -0.96 0.00 0.00 56.93 55.80 3ihi s PHE 53 Cb -0.07 -2.24 0.00 0.00 -0.34 0.00 0.00 43.02 40.37 3ihi s PHE 53 CO 0.01 -0.22 0.00 0.41 -1.46 0.00 0.00 175.22 173.95 3ihi n GLY 54 N 4.71 -0.98 3.20 13.12 0.00 -0.17 -5.00 105.19 120.07 3ihi n GLY 54 Ca -0.16 -0.74 -0.10 0.00 0.00 0.00 0.00 46.02 45.02 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 -1.07 0.75 -0.09 1.61 -1.94 -1.02 -4.99 119.30 112.55 3ihi s MET 55 Ca 0.00 -0.67 -0.08 0.00 -1.71 0.00 0.00 55.69 53.22 3ihi s MET 55 Cb 0.00 0.31 0.02 0.00 2.01 0.00 0.00 34.83 37.18 3ihi s MET 55 CO 0.00 -0.23 0.25 -1.14 -0.01 0.00 0.00 175.02 173.89 3ihi s GLN 56 N -2.84 0.29 0.06 2.03 0.74 -1.26 -1.17 119.66 117.51 3ihi s GLN 56 Ca -0.03 0.35 0.01 0.00 0.05 0.00 0.00 55.36 55.74 3ihi s GLN 56 Cb 0.00 0.13 -0.03 0.00 1.10 0.00 0.00 33.01 34.21 3ihi s GLN 56 CO -0.05 -0.04 -0.05 0.00 -0.55 0.00 0.00 175.29 174.60 3ihi s ALA 57 N 0.16 0.65 -0.17 1.58 0.00 -0.61 -4.99 121.76 118.38 3ihi s ALA 57 Ca -0.00 -1.09 0.01 0.00 0.00 0.00 0.00 51.96 50.88 3ihi s ALA 57 Cb -0.02 0.16 0.02 0.00 0.00 0.00 0.00 23.12 23.28 3ihi s ALA 57 CO 0.00 -0.22 -0.19 0.50 0.00 0.00 0.00 175.76 175.85 3ihi s ARG 58 N -3.06 3.03 -0.27 0.00 3.52 -1.26 0.07 118.95 120.97 3ihi s ARG 58 Ca 0.02 -0.82 -0.05 0.00 -0.13 0.00 0.00 55.73 54.75 3ihi s ARG 58 Cb 0.01 -2.58 0.01 0.00 -1.56 0.00 0.00 34.95 30.83 3ihi s ARG 58 CO -0.05 -0.17 0.03 0.71 -0.81 0.00 0.00 175.30 175.01 3ihi s TYR 59 N 1.21 3.10 0.29 5.12 2.02 0.13 -4.97 117.35 124.26 3ihi s TYR 59 Ca 0.03 -1.10 -0.30 0.00 -0.37 0.00 0.00 57.07 55.33 3ihi s TYR 59 Cb -0.14 -2.19 -0.12 0.00 -0.40 0.00 0.00 41.96 39.12 3ihi s TYR 59 CO -0.10 -0.60 1.46 0.45 -1.57 0.00 0.00 175.55 175.19 3ihi n SER 60 N 4.81 3.26 -0.37 2.29 2.88 -1.26 -0.47 113.62 124.76 3ihi n SER 60 Ca -0.15 1.16 0.04 0.00 -1.33 0.00 0.00 58.87 58.59 3ihi n SER 60 Cb 0.48 -1.52 0.11 0.00 -0.75 0.00 0.00 64.21 62.53 3ihi n SER 60 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3ihi n LEU 61 N 1.74 2.63 -4.51 2.46 4.77 0.07 -4.59 117.00 119.58 3ihi n LEU 61 Ca 0.08 -2.23 -0.42 0.00 -0.03 0.00 0.00 56.01 53.41 3ihi n LEU 61 Cb 0.35 -0.20 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 3ihi n LEU 61 CO 0.63 0.64 0.98 -0.13 -1.33 0.00 0.00 177.39 178.17 3ihi s ARG 62 N -1.41 3.17 -1.81 3.23 0.52 -1.24 -4.07 118.95 117.34 3ihi s ARG 62 Ca 0.18 -0.48 0.00 0.00 -0.52 0.00 0.00 55.73 54.91 3ihi s ARG 62 Cb 0.12 -4.19 0.00 0.00 0.52 0.00 0.00 34.95 31.40 3ihi s ARG 62 CO 0.08 -1.97 0.00 -0.25 0.02 0.00 0.00 175.30 173.17 3ihi n ASP 63 N 8.58 -5.41 -3.78 0.23 8.00 -1.26 -4.94 116.55 117.97 3ihi n ASP 63 Ca 0.00 0.20 -0.09 0.00 0.71 0.00 0.00 54.79 55.61 3ihi n ASP 63 Cb 0.47 -4.52 -0.04 0.00 -0.02 0.00 0.00 41.12 37.02 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 -4.35 1.48 -0.04 -1.24 -1.05 -1.26 -4.86 118.70 107.38 3ihi s GLU 64 Ca 0.00 -0.92 -0.00 0.00 -0.15 0.00 0.00 54.97 53.89 3ihi s GLU 64 Cb 0.00 0.53 0.03 0.00 -0.44 0.00 0.00 34.13 34.25 3ihi s GLU 64 CO 0.00 -0.64 0.02 0.12 0.95 0.00 0.00 175.26 175.71 3ihi s PHE 65 N -3.90 0.31 -1.59 4.83 5.36 0.00 -4.48 117.98 118.52 3ihi s PHE 65 Ca 0.11 0.03 -0.11 0.00 -0.96 0.00 0.00 56.93 56.00 3ihi s PHE 65 Cb -0.02 -0.49 -0.06 0.00 -0.34 0.00 0.00 43.02 42.11 3ihi s PHE 65 CO 0.00 -0.18 2.79 -0.35 -1.46 0.00 0.00 175.22 176.03 3ihi n PRO 66 N 4.60 3.51 -3.34 10.12 -0.04 -1.26 -3.96 135.00 144.62 3ihi n PRO 66 Ca -0.18 -2.30 -0.40 0.00 -0.04 0.00 0.00 63.50 60.58 3ihi n PRO 66 Cb 0.50 -2.92 -0.09 0.00 -0.04 0.00 0.00 33.50 30.96 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 0.65 4.24 0.50 1.53 2.96 -1.26 -4.39 118.68 122.91 3ihi s LEU 67 Ca 0.64 0.07 -0.23 0.00 -0.22 0.00 0.00 54.13 54.40 3ihi s LEU 67 Cb 0.17 -2.47 -0.06 0.00 0.50 0.00 0.00 46.19 44.33 3ihi s LEU 67 CO -0.07 -0.32 1.36 -0.76 -1.32 0.00 0.00 176.35 175.24 3ihi s LEU 68 N 2.17 3.97 -0.06 -0.68 1.02 -1.26 -4.70 118.68 119.14 3ihi s LEU 68 Ca 0.16 2.77 0.13 0.00 0.02 0.00 0.00 54.13 57.20 3ihi s LEU 68 Cb -0.16 -4.14 -0.19 0.00 0.02 0.00 0.00 46.19 41.72 3ihi s LEU 68 CO 0.11 -1.34 0.20 0.35 0.02 0.00 0.00 176.35 175.69 3ihi n THR 69 N -0.64 0.33 0.30 5.49 -2.24 -1.26 -4.26 114.28 112.00 3ihi n THR 69 Ca 0.08 -0.40 0.14 0.00 -2.27 0.00 0.00 64.05 61.61 3ihi n THR 69 Cb 0.44 -0.14 0.66 0.00 -2.10 0.00 0.00 70.33 69.19 3ihi n THR 69 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 3ihi h THR 70 N 0.00 0.00 -3.38 4.28 1.35 -1.90 0.18 112.91 113.43 3ihi h THR 70 Ca -0.13 -0.19 -0.08 0.00 -0.55 0.00 0.00 66.41 65.46 3ihi h THR 70 Cb 1.06 0.94 -0.15 0.00 -1.73 0.00 0.00 68.15 68.28 3ihi h THR 70 CO 0.01 0.00 -0.20 -1.59 -0.25 0.00 0.00 175.52 173.49 3ihi s LYS 71 N -3.57 0.91 0.08 4.72 -2.85 -1.26 -4.67 119.74 113.10 3ihi s LYS 71 Ca 0.01 -0.62 -0.31 0.00 -1.00 0.00 0.00 55.97 54.04 3ihi s LYS 71 Cb 0.09 0.39 -0.07 0.00 -2.06 0.00 0.00 37.83 36.18 3ihi s LYS 71 CO 0.37 -0.32 1.31 0.50 0.10 0.00 0.00 175.35 177.32 3ihi s ARG 72 N -3.14 4.36 0.02 1.78 3.52 -1.20 -4.74 118.95 119.55 3ihi s ARG 72 Ca -0.01 1.94 -0.06 0.00 -0.13 0.00 0.00 55.73 57.47 3ihi s ARG 72 Cb 0.01 -3.31 -0.05 0.00 -1.56 0.00 0.00 34.95 30.04 3ihi s ARG 72 CO -0.07 -0.38 0.26 0.08 -0.81 0.00 0.00 175.30 174.39 3ihi s VAL 73 N 1.19 5.31 -1.18 7.11 1.01 -1.26 -4.88 120.40 127.69 3ihi s VAL 73 Ca 0.62 0.11 -0.17 0.00 0.00 0.00 0.00 61.98 62.54 3ihi s VAL 73 Cb -0.33 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 3ihi s VAL 73 CO 0.29 0.34 2.09 0.33 0.00 0.00 0.00 175.10 178.15 3ihi n PHE 74 N 1.02 2.92 -0.26 5.22 7.35 -1.26 -4.77 117.46 127.68 3ihi n PHE 74 Ca -0.10 -2.49 0.04 0.00 -0.76 0.00 0.00 57.45 54.14 3ihi n PHE 74 Cb 0.53 -2.23 0.18 0.00 0.35 0.00 0.00 39.48 38.30 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 6.86 0.59 -0.58 -5.13 2.91 -2.00 -1.10 115.95 117.50 3ihi h TRP 75 Ca 0.50 0.03 0.06 0.00 1.13 0.00 0.00 58.89 60.62 3ihi h TRP 75 Cb 0.66 -0.15 -0.06 0.00 -0.51 0.00 0.00 29.16 29.11 3ihi h TRP 75 CO 1.37 0.14 0.28 -0.22 -1.03 0.00 0.00 178.44 178.97 3ihi h LYS 76 N 0.52 0.50 -0.67 2.65 3.64 -2.00 -1.37 116.57 119.85 3ihi h LYS 76 Ca 0.40 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.69 3ihi h LYS 76 Cb 0.55 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.23 3ihi h LYS 76 CO -0.35 0.33 0.17 0.78 -2.27 0.00 0.00 179.45 178.11 3ihi h GLY 77 N 0.52 1.13 0.17 5.01 0.00 -1.64 -2.01 103.07 106.25 3ihi h GLY 77 Ca 0.27 -0.69 0.05 0.00 0.00 0.00 0.00 47.33 46.97 3ihi h GLY 77 CO -0.21 0.64 -0.27 -2.08 0.00 0.00 0.00 176.54 174.62 3ihi h VAL 78 N 1.00 0.35 -0.15 4.60 2.07 -0.68 -1.52 116.25 121.92 3ihi h VAL 78 Ca 0.21 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.68 3ihi h VAL 78 Cb 0.34 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 30.47 3ihi h VAL 78 CO 0.00 0.00 -0.10 0.25 0.02 0.00 0.00 177.57 177.74 3ihi h LEU 79 N -0.31 0.35 -0.22 2.57 5.85 -1.14 -0.93 115.31 121.48 3ihi h LEU 79 Ca 0.12 -0.44 -0.04 0.00 0.84 0.00 0.00 57.88 58.35 3ihi h LEU 79 Cb 0.49 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 3ihi h LEU 79 CO -0.36 0.72 -0.02 -0.33 -0.34 0.00 0.00 178.44 178.10 3ihi h GLU 80 N -0.01 0.41 -0.11 1.25 4.39 -1.41 -0.58 114.58 118.52 3ihi h GLU 80 Ca 0.03 -0.14 0.04 0.00 0.34 0.00 0.00 59.36 59.63 3ihi h GLU 80 Cb 0.60 -0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 29.18 3ihi h GLU 80 CO 0.03 0.62 -0.16 1.49 -1.16 0.00 0.00 179.01 179.82 3ihi h GLU 81 N 0.16 -0.21 -0.39 2.33 4.81 -1.26 0.14 114.58 120.16 3ihi h GLU 81 Ca 0.06 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.37 3ihi h GLU 81 Cb 0.45 0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.82 3ihi h GLU 81 CO 0.02 -0.14 0.07 1.25 -0.73 0.00 0.00 179.01 179.48 3ihi h LEU 82 N -0.21 -0.01 -1.47 1.64 5.85 -0.97 -0.21 115.31 119.93 3ihi h LEU 82 Ca 0.09 0.07 0.08 0.00 0.84 0.00 0.00 57.88 58.96 3ihi h LEU 82 Cb 0.34 0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 3ihi h LEU 82 CO -0.24 0.03 0.45 -0.07 -0.34 0.00 0.00 178.44 178.27 3ihi h LEU 83 N 0.19 0.55 -0.21 2.25 4.07 -0.83 -0.65 115.31 120.68 3ihi h LEU 83 Ca 0.19 0.01 -0.14 0.00 0.08 0.00 0.00 57.88 58.02 3ihi h LEU 83 Cb 0.23 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 41.86 3ihi h LEU 83 CO -0.26 0.35 -0.40 -0.25 -1.08 0.00 0.00 178.44 176.80 3ihi h TRP 84 N 0.62 0.81 -0.39 1.13 7.01 0.24 -2.19 115.95 123.18 3ihi h TRP 84 Ca 0.31 -0.29 0.06 0.00 2.11 0.00 0.00 58.89 61.08 3ihi h TRP 84 Cb 0.38 -0.15 -0.05 0.00 -2.10 0.00 0.00 29.16 27.24 3ihi h TRP 84 CO -0.00 1.05 0.07 0.74 -2.79 0.00 0.00 178.44 177.51 3ihi h PHE 85 N 0.34 0.11 -0.75 2.65 0.04 -0.20 -2.73 116.94 116.40 3ihi h PHE 85 Ca 0.01 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.81 3ihi h PHE 85 Cb 1.00 0.01 -0.04 0.00 2.20 0.00 0.00 35.95 39.12 3ihi h PHE 85 CO 0.09 0.00 0.49 0.82 -0.60 0.00 0.00 178.31 179.11 3ihi h ILE 86 N 0.19 1.20 0.00 -0.55 2.04 -0.93 0.13 117.51 119.58 3ihi h ILE 86 Ca 0.19 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.68 3ihi h ILE 86 Cb 0.23 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.41 3ihi h ILE 86 CO -0.26 0.19 0.00 2.29 0.00 0.00 0.00 178.15 180.37 3ihi n LYS 87 N -4.42 0.74 -0.79 2.37 2.85 -0.84 -4.87 118.16 113.20 3ihi n LYS 87 Ca 0.08 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.34 3ihi n LYS 87 Cb 0.04 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 32.92 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 1.11 0.55 3.76 2.58 0.00 0.44 -5.01 105.19 108.63 3ihi n GLY 88 Ca 0.20 -0.54 -0.39 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.49 7.10 -0.18 1.61 0.15 -1.05 -3.98 113.70 114.86 3ihi s SER 89 Ca 0.00 2.25 0.15 0.00 0.70 0.00 0.00 55.95 59.05 3ihi s SER 89 Cb 0.00 -2.62 0.38 0.00 -1.71 0.00 0.00 66.02 62.07 3ihi s SER 89 CO 0.00 -0.26 1.22 0.35 1.20 0.00 0.00 173.24 175.75 3ihi n THR 90 N 0.87 2.10 -3.80 6.45 -2.24 -1.26 -4.15 114.28 112.25 3ihi n THR 90 Ca 0.00 -2.70 -0.37 0.00 -2.27 0.00 0.00 64.05 58.71 3ihi n THR 90 Cb 0.46 -0.25 -0.12 0.00 -2.10 0.00 0.00 70.33 68.32 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 -2.95 5.19 0.55 3.42 3.84 -1.26 -2.16 114.94 121.57 3ihi s ASN 91 Ca 0.36 -1.48 0.22 0.00 0.21 0.00 0.00 52.86 52.17 3ihi s ASN 91 Cb 0.33 -1.82 1.50 0.00 -0.55 0.00 0.00 41.25 40.72 3ihi s ASN 91 CO -0.01 -0.39 2.19 0.00 -2.79 0.00 0.00 177.10 176.10 3ihi h ALA 92 N 8.11 1.82 -0.59 1.71 0.00 -0.27 -1.97 119.26 128.07 3ihi h ALA 92 Ca -0.20 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 3ihi h ALA 92 Cb 1.07 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 3ihi h ALA 92 CO 0.62 -0.02 0.27 0.87 0.00 0.00 0.00 179.25 180.99 3ihi h LYS 93 N 0.00 0.83 0.00 0.00 1.79 -1.90 -1.19 116.57 116.11 3ihi h LYS 93 Ca 0.01 -0.11 -0.04 0.00 -2.18 0.00 0.00 60.65 58.33 3ihi h LYS 93 Cb 0.03 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 30.52 3ihi h LYS 93 CO -0.00 0.66 -0.17 1.49 -1.08 0.00 0.00 179.45 180.35 3ihi h GLU 94 N 0.83 0.00 0.10 3.15 4.81 -1.74 -1.03 114.58 120.71 3ihi h GLU 94 Ca 0.20 0.00 -0.33 0.00 -0.13 0.00 0.00 59.36 59.10 3ihi h GLU 94 Cb 0.11 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 3ihi h GLU 94 CO -0.02 0.17 -1.79 1.25 -0.73 0.00 0.00 179.01 177.89 3ihi h LEU 95 N 0.00 0.34 -0.92 1.64 5.85 -1.56 -3.38 115.31 117.29 3ihi h LEU 95 Ca -0.00 -0.64 0.08 0.00 0.84 0.00 0.00 57.88 58.16 3ihi h LEU 95 Cb 0.42 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.27 3ihi h LEU 95 CO 0.02 1.56 0.57 -1.28 -0.34 0.00 0.00 178.44 178.98 3ihi h SER 96 N 0.06 0.88 0.05 1.25 0.87 -0.86 -1.47 113.55 114.32 3ihi h SER 96 Ca -0.34 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.25 3ihi h SER 96 Cb 2.03 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 63.84 3ihi h SER 96 CO 0.11 0.54 0.00 0.77 -0.53 0.00 0.00 176.83 177.72 3ihi h SER 97 N 1.00 0.00 0.07 6.23 4.64 -1.37 0.90 113.55 125.02 3ihi h SER 97 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 3ihi h SER 97 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 3ihi h SER 97 CO -0.20 0.00 -0.03 0.29 -0.87 0.00 0.00 176.83 176.02 3ihi n LYS 98 N -2.82 1.24 -1.32 4.77 4.76 -0.56 -4.89 118.16 119.33 3ihi n LYS 98 Ca -0.02 -0.50 0.00 0.00 -2.87 0.00 0.00 58.31 54.92 3ihi n LYS 98 Cb 0.07 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.77 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 1.15 0.43 3.17 0.72 0.00 0.31 -5.04 105.19 105.93 3ihi n GLY 99 Ca 0.19 -0.96 -0.35 0.00 0.00 0.00 0.00 46.02 44.90 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 3.11 -1.44 1.61 1.01 -1.17 -4.99 120.40 116.53 3ihi s VAL 100 Ca 0.00 -1.48 0.18 0.00 0.00 0.00 0.00 61.98 60.68 3ihi s VAL 100 Cb 0.00 -2.85 0.52 0.00 0.00 0.00 0.00 36.38 34.06 3ihi s VAL 100 CO 0.00 -0.21 1.44 0.54 0.00 0.00 0.00 175.10 176.87 3ihi n ARG 101 N 4.63 2.89 0.27 2.72 1.74 -1.26 -2.92 116.66 124.73 3ihi n ARG 101 Ca -0.11 -2.46 0.14 0.00 -0.77 0.00 0.00 57.85 54.64 3ihi n ARG 101 Cb 0.43 -1.50 0.79 0.00 -1.02 0.00 0.00 32.46 31.16 3ihi n ARG 101 CO 0.00 0.00 0.00 -0.84 -1.52 0.00 0.00 177.63 175.27 3ihi h ILE 102 N 3.34 0.50 -0.02 0.55 3.07 -1.95 -1.23 117.51 121.77 3ihi h ILE 102 Ca 0.00 -0.41 0.00 0.00 1.55 0.00 0.00 64.86 66.00 3ihi h ILE 102 Cb 0.95 1.27 0.00 0.00 -0.27 0.00 0.00 36.82 38.78 3ihi h ILE 102 CO 0.03 0.09 -0.17 0.79 -1.05 0.00 0.00 178.15 177.83 3ihi n TRP 103 N -3.62 0.00 -0.18 0.16 7.02 -1.26 -4.64 117.44 114.91 3ihi n TRP 103 Ca -0.02 0.00 -0.10 0.00 -1.02 0.00 0.00 57.50 56.36 3ihi n TRP 103 Cb 0.20 -0.03 0.01 0.00 -2.42 0.00 0.00 31.31 29.08 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 2.81 0.99 -0.32 -0.99 3.32 -1.53 -2.45 116.42 118.26 3ihi h ASP 104 Ca 0.00 -0.34 0.05 0.00 0.02 0.00 0.00 57.03 56.77 3ihi h ASP 104 Cb 0.71 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 39.94 3ihi h ASP 104 CO 0.00 1.10 0.00 0.00 -1.72 0.00 0.00 179.24 178.62 3ihi h ALA 105 N 0.93 0.29 0.00 3.45 0.00 -1.82 -0.83 119.26 121.27 3ihi h ALA 105 Ca 0.14 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 3ihi h ALA 105 Cb 0.63 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 3ihi h ALA 105 CO 0.04 -0.40 -0.01 -0.91 0.00 0.00 0.00 179.25 177.97 3ihi h ASN 106 N 0.10 0.00 -0.37 0.00 -0.26 -1.75 -2.13 115.58 111.17 3ihi h ASN 106 Ca 0.15 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.89 3ihi h ASN 106 Cb 0.20 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.46 3ihi h ASN 106 CO -0.25 0.01 0.00 0.61 -1.06 0.00 0.00 177.43 176.74 3ihi n GLY 107 N -1.24 1.81 3.75 2.83 0.00 -0.95 -4.54 105.19 106.85 3ihi n GLY 107 Ca -0.03 -0.59 -0.38 0.00 0.00 0.00 0.00 46.02 45.03 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 -1.19 5.20 0.25 1.61 1.04 -0.36 -0.46 113.70 119.79 3ihi s SER 108 Ca 0.32 2.64 -0.03 0.00 0.48 0.00 0.00 55.95 59.36 3ihi s SER 108 Cb 0.18 -2.62 0.52 0.00 0.10 0.00 0.00 66.02 64.20 3ihi s SER 108 CO 0.25 -1.61 1.67 -0.09 0.98 0.00 0.00 173.24 174.45 3ihi h ARG 109 N 1.24 0.24 -0.04 4.02 9.65 -1.91 0.05 114.38 127.63 3ihi h ARG 109 Ca -0.51 -0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 58.34 3ihi h ARG 109 Cb 1.30 -0.05 -0.00 0.00 -1.39 0.00 0.00 29.97 29.83 3ihi h ARG 109 CO 0.56 0.16 -0.03 -0.44 2.80 0.00 0.00 179.97 183.02 3ihi h ASP 110 N 0.25 0.10 -0.19 -3.80 3.32 -1.93 -1.53 116.42 112.64 3ihi h ASP 110 Ca 0.45 -0.45 0.05 0.00 0.02 0.00 0.00 57.03 57.09 3ihi h ASP 110 Cb 0.80 -0.03 -0.05 0.00 0.22 0.00 0.00 39.33 40.28 3ihi h ASP 110 CO -0.56 0.53 -0.09 0.15 -1.72 0.00 0.00 179.24 177.55 3ihi h PHE 111 N -0.33 -0.22 -0.60 4.55 3.57 -1.77 -0.74 116.94 121.39 3ihi h PHE 111 Ca 0.01 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.56 3ihi h PHE 111 Cb 0.50 0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.33 3ihi h PHE 111 CO 0.08 -0.15 0.36 -0.07 -2.23 0.00 0.00 178.31 176.30 3ihi h LEU 112 N -0.07 0.57 -0.36 0.59 3.38 -0.86 -2.62 115.31 115.94 3ihi h LEU 112 Ca 0.11 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 3ihi h LEU 112 Cb 0.23 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 3ihi h LEU 112 CO -0.24 0.40 0.13 0.44 0.09 0.00 0.00 178.44 179.25 3ihi h ASP 113 N 0.70 0.51 -0.65 -0.43 3.32 -1.09 0.20 116.42 118.98 3ihi h ASP 113 Ca 0.25 -0.18 0.19 0.00 0.02 0.00 0.00 57.03 57.30 3ihi h ASP 113 Cb 0.06 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.45 3ihi h ASP 113 CO -0.12 0.55 0.69 0.77 -1.72 0.00 0.00 179.24 179.42 3ihi h SER 114 N 0.43 0.00 -0.24 6.45 4.64 -0.77 0.83 113.55 124.89 3ihi h SER 114 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 3ihi h SER 114 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 3ihi h SER 114 CO -0.01 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.13 3ihi n LEU 115 N -3.61 3.00 -0.14 5.97 4.32 -0.99 -4.94 117.00 120.61 3ihi n LEU 115 Ca 0.13 -1.20 -0.02 0.00 -0.02 0.00 0.00 56.01 54.90 3ihi n LEU 115 Cb 0.92 -0.15 -0.01 0.00 -1.62 0.00 0.00 43.42 42.56 3ihi n LEU 115 CO 0.27 0.60 -0.02 0.61 -1.22 0.00 0.00 177.39 177.64 3ihi n GLY 116 N 1.40 0.47 2.92 -0.72 0.00 0.29 -4.98 105.19 104.58 3ihi n GLY 116 Ca 0.18 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.79 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 -3.13 2.35 -0.05 1.61 3.72 0.02 -4.84 117.46 117.14 3ihi n PHE 117 Ca -0.02 -2.59 -0.14 0.00 -0.05 0.00 0.00 57.45 54.65 3ihi n PHE 117 Cb 0.13 -1.23 -0.08 0.00 -0.94 0.00 0.00 39.48 37.37 3ihi n PHE 117 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 3ihi h SER 118 N 5.16 0.42 0.00 4.37 0.02 -1.88 -3.19 113.55 118.45 3ihi h SER 118 Ca 0.26 -0.56 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 3ihi h SER 118 Cb 0.56 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.98 3ihi h SER 118 CO 1.30 0.90 0.10 0.00 -1.14 0.00 0.00 176.83 177.99 3ihi h ALA 119 N 0.53 1.09 -2.72 3.77 0.00 -1.98 -3.45 119.26 116.51 3ihi h ALA 119 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.36 3ihi h ALA 119 Cb 0.83 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.57 3ihi h ALA 119 CO 0.05 -0.09 0.05 0.50 0.00 0.00 0.00 179.25 179.76 3ihi s ARG 120 N -3.91 4.38 0.56 0.00 3.52 -1.21 -5.05 118.95 117.24 3ihi s ARG 120 Ca -0.04 0.86 -0.16 0.00 -0.13 0.00 0.00 55.73 56.26 3ihi s ARG 120 Cb 0.10 -3.34 -0.06 0.00 -1.56 0.00 0.00 34.95 30.09 3ihi s ARG 120 CO 0.30 0.36 1.02 1.14 -0.81 0.00 0.00 175.30 177.31 3ihi s GLN 121 N -0.23 3.62 0.50 5.12 -2.07 -1.26 -4.96 119.66 120.38 3ihi s GLN 121 Ca 0.34 1.07 -0.24 0.00 -1.82 0.00 0.00 55.36 54.71 3ihi s GLN 121 Cb -0.19 -2.08 -0.07 0.00 -1.09 0.00 0.00 33.01 29.58 3ihi s GLN 121 CO 0.20 -0.55 1.40 -1.91 -1.32 0.00 0.00 175.29 173.10 3ihi n GLU 122 N -1.84 1.99 0.00 9.60 2.13 -1.26 -2.30 120.64 128.96 3ihi n GLU 122 Ca 0.08 0.72 0.00 0.00 0.66 0.00 0.00 57.16 58.61 3ihi n GLU 122 Cb 0.53 -2.60 0.00 0.00 0.27 0.00 0.00 31.44 29.64 3ihi n GLU 122 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3ihi n GLY 123 N 0.67 2.66 3.51 8.31 0.00 0.39 -4.88 105.19 115.84 3ihi n GLY 123 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.50 6.38 0.22 1.61 -1.08 -0.97 0.52 116.67 120.85 3ihi s ASP 124 Ca 0.00 -1.25 0.23 0.00 -0.52 0.00 0.00 52.55 51.01 3ihi s ASP 124 Cb 0.00 -2.49 0.93 0.00 -1.46 0.00 0.00 42.92 39.89 3ihi s ASP 124 CO 0.00 -1.47 1.70 0.18 0.52 0.00 0.00 175.17 176.11 3ihi n LEU 125 N 8.18 0.61 0.00 -1.34 4.77 -0.92 -4.89 117.00 123.41 3ihi n LEU 125 Ca 0.16 0.63 0.00 0.00 -0.03 0.00 0.00 56.01 56.77 3ihi n LEU 125 Cb 0.49 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 3ihi n LEU 125 CO 0.63 -0.46 0.00 0.61 -1.33 0.00 0.00 177.39 176.84 3ihi n GLY 126 N 0.23 -1.62 2.71 -0.72 0.00 -1.26 -1.03 105.19 103.50 3ihi n GLY 126 Ca 0.03 -1.48 -0.42 0.00 0.00 0.00 0.00 46.02 44.16 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 0.00 3.53 -0.14 1.61 -0.04 -1.26 -4.82 135.00 133.87 3ihi n PRO 127 Ca 0.00 -3.08 0.00 0.00 -0.04 0.00 0.00 63.50 60.38 3ihi n PRO 127 Cb 0.00 -2.98 0.00 0.00 -0.04 0.00 0.00 33.50 30.48 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 3.68 0.00 -0.38 0.52 0.24 -1.26 -4.57 118.33 116.57 3ihi n VAL 128 Ca 0.51 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.72 3ihi n VAL 128 Cb 0.34 -1.54 -0.06 0.00 -1.47 0.00 0.00 33.84 31.11 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 -0.16 -1.65 -0.80 6.34 -1.99 -1.90 -1.57 116.97 115.23 3ihi h TYR 129 Ca 0.00 0.12 0.19 0.00 2.00 0.00 0.00 58.73 61.04 3ihi h TYR 129 Cb 0.00 0.85 -0.14 0.00 2.00 0.00 0.00 36.73 39.44 3ihi h TYR 129 CO 0.00 -0.39 0.06 0.78 -0.00 0.00 0.00 178.16 178.61 3ihi h GLY 130 N -0.04 0.98 1.00 3.88 0.00 -1.76 0.69 103.07 107.82 3ihi h GLY 130 Ca 0.20 0.08 -0.18 0.00 0.00 0.00 0.00 47.33 47.43 3ihi h GLY 130 CO -0.91 -0.31 -0.63 -2.75 0.00 0.00 0.00 176.54 171.94 3ihi h PHE 131 N 0.13 0.86 -0.48 5.60 3.57 -1.43 -2.86 116.94 122.33 3ihi h PHE 131 Ca 0.45 -0.39 -0.07 0.00 3.53 0.00 0.00 57.97 61.50 3ihi h PHE 131 Cb 0.83 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.42 3ihi h PHE 131 CO -0.39 1.19 0.04 1.96 -2.23 0.00 0.00 178.31 178.88 3ihi h GLN 132 N 0.29 0.82 -0.53 1.11 1.08 -0.93 0.25 115.11 117.20 3ihi h GLN 132 Ca -0.05 -0.24 -0.01 0.00 -1.45 0.00 0.00 58.65 56.91 3ihi h GLN 132 Cb 1.27 -0.09 -0.03 0.00 -0.05 0.00 0.00 27.48 28.59 3ihi h GLN 132 CO 0.13 0.84 0.29 -1.49 -0.95 0.00 0.00 178.83 177.65 3ihi h TRP 133 N 0.68 0.71 0.00 2.96 4.06 -0.91 -3.03 115.95 120.42 3ihi h TRP 133 Ca 0.14 -0.01 0.00 0.00 2.06 0.00 0.00 58.89 61.08 3ihi h TRP 133 Cb 0.45 -0.23 0.00 0.00 -1.00 0.00 0.00 29.16 28.37 3ihi h TRP 133 CO 0.03 0.50 -1.59 0.54 -3.56 0.00 0.00 178.44 174.36 3ihi n ARG 134 N -4.40 0.57 -2.09 0.49 5.12 -1.08 -1.23 116.66 114.03 3ihi n ARG 134 Ca 0.05 -0.12 0.01 0.00 -1.93 0.00 0.00 57.85 55.86 3ihi n ARG 134 Cb 0.10 -1.33 0.03 0.00 -1.16 0.00 0.00 32.46 30.10 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 -1.95 0.42 -1.70 -1.55 8.25 0.87 -3.46 115.22 116.10 3ihi n HIS 135 Ca -0.02 -1.25 -0.44 0.00 -0.26 0.00 0.00 57.72 55.75 3ihi n HIS 135 Cb 0.36 -0.05 -0.03 0.00 1.12 0.00 0.00 29.99 31.39 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 -0.10 2.50 0.00 4.41 -0.00 -0.73 -0.96 117.46 122.58 3ihi n PHE 136 Ca 0.03 0.26 0.00 0.00 -0.00 0.00 0.00 57.45 57.74 3ihi n PHE 136 Cb 0.96 -2.56 0.00 0.00 -0.00 0.00 0.00 39.48 37.88 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 2.86 1.91 3.75 7.13 0.00 -1.26 -0.92 105.19 118.67 3ihi n GLY 137 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.33 2.68 -0.21 4.61 0.00 -0.14 -4.86 121.76 121.52 3ihi s ALA 138 Ca 0.00 1.23 -0.29 0.00 0.00 0.00 0.00 51.96 52.90 3ihi s ALA 138 Cb 0.00 -3.53 -0.02 0.00 0.00 0.00 0.00 23.12 19.57 3ihi s ALA 138 CO 0.00 -1.35 1.41 -2.00 0.00 0.00 0.00 175.76 173.82 3ihi s GLU 139 N -3.07 4.02 0.29 0.00 2.12 -1.26 -5.00 118.70 115.79 3ihi s GLU 139 Ca 0.75 1.59 -0.26 0.00 0.36 0.00 0.00 54.97 57.41 3ihi s GLU 139 Cb -0.37 -3.89 -0.09 0.00 0.26 0.00 0.00 34.13 30.03 3ihi s GLU 139 CO 0.43 -1.00 0.90 -0.47 -0.54 0.00 0.00 175.26 174.58 3ihi s TYR 140 N 4.25 3.75 0.00 5.30 5.04 -1.26 -4.97 117.35 129.47 3ihi s TYR 140 Ca 0.61 1.74 0.00 0.00 -2.44 0.00 0.00 57.07 56.99 3ihi s TYR 140 Cb -0.22 -2.88 0.00 0.00 0.35 0.00 0.00 41.96 39.21 3ihi s TYR 140 CO 0.23 0.29 0.00 1.63 -1.34 0.00 0.00 175.55 176.35 3ihi n LYS 141 N 0.80 0.00 -4.03 4.97 5.02 -1.26 -5.13 118.16 118.52 3ihi n LYS 141 Ca 0.00 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.15 3ihi n LYS 141 Cb 0.50 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.48 3ihi n LYS 141 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 3ihi s ASP 142 N 0.05 0.87 0.04 4.39 1.47 -1.26 -5.02 116.67 117.20 3ihi s ASP 142 Ca 0.00 -1.49 0.08 0.00 1.18 0.00 0.00 52.55 52.32 3ihi s ASP 142 Cb 0.00 0.73 0.35 0.00 -0.34 0.00 0.00 42.92 43.66 3ihi s ASP 142 CO 0.00 -1.42 1.25 1.15 0.68 0.00 0.00 175.17 176.82 3ihi n MET 143 N -0.59 0.02 0.00 2.11 0.00 -1.26 -1.78 117.12 115.62 3ihi n MET 143 Ca -0.01 0.42 0.10 0.00 0.00 0.00 0.00 57.70 58.20 3ihi n MET 143 Cb 0.61 -1.55 -0.11 0.00 0.00 0.00 0.00 33.22 32.16 3ihi n MET 143 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 3ihi n ASP 144 N -1.59 0.98 -4.73 3.17 8.00 -1.26 -4.77 116.55 116.36 3ihi n ASP 144 Ca 0.01 -0.99 -0.36 0.00 0.71 0.00 0.00 54.79 54.16 3ihi n ASP 144 Cb 0.07 0.99 0.07 0.00 -0.02 0.00 0.00 41.12 42.24 3ihi n ASP 144 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3ihi s SER 145 N -2.93 4.55 -0.34 -2.24 0.01 -0.73 -4.99 113.70 107.04 3ihi s SER 145 Ca 0.08 2.49 -0.19 0.00 1.31 0.00 0.00 55.95 59.63 3ihi s SER 145 Cb 0.16 -2.60 -0.00 0.00 0.21 0.00 0.00 66.02 63.78 3ihi s SER 145 CO 0.84 -2.03 0.58 -0.62 0.41 0.00 0.00 173.24 172.41 3ihi s ASP 146 N -1.66 6.39 0.00 2.44 2.15 -1.26 -4.94 116.67 119.79 3ihi s ASP 146 Ca 0.79 0.14 0.19 0.00 0.43 0.00 0.00 52.55 54.10 3ihi s ASP 146 Cb -0.33 -2.30 0.50 0.00 -0.30 0.00 0.00 42.92 40.49 3ihi s ASP 146 CO 0.40 -0.51 1.41 -1.22 -0.17 0.00 0.00 175.17 175.09 3ihi n TYR 147 N 5.86 0.74 -1.53 -5.34 4.01 -1.26 -5.01 117.16 114.63 3ihi n TYR 147 Ca -0.03 -0.46 -0.50 0.00 -0.16 0.00 0.00 57.90 56.75 3ihi n TYR 147 Cb 0.49 -0.01 -0.04 0.00 -0.31 0.00 0.00 39.34 39.46 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 1.24 0.52 0.00 7.72 7.64 -1.26 -0.12 113.62 129.37 3ihi n SER 148 Ca 0.19 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.22 3ihi n SER 148 Cb 0.55 -1.11 0.00 0.00 -1.01 0.00 0.00 64.21 62.64 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 1.86 0.21 3.88 0.23 0.00 -1.26 -4.99 105.19 105.13 3ihi n GLY 149 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.88 3.44 1.34 1.61 -0.21 0.83 -4.99 119.66 120.80 3ihi s GLN 150 Ca 0.00 -0.16 0.00 0.00 0.02 0.00 0.00 55.36 55.22 3ihi s GLN 150 Cb 0.00 -3.17 0.00 0.00 1.00 0.00 0.00 33.01 30.84 3ihi s GLN 150 CO 0.00 0.76 0.00 0.41 -2.12 0.00 0.00 175.29 174.34 3ihi n GLY 151 N 1.82 -1.72 3.63 3.09 0.00 -1.26 -4.40 105.19 106.35 3ihi n GLY 151 Ca -0.19 -1.29 -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 5.13 -1.09 1.61 1.01 -0.09 -4.76 120.40 122.20 3ihi s VAL 152 Ca 0.00 0.10 -0.19 0.00 0.00 0.00 0.00 61.98 61.88 3ihi s VAL 152 Cb 0.00 -3.38 0.09 0.00 0.00 0.00 0.00 36.38 33.09 3ihi s VAL 152 CO 0.00 0.36 1.44 -0.62 0.00 0.00 0.00 175.10 176.28 3ihi s ASP 153 N 1.01 6.70 0.31 3.32 -1.08 -1.22 -1.77 116.67 123.93 3ihi s ASP 153 Ca 0.06 -2.07 0.06 0.00 -0.52 0.00 0.00 52.55 50.08 3ihi s ASP 153 Cb -0.14 -2.50 0.50 0.00 -1.46 0.00 0.00 42.92 39.32 3ihi s ASP 153 CO 0.04 -1.20 1.74 1.56 0.52 0.00 0.00 175.17 177.83 3ihi h GLN 154 N 8.63 0.30 -0.10 4.34 4.20 -1.43 -1.54 115.11 129.51 3ihi h GLN 154 Ca 0.27 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.84 3ihi h GLN 154 Cb 0.96 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.72 3ihi h GLN 154 CO 1.33 0.59 0.01 1.25 -0.67 0.00 0.00 178.83 181.35 3ihi h LEU 155 N 0.27 0.16 -0.80 1.46 5.85 -1.66 0.81 115.31 121.39 3ihi h LEU 155 Ca 0.04 -0.27 -0.06 0.00 0.84 0.00 0.00 57.88 58.43 3ihi h LEU 155 Cb 0.70 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.65 3ihi h LEU 155 CO 0.05 0.39 0.22 -0.61 -0.34 0.00 0.00 178.44 178.15 3ihi h GLN 156 N -0.08 1.12 -0.89 1.25 5.75 -1.81 -2.27 115.11 118.19 3ihi h GLN 156 Ca 0.03 -0.24 0.02 0.00 -0.15 0.00 0.00 58.65 58.32 3ihi h GLN 156 Cb 0.30 -0.16 -0.05 0.00 1.07 0.00 0.00 27.48 28.64 3ihi h GLN 156 CO 0.00 0.95 0.58 0.87 -2.65 0.00 0.00 178.83 178.58 3ihi h LYS 157 N 1.07 1.12 0.21 1.69 1.57 -1.10 0.14 116.57 121.28 3ihi h LYS 157 Ca 0.23 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 3ihi h LYS 157 Cb 0.30 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.36 3ihi h LYS 157 CO -0.01 0.74 -0.10 0.28 -0.57 0.00 0.00 179.45 179.79 3ihi h VAL 158 N 1.15 0.80 -0.59 0.50 2.07 -0.48 -0.62 116.25 119.08 3ihi h VAL 158 Ca 0.34 -0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.87 3ihi h VAL 158 Cb -0.05 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 3ihi h VAL 158 CO -0.10 0.00 0.38 0.40 0.02 0.00 0.00 177.57 178.27 3ihi h ILE 159 N -0.28 1.11 -0.50 4.57 2.04 -0.92 -0.77 117.51 122.76 3ihi h ILE 159 Ca -0.03 -0.26 -0.13 0.00 1.00 0.00 0.00 64.86 65.44 3ihi h ILE 159 Cb 0.22 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.57 3ihi h ILE 159 CO 0.05 0.14 -0.19 0.44 0.00 0.00 0.00 178.15 178.59 3ihi h ASP 160 N 0.76 1.02 -0.42 1.72 3.32 -0.63 -1.71 116.42 120.48 3ihi h ASP 160 Ca 0.23 -0.37 -0.02 0.00 0.02 0.00 0.00 57.03 56.88 3ihi h ASP 160 Cb -0.04 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.21 3ihi h ASP 160 CO -0.07 1.17 0.18 0.74 -1.72 0.00 0.00 179.24 179.54 3ihi h THR 161 N 0.87 1.19 -0.70 0.35 2.02 -0.97 -1.26 112.91 114.42 3ihi h THR 161 Ca 0.12 -0.57 0.05 0.00 0.77 0.00 0.00 66.41 66.77 3ihi h THR 161 Cb 0.76 0.79 -0.05 0.00 -1.74 0.00 0.00 68.15 67.92 3ihi h THR 161 CO 0.06 0.21 0.42 0.40 0.37 0.00 0.00 175.52 176.98 3ihi h ILE 162 N 0.53 1.03 -0.53 3.11 2.04 -0.89 0.17 117.51 122.98 3ihi h ILE 162 Ca 0.14 -0.27 -0.03 0.00 1.00 0.00 0.00 64.86 65.70 3ihi h ILE 162 Cb 0.17 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 36.40 3ihi h ILE 162 CO -0.01 0.14 0.20 0.11 0.00 0.00 0.00 178.15 178.59 3ihi h LYS 163 N 0.79 0.79 0.00 2.37 1.57 -1.03 -3.25 116.57 117.81 3ihi h LYS 163 Ca 0.30 -0.15 -0.30 0.00 -1.87 0.00 0.00 60.65 58.63 3ihi h LYS 163 Cb 0.12 -0.13 -0.06 0.00 0.08 0.00 0.00 32.23 32.25 3ihi h LYS 163 CO -0.15 0.70 -2.06 0.25 -0.57 0.00 0.00 179.45 177.62 3ihi n THR 164 N -4.52 1.34 -3.19 -0.16 -2.24 -0.50 -4.72 114.28 100.30 3ihi n THR 164 Ca 0.02 -0.80 -0.23 0.00 -2.27 0.00 0.00 64.05 60.77 3ihi n THR 164 Cb 0.17 -0.63 -0.07 0.00 -2.10 0.00 0.00 70.33 67.70 3ihi n THR 164 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3ihi n ASN 165 N -2.82 -0.34 0.26 3.42 5.15 0.58 -4.99 115.26 116.51 3ihi n ASN 165 Ca -0.24 -2.67 0.14 0.00 -0.60 0.00 0.00 54.58 51.21 3ihi n ASN 165 Cb 1.06 -0.35 0.82 0.00 -0.53 0.00 0.00 39.78 40.77 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 4.42 0.00 0.00 1.20 0.13 -1.63 -1.19 132.00 134.94 3ihi h PRO 166 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 3ihi h PRO 166 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 3ihi h PRO 166 CO 0.41 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 177.93 3ihi n ASP 167 N -4.05 0.00 -4.72 1.44 8.00 -1.26 -3.92 116.55 112.04 3ihi n ASP 167 Ca -0.02 0.16 -0.43 0.00 0.71 0.00 0.00 54.79 55.22 3ihi n ASP 167 Cb 0.15 -0.34 -0.02 0.00 -0.02 0.00 0.00 41.12 40.89 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 -1.34 3.44 -1.51 -2.24 2.03 -0.45 -4.90 116.55 111.58 3ihi n ASP 168 Ca 0.07 1.14 0.10 0.00 0.52 0.00 0.00 54.79 56.62 3ihi n ASP 168 Cb 0.14 -1.53 0.35 0.00 -0.72 0.00 0.00 41.12 39.36 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 2.18 3.57 -0.64 -0.67 1.74 -1.26 -4.35 116.66 117.23 3ihi n ARG 169 Ca 0.10 -2.84 0.06 0.00 -0.77 0.00 0.00 57.85 54.40 3ihi n ARG 169 Cb 0.35 -1.83 0.16 0.00 -1.02 0.00 0.00 32.46 30.12 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 1.14 1.25 -2.92 5.56 1.74 -1.26 -4.96 116.66 117.21 3ihi n ARG 170 Ca 0.25 -2.92 -0.44 0.00 -0.77 0.00 0.00 57.85 53.97 3ihi n ARG 170 Cb 0.84 -1.33 -0.02 0.00 -1.02 0.00 0.00 32.46 30.94 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 -2.60 4.82 -0.02 0.55 1.01 -1.26 -4.95 121.20 118.75 3ihi s ILE 171 Ca 0.35 -1.96 0.06 0.00 0.00 0.00 0.00 60.65 59.10 3ihi s ILE 171 Cb 0.34 -4.84 -0.01 0.00 0.01 0.00 0.00 42.46 37.96 3ihi s ILE 171 CO -0.07 -1.57 -0.20 -0.63 0.00 0.00 0.00 174.94 172.48 3ihi s ILE 172 N 2.34 1.56 -0.16 2.92 1.01 -1.26 -0.49 121.20 127.11 3ihi s ILE 172 Ca 0.37 -0.83 0.01 0.00 0.00 0.00 0.00 60.65 60.19 3ihi s ILE 172 Cb -0.04 -1.30 0.00 0.00 0.01 0.00 0.00 42.46 41.13 3ihi s ILE 172 CO -0.06 0.44 -0.17 -0.32 0.00 0.00 0.00 174.94 174.83 3ihi s MET 173 N -0.38 3.13 -0.16 2.79 -2.45 -0.14 -4.88 119.30 117.21 3ihi s MET 173 Ca 0.05 -0.78 0.02 0.00 -1.25 0.00 0.00 55.69 53.73 3ihi s MET 173 Cb -0.08 -2.59 0.02 0.00 1.25 0.00 0.00 34.83 33.42 3ihi s MET 173 CO -0.00 -0.05 -0.21 0.00 1.05 0.00 0.00 175.02 175.81 3ihi n ALA 175 N 4.39 2.91 -2.34 0.00 0.00 -0.52 -4.72 120.51 120.24 3ihi n ALA 175 Ca -0.21 -0.30 -0.43 0.00 0.00 0.00 0.00 53.44 52.51 3ihi n ALA 175 Cb 0.51 -1.07 -0.02 0.00 0.00 0.00 0.00 19.45 18.86 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 -3.26 2.60 -0.31 0.00 -0.11 -0.81 -4.81 118.94 112.23 3ihi s TRP 176 Ca 0.02 0.81 -0.01 0.00 1.22 0.00 0.00 56.10 58.14 3ihi s TRP 176 Cb 0.12 -3.76 0.10 0.00 -1.50 0.00 0.00 33.47 28.44 3ihi s TRP 176 CO 0.78 -2.09 0.12 1.21 -4.62 0.00 0.00 176.95 172.35 3ihi s ASN 177 N 2.75 3.83 0.36 5.86 3.84 -1.26 -5.00 114.94 125.32 3ihi s ASN 177 Ca 0.59 -1.62 0.12 0.00 0.21 0.00 0.00 52.86 52.16 3ihi s ASN 177 Cb -0.21 -0.71 0.90 0.00 -0.55 0.00 0.00 41.25 40.67 3ihi s ASN 177 CO 0.21 -0.41 1.83 -0.65 -2.79 0.00 0.00 177.10 175.29 3ihi h PRO 178 N 8.05 0.59 -0.90 0.43 0.11 -2.02 -0.90 132.00 137.36 3ihi h PRO 178 Ca -0.14 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.92 3ihi h PRO 178 Cb 1.01 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 31.94 3ihi h PRO 178 CO 0.45 0.39 0.48 -0.22 -0.21 0.00 0.00 178.00 178.89 3ihi h LYS 179 N 0.60 1.26 -0.00 1.05 3.64 -2.02 -3.18 116.57 117.93 3ihi h LYS 179 Ca 0.51 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.73 3ihi h LYS 179 Cb 0.98 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.55 3ihi h LYS 179 CO -0.25 0.93 -0.56 -0.25 -2.27 0.00 0.00 179.45 177.05 3ihi n ASP 180 N -4.32 0.65 -0.25 4.20 8.00 -0.39 -4.51 116.55 119.93 3ihi n ASP 180 Ca 0.09 -0.45 0.05 0.00 0.71 0.00 0.00 54.79 55.20 3ihi n ASP 180 Cb 0.11 0.36 0.16 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 0.14 -0.26 -2.04 0.64 3.38 -1.42 -1.22 115.31 114.53 3ihi h LEU 181 Ca 0.00 0.18 0.12 0.00 0.09 0.00 0.00 57.88 58.27 3ihi h LEU 181 Cb 0.50 0.31 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 3ihi h LEU 181 CO 0.00 -0.15 0.38 -0.65 0.09 0.00 0.00 178.44 178.11 3ihi h PRO 182 N 0.13 0.00 -0.01 1.13 0.11 -1.82 -1.46 132.00 130.10 3ihi h PRO 182 Ca 0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.51 3ihi h PRO 182 Cb 0.71 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.82 3ihi h PRO 182 CO -0.62 0.00 -0.38 1.28 -0.21 0.00 0.00 178.00 178.07 3ihi n LEU 183 N -4.00 0.96 -4.82 2.35 4.77 -0.47 -4.92 117.00 110.87 3ihi n LEU 183 Ca 0.07 -0.24 -0.37 0.00 -0.03 0.00 0.00 56.01 55.44 3ihi n LEU 183 Cb 0.56 -0.14 -0.06 0.00 -2.33 0.00 0.00 43.42 41.45 3ihi n LEU 183 CO 0.31 0.19 0.35 -0.04 -1.33 0.00 0.00 177.39 176.87 3ihi s MET 184 N -2.67 4.20 0.21 3.23 -1.94 -0.55 -4.29 119.30 117.50 3ihi s MET 184 Ca 0.19 0.77 0.20 0.00 -1.71 0.00 0.00 55.69 55.14 3ihi s MET 184 Cb 0.18 -3.00 0.89 0.00 2.01 0.00 0.00 34.83 34.92 3ihi s MET 184 CO 0.59 0.48 1.60 0.00 -0.01 0.00 0.00 175.02 177.68 3ihi n ALA 185 N 1.02 1.43 -3.25 3.03 0.00 -0.20 -4.61 120.51 117.93 3ihi n ALA 185 Ca -0.05 0.09 0.03 0.00 0.00 0.00 0.00 53.44 53.51 3ihi n ALA 185 Cb 0.51 -1.31 -0.04 0.00 0.00 0.00 0.00 19.45 18.61 3ihi n ALA 185 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3ihi s LEU 186 N -4.14 -0.20 0.56 0.00 0.20 -1.26 -5.07 118.68 108.77 3ihi s LEU 186 Ca 0.02 0.28 -0.20 0.00 0.69 0.00 0.00 54.13 54.92 3ihi s LEU 186 Cb 0.08 1.23 -0.05 0.00 -0.43 0.00 0.00 46.19 47.02 3ihi s LEU 186 CO 0.28 -0.04 1.21 -2.16 -0.29 0.00 0.00 176.35 175.35 3ihi s PRO 187 N 2.12 3.15 0.25 0.98 0.04 -1.26 -4.92 135.00 135.36 3ihi s PRO 187 Ca -0.01 1.83 -0.30 0.00 0.04 0.00 0.00 61.00 62.56 3ihi s PRO 187 Cb -0.02 -2.04 -0.11 0.00 0.04 0.00 0.00 34.50 32.38 3ihi s PRO 187 CO -0.16 -1.06 1.53 -1.25 0.04 0.00 0.00 177.00 176.09 3ihi s PRO 188 N -3.19 4.20 0.19 0.56 0.04 -1.26 -4.89 135.00 130.65 3ihi s PRO 188 Ca 0.74 2.42 0.06 0.00 0.04 0.00 0.00 61.00 64.26 3ihi s PRO 188 Cb -0.30 -3.08 0.06 0.00 0.04 0.00 0.00 34.50 31.22 3ihi s PRO 188 CO 0.34 -0.54 1.43 0.00 0.04 0.00 0.00 177.00 178.27 3ihi s HIS 190 N -3.23 3.15 0.10 0.00 3.76 -1.26 -0.50 115.29 117.30 3ihi s HIS 190 Ca -0.02 -1.56 -0.14 0.00 -0.15 0.00 0.00 55.06 53.20 3ihi s HIS 190 Cb 0.11 -4.35 -0.14 0.00 1.11 0.00 0.00 32.58 29.31 3ihi s HIS 190 CO 0.81 -1.52 1.32 0.00 -0.85 0.00 0.00 174.74 174.50 3ihi h ALA 191 N 8.41 0.33 -2.29 -1.40 0.00 -1.24 -3.41 119.26 119.65 3ihi h ALA 191 Ca 0.22 -0.55 -0.06 0.00 0.00 0.00 0.00 54.91 54.52 3ihi h ALA 191 Cb 0.97 -0.03 -0.18 0.00 0.00 0.00 0.00 17.79 18.55 3ihi h ALA 191 CO 1.19 0.60 0.08 -1.17 0.00 0.00 0.00 179.25 179.95 3ihi s LEU 192 N -8.57 -0.27 0.05 0.00 0.20 -1.20 -1.44 118.68 107.45 3ihi s LEU 192 Ca -0.11 0.42 -0.02 0.00 0.69 0.00 0.00 54.13 55.11 3ihi s LEU 192 Cb 0.08 2.25 -0.03 0.00 -0.43 0.00 0.00 46.19 48.06 3ihi s LEU 192 CO 0.88 -0.65 0.01 0.00 -0.29 0.00 0.00 176.35 176.30 3ihi s GLN 194 N -3.22 0.99 0.21 0.00 0.74 -0.07 -0.96 119.66 117.34 3ihi s GLN 194 Ca 0.00 -0.56 0.08 0.00 0.05 0.00 0.00 55.36 54.94 3ihi s GLN 194 Cb 0.03 -0.96 -0.04 0.00 1.10 0.00 0.00 33.01 33.13 3ihi s GLN 194 CO -0.07 0.26 -0.01 -0.06 -0.55 0.00 0.00 175.29 174.85 3ihi s PHE 195 N -0.50 2.76 -0.17 1.67 0.08 0.35 0.09 117.98 122.26 3ihi s PHE 195 Ca 0.04 -0.18 -0.15 0.00 0.12 0.00 0.00 56.93 56.75 3ihi s PHE 195 Cb -0.06 -1.29 0.04 0.00 -0.57 0.00 0.00 43.02 41.14 3ihi s PHE 195 CO 0.00 0.55 0.45 -0.47 -0.10 0.00 0.00 175.22 175.65 3ihi s TYR 196 N -1.96 -0.49 -0.08 0.36 6.14 -0.62 -4.45 117.35 116.24 3ihi s TYR 196 Ca 0.29 1.20 0.01 0.00 0.64 0.00 0.00 57.07 59.21 3ihi s TYR 196 Cb -0.08 0.17 0.02 0.00 0.42 0.00 0.00 41.96 42.49 3ihi s TYR 196 CO 0.19 -0.24 -0.09 0.08 0.64 0.00 0.00 175.55 176.13 3ihi s VAL 197 N 0.26 1.00 -0.07 3.14 1.01 -1.25 -0.35 120.40 124.14 3ihi s VAL 197 Ca -0.00 -0.35 -0.14 0.00 0.00 0.00 0.00 61.98 61.49 3ihi s VAL 197 Cb -0.03 -0.97 0.03 0.00 0.00 0.00 0.00 36.38 35.41 3ihi s VAL 197 CO 0.00 0.34 0.34 0.54 0.00 0.00 0.00 175.10 176.33 3ihi s VAL 198 N 1.13 0.03 -1.42 2.92 0.11 -0.94 -4.67 120.40 117.56 3ihi s VAL 198 Ca -0.06 -0.24 -0.10 0.00 -2.93 0.00 0.00 61.98 58.65 3ihi s VAL 198 Cb -0.14 -0.57 0.04 0.00 -1.53 0.00 0.00 36.38 34.18 3ihi s VAL 198 CO -0.02 -0.13 1.10 0.59 -3.33 0.00 0.00 175.10 173.31 3ihi n ASN 199 N 2.05 -5.57 -0.96 3.54 3.02 -1.26 -1.59 115.26 114.49 3ihi n ASN 199 Ca -0.17 -0.64 -0.13 0.00 -0.03 0.00 0.00 54.58 53.61 3ihi n ASN 199 Cb 0.57 -4.58 -0.05 0.00 -0.61 0.00 0.00 39.78 35.10 3ihi n ASN 199 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ihi n GLY 200 N -1.86 1.29 3.18 7.41 0.00 -1.26 -4.99 105.19 108.96 3ihi n GLY 200 Ca 0.01 -0.19 -0.28 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.96 2.00 -0.24 1.61 2.02 -0.62 -1.66 118.70 118.84 3ihi s GLU 201 Ca 0.00 -0.71 -0.12 0.00 0.02 0.00 0.00 54.97 54.15 3ihi s GLU 201 Cb 0.00 -1.74 -0.05 0.00 0.10 0.00 0.00 34.13 32.44 3ihi s GLU 201 CO 0.00 0.31 0.25 -1.17 0.02 0.00 0.00 175.26 174.67 3ihi s LEU 202 N -0.09 4.10 0.35 1.80 2.96 -0.41 -2.21 118.68 125.18 3ihi s LEU 202 Ca -0.02 0.22 0.09 0.00 -0.22 0.00 0.00 54.13 54.19 3ihi s LEU 202 Cb -0.12 -2.25 -0.05 0.00 0.50 0.00 0.00 46.19 44.27 3ihi s LEU 202 CO 0.02 -0.02 0.07 -0.44 -1.32 0.00 0.00 176.35 174.66 3ihi s SER 203 N 1.24 4.35 -0.04 3.68 0.01 0.53 0.05 113.70 123.52 3ihi s SER 203 Ca 0.11 -0.93 -0.01 0.00 1.31 0.00 0.00 55.95 56.43 3ihi s SER 203 Cb -0.14 -0.59 0.03 0.00 0.21 0.00 0.00 66.02 65.53 3ihi s SER 203 CO 0.07 -0.28 0.07 0.00 0.41 0.00 0.00 173.24 173.51 3ihi s GLN 205 N 1.05 3.16 -0.23 0.00 0.74 0.11 -0.62 119.66 123.88 3ihi s GLN 205 Ca -0.09 -0.69 -0.09 0.00 0.05 0.00 0.00 55.36 54.54 3ihi s GLN 205 Cb -0.12 -2.56 -0.04 0.00 1.10 0.00 0.00 33.01 31.39 3ihi s GLN 205 CO -0.04 0.32 0.11 -1.17 -0.55 0.00 0.00 175.29 173.96 3ihi s LEU 206 N 0.08 3.86 -0.47 3.68 2.96 -0.71 -0.89 118.68 127.18 3ihi s LEU 206 Ca -0.06 0.02 -0.24 0.00 -0.22 0.00 0.00 54.13 53.63 3ihi s LEU 206 Cb -0.15 -2.02 0.03 0.00 0.50 0.00 0.00 46.19 44.55 3ihi s LEU 206 CO 0.04 0.06 0.87 -0.47 -1.32 0.00 0.00 176.35 175.54 3ihi s TYR 207 N 1.05 2.93 -0.32 5.38 5.04 0.01 -1.43 117.35 130.01 3ihi s TYR 207 Ca 0.06 0.22 -0.05 0.00 -2.44 0.00 0.00 57.07 54.86 3ihi s TYR 207 Cb -0.14 -3.86 0.04 0.00 0.35 0.00 0.00 41.96 38.35 3ihi s TYR 207 CO 0.04 -1.09 0.07 -1.14 -1.34 0.00 0.00 175.55 172.08 3ihi s GLN 208 N 3.59 2.61 0.53 4.97 0.74 -0.33 -0.95 119.66 130.83 3ihi s GLN 208 Ca 0.33 -1.17 0.32 0.00 0.05 0.00 0.00 55.36 54.88 3ihi s GLN 208 Cb -0.11 -3.36 1.33 0.00 1.10 0.00 0.00 33.01 31.96 3ihi s GLN 208 CO 0.24 -0.63 1.97 0.07 -0.55 0.00 0.00 175.29 176.39 3ihi h ARG 209 N 8.15 0.00 -2.40 1.67 0.11 -1.08 0.22 114.38 121.05 3ihi h ARG 209 Ca -0.23 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 59.79 3ihi h ARG 209 Cb 1.08 0.00 -0.25 0.00 1.11 0.00 0.00 29.97 31.91 3ihi h ARG 209 CO 0.58 0.05 -0.27 0.45 0.10 0.00 0.00 179.97 180.88 3ihi s SER 210 N -5.80 -0.54 -0.09 0.08 0.15 -1.26 -1.58 113.70 104.66 3ihi s SER 210 Ca 0.01 1.13 -0.02 0.00 0.70 0.00 0.00 55.95 57.77 3ihi s SER 210 Cb 0.10 1.40 0.03 0.00 -1.71 0.00 0.00 66.02 65.84 3ihi s SER 210 CO 0.56 -0.22 0.00 -0.83 1.20 0.00 0.00 173.24 173.95 3ihi s GLY 211 N 2.31 0.53 -0.66 9.45 0.00 0.16 -4.91 107.32 114.21 3ihi s GLY 211 Ca -0.05 -0.24 -0.24 0.00 0.00 0.00 0.00 44.72 44.19 3ihi s GLY 211 CO -0.15 1.16 1.06 -0.35 0.00 0.00 0.00 173.10 174.83 3ihi s ASP 212 N 1.94 6.21 0.45 1.64 -1.08 -1.26 -0.87 116.67 123.70 3ihi s ASP 212 Ca 0.04 -0.69 0.12 0.00 -0.52 0.00 0.00 52.55 51.50 3ihi s ASP 212 Cb -0.13 -2.47 1.03 0.00 -1.46 0.00 0.00 42.92 39.89 3ihi s ASP 212 CO -0.06 -1.52 2.05 0.24 0.52 0.00 0.00 175.17 176.41 3ihi h MET 213 N 9.65 0.35 0.10 4.34 2.86 -1.31 -0.99 114.93 129.94 3ihi h MET 213 Ca -0.28 -0.02 -0.13 0.00 -2.06 0.00 0.00 59.70 57.21 3ihi h MET 213 Cb 1.06 -0.08 0.02 0.00 0.06 0.00 0.00 31.60 32.66 3ihi h MET 213 CO 1.19 0.23 -0.58 0.78 1.06 0.00 0.00 176.91 179.60 3ihi h GLY 214 N 0.36 0.25 0.00 8.32 0.00 -1.91 -3.38 103.07 106.70 3ihi h GLY 214 Ca 0.16 -0.62 -0.40 0.00 0.00 0.00 0.00 47.33 46.47 3ihi h GLY 214 CO -0.04 0.55 -2.36 -0.10 0.00 0.00 0.00 176.54 174.60 3ihi n LEU 215 N -4.27 2.02 -0.09 3.11 7.94 -1.24 -4.84 117.00 119.65 3ihi n LEU 215 Ca -0.13 0.20 -0.21 0.00 -1.11 0.00 0.00 56.01 54.76 3ihi n LEU 215 Cb 0.72 -0.74 -0.12 0.00 0.53 0.00 0.00 43.42 43.81 3ihi n LEU 215 CO 0.44 0.60 -0.49 1.23 -1.11 0.00 0.00 177.39 178.06 3ihi h GLY 216 N -0.25 0.05 0.99 -3.96 0.00 -1.50 -3.42 103.07 94.97 3ihi h GLY 216 Ca -0.60 -0.12 0.01 0.00 0.00 0.00 0.00 47.33 46.63 3ihi h GLY 216 CO -0.31 0.10 0.43 -2.08 0.00 0.00 0.00 176.54 174.69 3ihi h VAL 217 N -0.86 1.16 -0.77 4.60 2.07 -1.41 -0.21 116.25 120.83 3ihi h VAL 217 Ca -0.33 -0.30 -0.00 0.00 0.82 0.00 0.00 66.70 66.88 3ihi h VAL 217 Cb 1.39 0.20 -0.04 0.00 -1.52 0.00 0.00 31.29 31.32 3ihi h VAL 217 CO -0.16 0.16 0.46 -0.65 0.02 0.00 0.00 177.57 177.41 3ihi h PRO 218 N 0.88 1.05 -0.35 1.57 0.11 -1.82 -1.00 132.00 132.42 3ihi h PRO 218 Ca 0.24 -0.09 -0.01 0.00 0.11 0.00 0.00 66.00 66.25 3ihi h PRO 218 Cb -0.09 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 30.79 3ihi h PRO 218 CO -0.06 0.73 0.17 0.35 -0.21 0.00 0.00 178.00 178.98 3ihi h PHE 219 N 1.06 0.51 -0.24 0.65 3.04 -1.63 -2.89 116.94 117.45 3ihi h PHE 219 Ca 0.28 -0.03 0.05 0.00 3.98 0.00 0.00 57.97 62.25 3ihi h PHE 219 Cb -0.04 -0.16 -0.05 0.00 2.56 0.00 0.00 35.95 38.26 3ihi h PHE 219 CO 0.00 0.44 -0.06 -0.91 -2.02 0.00 0.00 178.31 175.77 3ihi h ASN 220 N 0.43 -0.22 -0.51 0.41 -0.26 -0.44 -0.71 115.58 114.28 3ihi h ASN 220 Ca 0.12 0.07 0.09 0.00 -0.56 0.00 0.00 56.30 56.02 3ihi h ASN 220 Cb 0.13 0.15 -0.08 0.00 -1.06 0.00 0.00 38.32 37.46 3ihi h ASN 220 CO -0.01 -0.08 0.08 0.40 -1.06 0.00 0.00 177.43 176.75 3ihi h ILE 221 N 0.00 0.68 -0.10 2.81 2.04 -1.18 -2.23 117.51 119.52 3ihi h ILE 221 Ca 0.11 -0.07 -0.13 0.00 1.00 0.00 0.00 64.86 65.77 3ihi h ILE 221 Cb 0.17 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 3ihi h ILE 221 CO -0.25 0.04 -0.52 0.00 0.00 0.00 0.00 178.15 177.42 3ihi h ALA 222 N 1.42 0.93 -0.23 1.87 0.00 -1.28 -1.27 119.26 120.68 3ihi h ALA 222 Ca 0.26 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 3ihi h ALA 222 Cb 0.37 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3ihi h ALA 222 CO -0.36 0.67 0.14 1.03 0.00 0.00 0.00 179.25 180.73 3ihi h SER 223 N 0.22 0.28 1.28 0.00 0.87 -0.56 -1.53 113.55 114.11 3ihi h SER 223 Ca 0.01 -0.05 -0.14 0.00 -1.23 0.00 0.00 61.79 60.38 3ihi h SER 223 Cb 0.99 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.86 3ihi h SER 223 CO 0.08 0.25 -0.74 1.88 -0.53 0.00 0.00 176.83 177.77 3ihi h TYR 224 N 0.29 0.00 -0.77 2.24 -1.99 -1.33 -1.55 116.97 113.86 3ihi h TYR 224 Ca 0.08 0.00 0.06 0.00 2.00 0.00 0.00 58.73 60.87 3ihi h TYR 224 Cb 0.02 0.00 -0.06 0.00 2.00 0.00 0.00 36.73 38.69 3ihi h TYR 224 CO -0.05 0.61 0.46 0.00 -0.00 0.00 0.00 178.16 179.18 3ihi h ALA 225 N 1.39 1.05 -0.07 3.88 0.00 -1.12 -1.70 119.26 122.70 3ihi h ALA 225 Ca -0.03 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 3ihi h ALA 225 Cb 1.49 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 3ihi h ALA 225 CO 0.07 0.18 -0.07 1.25 0.00 0.00 0.00 179.25 180.68 3ihi h LEU 226 N 0.85 0.19 -0.73 0.00 5.85 -1.04 -1.19 115.31 119.23 3ihi h LEU 226 Ca 0.34 -0.49 0.14 0.00 0.84 0.00 0.00 57.88 58.70 3ihi h LEU 226 Cb 0.16 -0.05 -0.09 0.00 0.37 0.00 0.00 40.66 41.05 3ihi h LEU 226 CO -0.17 0.64 0.28 0.25 -0.34 0.00 0.00 178.44 179.10 3ihi h LEU 227 N -0.27 0.25 -0.36 2.25 5.85 -1.23 -0.20 115.31 121.61 3ihi h LEU 227 Ca 0.01 0.11 -0.07 0.00 0.84 0.00 0.00 57.88 58.77 3ihi h LEU 227 Cb 0.59 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 3ihi h LEU 227 CO 0.02 0.10 -0.04 0.74 -0.34 0.00 0.00 178.44 178.91 3ihi h THR 228 N 0.42 1.27 -0.78 1.05 2.02 -1.00 -0.17 112.91 115.73 3ihi h THR 228 Ca 0.40 -1.07 0.15 0.00 0.77 0.00 0.00 66.41 66.66 3ihi h THR 228 Cb 0.60 1.24 -0.10 0.00 -1.74 0.00 0.00 68.15 68.15 3ihi h THR 228 CO -0.40 0.35 0.30 1.88 0.37 0.00 0.00 175.52 178.03 3ihi h TYR 229 N 0.47 0.51 -0.16 3.16 -1.99 -0.85 -0.47 116.97 117.65 3ihi h TYR 229 Ca 0.10 0.04 -0.04 0.00 2.00 0.00 0.00 58.73 60.83 3ihi h TYR 229 Cb 0.53 -0.11 -0.00 0.00 2.00 0.00 0.00 36.73 39.14 3ihi h TYR 229 CO 0.04 0.04 -0.05 0.52 -0.00 0.00 0.00 178.16 178.72 3ihi h MET 230 N 0.43 0.31 -0.56 4.88 2.86 -0.47 -0.53 114.93 121.84 3ihi h MET 230 Ca 0.43 -0.12 -0.05 0.00 -2.06 0.00 0.00 59.70 57.90 3ihi h MET 230 Cb 0.69 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.31 3ihi h MET 230 CO -0.43 0.60 0.13 0.82 1.06 0.00 0.00 176.91 179.09 3ihi h ILE 231 N 0.01 1.23 -0.29 -1.22 2.04 -1.00 -1.38 117.51 116.90 3ihi h ILE 231 Ca 0.04 -0.85 -0.09 0.00 1.00 0.00 0.00 64.86 64.95 3ihi h ILE 231 Cb 0.49 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 3ihi h ILE 231 CO 0.02 0.32 -0.22 0.00 0.00 0.00 0.00 178.15 178.27 3ihi h ALA 232 N 1.30 1.08 0.32 1.87 0.00 -0.84 -1.12 119.26 121.87 3ihi h ALA 232 Ca 0.18 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 3ihi h ALA 232 Cb 0.31 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.98 3ihi h ALA 232 CO 0.00 0.56 -0.16 1.25 0.00 0.00 0.00 179.25 180.91 3ihi h HIS 233 N 0.49 -0.40 -0.54 0.00 -0.00 -0.54 -1.50 115.15 112.66 3ihi h HIS 233 Ca 0.08 -0.01 0.13 0.00 -0.00 0.00 0.00 60.37 60.57 3ihi h HIS 233 Cb 0.65 0.13 -0.03 0.00 -0.00 0.00 0.00 27.41 28.16 3ihi h HIS 233 CO 0.02 -0.10 0.38 0.82 -0.00 0.00 0.00 177.93 179.05 3ihi h ILE 234 N -0.71 0.79 -0.18 6.26 1.08 -1.12 -2.91 117.51 120.71 3ihi h ILE 234 Ca -0.04 -0.04 0.00 0.00 -0.39 0.00 0.00 64.86 64.38 3ihi h ILE 234 Cb 0.49 0.65 0.00 0.00 -3.07 0.00 0.00 36.82 34.89 3ihi h ILE 234 CO 0.07 0.02 0.00 0.35 -0.69 0.00 0.00 178.15 177.91 3ihi n THR 235 N -4.42 0.32 -2.05 -0.27 -2.24 -0.44 -4.96 114.28 100.22 3ihi n THR 235 Ca 0.10 -0.66 -0.06 0.00 -2.27 0.00 0.00 64.05 61.16 3ihi n THR 235 Cb 0.52 1.09 -0.00 0.00 -2.10 0.00 0.00 70.33 69.84 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 1.00 0.18 3.69 3.38 0.00 -0.87 -4.90 105.19 107.66 3ihi n GLY 236 Ca 0.13 -0.66 -0.27 0.00 0.00 0.00 0.00 46.02 45.21 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 -1.58 2.91 -0.06 0.99 1.43 -0.62 -5.06 118.68 116.70 3ihi s LEU 237 Ca 0.00 -1.28 -0.04 0.00 -1.03 0.00 0.00 54.13 51.78 3ihi s LEU 237 Cb 0.00 -1.11 -0.04 0.00 0.03 0.00 0.00 46.19 45.08 3ihi s LEU 237 CO 0.00 -0.55 0.13 -1.10 0.23 0.00 0.00 176.35 175.06 3ihi s GLN 238 N -3.82 3.32 0.19 1.70 -1.52 -0.67 -4.38 119.66 114.48 3ihi s GLN 238 Ca 0.35 -0.29 -0.33 0.00 -1.95 0.00 0.00 55.36 53.14 3ihi s GLN 238 Cb 0.06 -3.05 -0.14 0.00 -0.22 0.00 0.00 33.01 29.66 3ihi s GLN 238 CO 0.18 0.71 1.49 -2.30 -0.25 0.00 0.00 175.29 175.12 3ihi n PRO 239 N 1.51 2.05 0.00 2.91 -0.02 -1.26 -1.29 135.00 138.90 3ihi n PRO 239 Ca -0.16 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 3ihi n PRO 239 Cb 0.54 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 3ihi n PRO 239 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ihi n GLY 240 N 2.79 -0.00 3.37 -1.23 0.00 0.11 -4.11 105.19 106.11 3ihi n GLY 240 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.81 3.20 -0.28 1.61 1.01 -1.26 -0.75 116.67 119.40 3ihi s ASP 241 Ca 0.00 -0.69 -0.09 0.00 0.71 0.00 0.00 52.55 52.48 3ihi s ASP 241 Cb 0.00 -0.24 -0.02 0.00 1.01 0.00 0.00 42.92 43.67 3ihi s ASP 241 CO 0.00 0.20 0.13 0.12 0.21 0.00 0.00 175.17 175.82 3ihi s PHE 242 N -0.98 3.15 -0.31 4.23 5.36 0.38 -1.65 117.98 128.16 3ihi s PHE 242 Ca 0.13 -0.39 -0.10 0.00 -0.96 0.00 0.00 56.93 55.62 3ihi s PHE 242 Cb -0.10 -2.31 -0.00 0.00 -0.34 0.00 0.00 43.02 40.26 3ihi s PHE 242 CO 0.05 -0.36 0.15 0.08 -1.46 0.00 0.00 175.22 173.68 3ihi s VAL 243 N 1.64 4.58 -0.41 3.12 1.01 0.21 0.21 120.40 130.77 3ihi s VAL 243 Ca 0.06 -0.45 -0.14 0.00 0.00 0.00 0.00 61.98 61.45 3ihi s VAL 243 Cb -0.16 -3.35 0.04 0.00 0.00 0.00 0.00 36.38 32.90 3ihi s VAL 243 CO 0.06 0.05 0.29 -2.28 0.00 0.00 0.00 175.10 173.22 3ihi s HIS 244 N 1.61 3.25 -0.15 5.22 2.46 0.11 -1.74 115.29 126.04 3ihi s HIS 244 Ca 0.04 -0.82 -0.05 0.00 0.47 0.00 0.00 55.06 54.71 3ihi s HIS 244 Cb -0.17 -2.68 -0.03 0.00 -0.13 0.00 0.00 32.58 29.56 3ihi s HIS 244 CO 0.06 -0.66 -0.01 0.99 -2.47 0.00 0.00 174.74 172.65 3ihi s THR 245 N 1.62 4.19 -0.04 0.89 2.01 -0.51 -1.58 115.64 122.21 3ihi s THR 245 Ca 0.04 -0.26 0.02 0.00 0.31 0.00 0.00 61.69 61.81 3ihi s THR 245 Cb -0.20 -2.84 -0.03 0.00 0.01 0.00 0.00 72.50 69.43 3ihi s THR 245 CO 0.08 0.50 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.65 3ihi s LEU 246 N 0.22 3.01 0.00 4.42 1.43 -0.31 -1.18 118.68 126.27 3ihi s LEU 246 Ca -0.00 -0.12 0.00 0.00 -1.03 0.00 0.00 54.13 52.98 3ihi s LEU 246 Cb -0.13 -1.66 0.00 0.00 0.03 0.00 0.00 46.19 44.42 3ihi s LEU 246 CO 0.02 0.34 0.00 0.61 0.23 0.00 0.00 176.35 177.55 3ihi n GLY 247 N 2.09 1.90 3.56 -3.19 0.00 0.78 -2.45 105.19 107.88 3ihi n GLY 247 Ca -0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.45 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 6.17 -0.27 1.61 -1.08 -0.62 -0.99 116.67 120.48 3ihi s ASP 248 Ca 0.00 -0.90 -0.22 0.00 -0.52 0.00 0.00 52.55 50.91 3ihi s ASP 248 Cb 0.00 -2.56 -0.01 0.00 -1.46 0.00 0.00 42.92 38.89 3ihi s ASP 248 CO 0.00 -1.80 0.72 0.00 0.52 0.00 0.00 175.17 174.61 3ihi s ALA 249 N 6.01 3.59 0.05 3.66 0.00 -0.42 -0.66 121.76 133.98 3ihi s ALA 249 Ca 0.46 -0.39 -0.02 0.00 0.00 0.00 0.00 51.96 52.01 3ihi s ALA 249 Cb -0.04 -3.18 -0.03 0.00 0.00 0.00 0.00 23.12 19.86 3ihi s ALA 249 CO 0.02 -0.99 0.00 -3.38 0.00 0.00 0.00 175.76 171.41 3ihi s HIS 250 N 2.74 0.41 -0.12 0.00 -3.43 -0.05 -1.05 115.29 113.79 3ihi s HIS 250 Ca 0.30 -0.87 0.01 0.00 -0.80 0.00 0.00 55.06 53.71 3ihi s HIS 250 Cb -0.15 -0.30 0.02 0.00 -1.43 0.00 0.00 32.58 30.72 3ihi s HIS 250 CO 0.10 -0.35 -0.16 0.42 -2.00 0.00 0.00 174.74 172.75 3ihi s ILE 251 N -3.30 1.56 0.37 -5.38 1.01 -0.16 -0.71 121.20 114.59 3ihi s ILE 251 Ca 0.01 -0.67 -0.27 0.00 0.00 0.00 0.00 60.65 59.72 3ihi s ILE 251 Cb 0.03 -1.43 -0.09 0.00 0.01 0.00 0.00 42.46 40.98 3ihi s ILE 251 CO -0.08 0.45 1.24 -0.31 0.00 0.00 0.00 174.94 176.25 3ihi s TYR 252 N 1.08 3.04 0.41 3.97 2.02 -1.26 -1.50 117.35 125.10 3ihi s TYR 252 Ca -0.04 1.48 0.12 0.00 -0.37 0.00 0.00 57.07 58.26 3ihi s TYR 252 Cb -0.14 -3.56 0.86 0.00 -0.40 0.00 0.00 41.96 38.72 3ihi s TYR 252 CO -0.04 -1.64 1.94 -0.07 -1.57 0.00 0.00 175.55 174.17 3ihi h LEU 253 N 2.99 0.11 0.00 -1.29 3.38 -1.83 -0.57 115.31 118.11 3ihi h LEU 253 Ca -0.49 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.46 3ihi h LEU 253 Cb 1.23 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.95 3ihi h LEU 253 CO 0.64 0.30 0.00 -0.46 0.09 0.00 0.00 178.44 179.01 3ihi n ASN 254 N -4.28 0.00 -0.57 -0.43 2.04 -1.26 -1.85 115.26 108.91 3ihi n ASN 254 Ca -0.02 -1.56 0.06 0.00 -0.44 0.00 0.00 54.58 52.63 3ihi n ASN 254 Cb 0.27 0.00 0.08 0.00 -2.53 0.00 0.00 39.78 37.61 3ihi n ASN 254 CO 0.00 0.00 0.00 1.41 -0.44 0.00 0.00 177.26 178.23 3ihi n HIS 255 N -0.65 0.13 -0.12 -2.53 8.25 -0.22 -4.72 115.22 115.36 3ihi n HIS 255 Ca 0.07 -0.12 -0.03 0.00 -0.26 0.00 0.00 57.72 57.38 3ihi n HIS 255 Cb 0.03 -0.01 0.20 0.00 1.12 0.00 0.00 29.99 31.33 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 2.49 1.22 0.07 1.59 2.04 -1.40 -2.35 117.51 121.18 3ihi h ILE 256 Ca 0.00 -0.81 -0.12 0.00 1.00 0.00 0.00 64.86 64.93 3ihi h ILE 256 Cb 0.60 0.69 0.01 0.00 -0.74 0.00 0.00 36.82 37.38 3ihi h ILE 256 CO 0.00 0.30 -0.56 -0.33 0.00 0.00 0.00 178.15 177.56 3ihi h GLU 257 N 0.78 0.15 -1.01 2.37 4.39 -1.84 -1.94 114.58 117.48 3ihi h GLU 257 Ca 0.17 -0.25 0.23 0.00 0.34 0.00 0.00 59.36 59.85 3ihi h GLU 257 Cb 0.30 0.09 -0.12 0.00 -0.10 0.00 0.00 28.75 28.92 3ihi h GLU 257 CO -0.00 1.12 0.60 -1.35 -1.16 0.00 0.00 179.01 178.22 3ihi h PRO 258 N -0.67 0.61 -0.14 2.33 0.11 -1.87 0.37 132.00 132.73 3ihi h PRO 258 Ca -0.11 -0.04 -0.17 0.00 0.11 0.00 0.00 66.00 65.79 3ihi h PRO 258 Cb 1.36 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 3ihi h PRO 258 CO 0.06 0.40 -0.64 -0.07 -0.21 0.00 0.00 178.00 177.54 3ihi h LEU 259 N 0.63 0.58 -1.58 2.35 3.38 -1.45 -2.07 115.31 117.15 3ihi h LEU 259 Ca 0.62 -0.35 0.01 0.00 0.09 0.00 0.00 57.88 58.25 3ihi h LEU 259 Cb 1.14 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 3ihi h LEU 259 CO -0.44 1.07 0.29 0.11 0.09 0.00 0.00 178.44 179.56 3ihi h LYS 260 N 0.37 0.56 0.91 1.13 1.57 -0.21 -0.66 116.57 120.24 3ihi h LYS 260 Ca -0.01 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 3ihi h LYS 260 Cb 1.20 -0.13 0.01 0.00 0.08 0.00 0.00 32.23 33.39 3ihi h LYS 260 CO 0.12 0.37 -0.44 0.82 -0.57 0.00 0.00 179.45 179.75 3ihi h ILE 261 N 0.58 0.00 -1.04 1.86 2.04 -0.78 -3.17 117.51 116.99 3ihi h ILE 261 Ca 0.16 -0.06 0.27 0.00 1.00 0.00 0.00 64.86 66.23 3ihi h ILE 261 Cb -0.05 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 35.95 3ihi h ILE 261 CO -0.04 0.00 0.70 -0.61 0.00 0.00 0.00 178.15 178.20 3ihi h GLN 262 N -1.28 0.27 0.00 2.37 4.15 -0.96 0.70 115.11 120.36 3ihi h GLN 262 Ca -0.12 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.28 3ihi h GLN 262 Cb 0.94 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.56 3ihi h GLN 262 CO 0.20 0.18 0.00 -0.07 -1.93 0.00 0.00 178.83 177.22 3ihi h LEU 263 N 0.28 0.00 -3.51 -2.39 3.38 -1.11 -2.14 115.31 109.83 3ihi h LEU 263 Ca 0.56 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.53 3ihi h LEU 263 Cb 1.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.39 3ihi h LEU 263 CO -0.20 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.33 3ihi n GLN 264 N -2.89 4.73 -3.91 1.13 6.02 0.24 -4.87 117.38 117.83 3ihi n GLN 264 Ca 0.00 -3.13 -0.35 0.00 -0.01 0.00 0.00 57.00 53.51 3ihi n GLN 264 Cb 0.26 -2.22 -0.08 0.00 1.02 0.00 0.00 30.24 29.22 3ihi n GLN 264 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3ihi s ARG 265 N -2.64 3.90 0.09 -1.09 3.00 -0.81 -5.10 118.95 116.31 3ihi s ARG 265 Ca 0.54 -0.27 -0.29 0.00 0.00 0.00 0.00 55.73 55.71 3ihi s ARG 265 Cb 0.41 -3.26 -0.06 0.00 0.00 0.00 0.00 34.95 32.04 3ihi s ARG 265 CO 0.17 0.39 0.94 -1.21 0.00 0.00 0.00 175.30 175.59 3ihi s GLU 266 N 0.06 4.66 0.15 3.54 0.41 -1.26 -4.94 118.70 121.31 3ihi s GLU 266 Ca 0.07 1.40 -0.31 0.00 -0.41 0.00 0.00 54.97 55.72 3ihi s GLU 266 Cb -0.12 -3.38 -0.09 0.00 -1.78 0.00 0.00 34.13 28.77 3ihi s GLU 266 CO 0.00 0.20 1.41 -1.25 -0.49 0.00 0.00 175.26 175.14 3ihi s PRO 267 N 0.06 4.31 0.29 0.39 0.04 -1.26 -4.79 135.00 134.04 3ihi s PRO 267 Ca 0.46 2.14 -0.10 0.00 0.04 0.00 0.00 61.00 63.54 3ihi s PRO 267 Cb -0.23 -3.21 -0.07 0.00 0.04 0.00 0.00 34.50 31.03 3ihi s PRO 267 CO 0.29 -0.44 0.63 1.03 0.04 0.00 0.00 177.00 178.55 3ihi s ARG 268 N 0.81 3.81 0.42 4.56 0.52 -1.26 -5.01 118.95 122.81 3ihi s ARG 268 Ca 0.64 0.35 -0.23 0.00 -0.52 0.00 0.00 55.73 55.97 3ihi s ARG 268 Cb -0.38 -2.55 -0.12 0.00 0.52 0.00 0.00 34.95 32.42 3ihi s ARG 268 CO 0.33 0.20 0.73 -2.30 0.02 0.00 0.00 175.30 174.28 3ihi n PRO 269 N -0.53 0.84 -2.13 3.54 -0.02 -1.26 -4.81 135.00 130.64 3ihi n PRO 269 Ca 0.01 0.31 -0.38 0.00 -2.02 0.00 0.00 63.50 61.42 3ihi n PRO 269 Cb 0.53 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.30 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 -1.39 2.75 1.05 6.00 0.08 -1.26 -4.76 117.98 120.45 3ihi s PHE 270 Ca 0.64 1.48 -0.18 0.00 0.12 0.00 0.00 56.93 59.00 3ihi s PHE 270 Cb -0.59 -3.52 0.27 0.00 -0.57 0.00 0.00 43.02 38.62 3ihi s PHE 270 CO 0.57 -1.88 0.74 -0.35 -0.10 0.00 0.00 175.22 174.20 3ihi n PRO 271 N -0.47 -3.58 -4.31 0.24 -0.04 -1.25 -4.68 135.00 120.91 3ihi n PRO 271 Ca 0.07 -1.21 -0.28 0.00 -0.04 0.00 0.00 63.50 62.04 3ihi n PRO 271 Cb 0.47 -1.37 -0.11 0.00 -0.04 0.00 0.00 33.50 32.45 3ihi n PRO 271 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3ihi s LYS 272 N -4.73 1.85 -0.14 0.54 1.02 -0.31 -0.82 119.74 117.16 3ihi s LYS 272 Ca 0.53 -1.24 -0.00 0.00 0.02 0.00 0.00 55.97 55.28 3ihi s LYS 272 Cb -0.07 -2.11 -0.01 0.00 -0.52 0.00 0.00 37.83 35.12 3ihi s LYS 272 CO 0.43 0.46 -0.13 -1.17 -0.92 0.00 0.00 175.35 174.02 3ihi s LEU 273 N -2.41 2.70 -0.13 3.17 2.96 -1.26 -0.96 118.68 122.74 3ihi s LEU 273 Ca 0.20 -0.35 -0.02 0.00 -0.22 0.00 0.00 54.13 53.75 3ihi s LEU 273 Cb -0.10 -1.61 -0.02 0.00 0.50 0.00 0.00 46.19 44.96 3ihi s LEU 273 CO 0.12 0.15 -0.07 -0.54 -1.32 0.00 0.00 176.35 174.68 3ihi s LYS 274 N 0.46 3.45 -0.24 1.98 -0.14 0.57 -4.97 119.74 120.85 3ihi s LYS 274 Ca -0.09 -0.58 -0.11 0.00 -1.36 0.00 0.00 55.97 53.83 3ihi s LYS 274 Cb -0.16 -2.78 -0.05 0.00 -1.68 0.00 0.00 37.83 33.17 3ihi s LYS 274 CO 0.05 0.29 0.19 0.42 -0.76 0.00 0.00 175.35 175.54 3ihi s ILE 275 N 0.19 5.33 -1.97 2.17 1.01 -1.26 -1.43 121.20 125.24 3ihi s ILE 275 Ca -0.04 0.23 0.28 0.00 0.00 0.00 0.00 60.65 61.12 3ihi s ILE 275 Cb -0.14 -3.53 0.44 0.00 0.01 0.00 0.00 42.46 39.24 3ihi s ILE 275 CO 0.04 0.32 1.73 0.18 0.00 0.00 0.00 174.94 177.21 3ihi n LEU 276 N 4.46 0.97 -3.62 2.97 4.77 0.33 -4.90 117.00 121.98 3ihi n LEU 276 Ca -0.14 -0.25 -0.09 0.00 -0.03 0.00 0.00 56.01 55.50 3ihi n LEU 276 Cb 0.52 -0.09 -0.02 0.00 -2.33 0.00 0.00 43.42 41.50 3ihi n LEU 276 CO 0.35 0.17 0.52 0.00 -1.33 0.00 0.00 177.39 177.10 3ihi s ARG 277 N -2.31 1.35 -0.26 3.23 1.70 -1.26 -5.11 118.95 116.29 3ihi s ARG 277 Ca 0.31 -0.63 -0.29 0.00 -0.47 0.00 0.00 55.73 54.65 3ihi s ARG 277 Cb 0.20 0.53 -0.02 0.00 -0.57 0.00 0.00 34.95 35.10 3ihi s ARG 277 CO 0.44 -0.61 1.53 0.21 -1.08 0.00 0.00 175.30 175.80 3ihi s LYS 278 N -3.63 3.78 -0.05 3.89 2.20 -1.26 -5.00 119.74 119.67 3ihi s LYS 278 Ca 0.06 1.48 0.01 0.00 -0.36 0.00 0.00 55.97 57.17 3ihi s LYS 278 Cb -0.03 -4.00 -0.03 0.00 -1.51 0.00 0.00 37.83 32.26 3ihi s LYS 278 CO -0.04 -1.30 -0.06 0.08 -0.36 0.00 0.00 175.35 173.67 3ihi s VAL 279 N 5.10 3.79 -0.14 4.02 1.01 -1.26 -5.04 120.40 127.88 3ihi s VAL 279 Ca 0.67 -0.53 0.10 0.00 0.00 0.00 0.00 61.98 62.22 3ihi s VAL 279 Cb -0.22 -2.58 -0.16 0.00 0.00 0.00 0.00 36.38 33.42 3ihi s VAL 279 CO 0.28 0.54 0.01 1.21 0.00 0.00 0.00 175.10 177.14 3ihi n GLU 280 N 2.00 1.50 -4.26 2.72 4.07 -1.26 -4.55 120.64 120.86 3ihi n GLU 280 Ca -0.17 0.01 -0.19 0.00 -0.06 0.00 0.00 57.16 56.75 3ihi n GLU 280 Cb 0.53 -1.36 -0.11 0.00 -0.06 0.00 0.00 31.44 30.44 3ihi n GLU 280 CO 0.00 0.00 0.00 0.95 -0.06 0.00 0.00 177.13 178.02 3ihi s THR 281 N -2.34 1.46 0.33 6.31 -4.23 -1.26 -4.93 115.64 110.98 3ihi s THR 281 Ca -0.10 -1.73 0.10 0.00 -1.18 0.00 0.00 61.69 58.77 3ihi s THR 281 Cb 0.04 -1.59 0.07 0.00 1.34 0.00 0.00 72.50 72.36 3ihi s THR 281 CO 0.54 -0.36 1.76 -0.29 -0.54 0.00 0.00 174.62 175.73 3ihi h ILE 282 N 3.53 1.29 0.00 2.99 6.09 -1.94 -1.30 117.51 128.17 3ihi h ILE 282 Ca -0.41 -1.40 0.00 0.00 -1.37 0.00 0.00 64.86 61.68 3ihi h ILE 282 Cb 1.20 1.68 0.00 0.00 0.47 0.00 0.00 36.82 40.17 3ihi h ILE 282 CO 0.49 0.41 0.00 0.47 -3.07 0.00 0.00 178.15 176.46 3ihi n ASP 283 N -4.06 0.00 -0.46 2.19 9.92 -1.26 -3.50 116.55 119.38 3ihi n ASP 283 Ca -0.02 0.35 0.11 0.00 -0.53 0.00 0.00 54.79 54.70 3ihi n ASP 283 Cb 0.44 -0.43 -0.01 0.00 -0.64 0.00 0.00 41.12 40.48 3ihi n ASP 283 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 3ihi n ASP 284 N -1.43 1.95 -4.77 -2.24 2.03 -0.49 -4.93 116.55 106.68 3ihi n ASP 284 Ca 0.05 -1.47 -0.39 0.00 0.52 0.00 0.00 54.79 53.50 3ihi n ASP 284 Cb 0.17 0.51 0.00 0.00 -0.72 0.00 0.00 41.12 41.08 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 -2.48 2.75 0.12 -0.67 0.08 -1.23 -5.01 117.98 111.55 3ihi s PHE 285 Ca 0.17 1.42 0.01 0.00 0.12 0.00 0.00 56.93 58.66 3ihi s PHE 285 Cb 0.18 -3.65 -0.04 0.00 -0.57 0.00 0.00 43.02 38.93 3ihi s PHE 285 CO 0.58 -2.13 -0.02 0.15 -0.10 0.00 0.00 175.22 173.70 3ihi s LYS 286 N -2.40 0.91 0.30 0.44 1.02 -1.26 -5.06 119.74 113.69 3ihi s LYS 286 Ca 0.60 -1.40 0.05 0.00 0.02 0.00 0.00 55.97 55.24 3ihi s LYS 286 Cb -0.37 -0.12 0.75 0.00 -0.52 0.00 0.00 37.83 37.56 3ihi s LYS 286 CO 0.47 -0.10 1.73 0.28 -0.92 0.00 0.00 175.35 176.81 3ihi h VAL 287 N 2.88 0.56 0.00 3.17 2.07 -1.96 -0.80 116.25 122.18 3ihi h VAL 287 Ca -0.36 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 66.98 3ihi h VAL 287 Cb 1.18 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 3ihi h VAL 287 CO 0.63 0.10 0.00 -0.62 0.02 0.00 0.00 177.57 177.70 3ihi n GLU 288 N -4.94 0.17 0.05 1.57 4.71 -1.26 -2.47 120.64 118.48 3ihi n GLU 288 Ca 0.23 0.44 0.10 0.00 -0.01 0.00 0.00 57.16 57.92 3ihi n GLU 288 Cb 0.64 -1.85 0.41 0.00 -1.01 0.00 0.00 31.44 29.63 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 -2.17 0.30 -4.44 1.62 8.00 -0.30 -4.81 116.55 114.75 3ihi n ASP 289 Ca 0.02 0.57 -0.32 0.00 0.71 0.00 0.00 54.79 55.76 3ihi n ASP 289 Cb 0.19 -0.63 -0.14 0.00 -0.02 0.00 0.00 41.12 40.52 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 -3.12 2.58 -0.03 1.24 0.08 -1.03 -0.51 117.98 117.18 3ihi s PHE 290 Ca 0.07 -0.25 -0.01 0.00 0.12 0.00 0.00 56.93 56.86 3ihi s PHE 290 Cb 0.11 -1.55 0.03 0.00 -0.57 0.00 0.00 43.02 41.04 3ihi s PHE 290 CO 0.36 0.16 0.04 -1.14 -0.10 0.00 0.00 175.22 174.55 3ihi s GLN 291 N -0.95 -0.05 -0.18 0.44 0.74 -0.52 -4.99 119.66 114.16 3ihi s GLN 291 Ca 0.12 0.26 -0.19 0.00 0.05 0.00 0.00 55.36 55.61 3ihi s GLN 291 Cb -0.10 -0.36 -0.03 0.00 1.10 0.00 0.00 33.01 33.62 3ihi s GLN 291 CO 0.02 -0.23 0.53 0.42 -0.55 0.00 0.00 175.29 175.48 3ihi s ILE 292 N 1.50 5.11 -0.10 -2.34 -1.09 -1.26 -0.31 121.20 122.70 3ihi s ILE 292 Ca -0.04 1.00 0.03 0.00 -2.23 0.00 0.00 60.65 59.42 3ihi s ILE 292 Cb -0.13 -3.86 -0.00 0.00 -1.58 0.00 0.00 42.46 36.89 3ihi s ILE 292 CO -0.03 0.20 -0.22 -1.61 -1.23 0.00 0.00 174.94 172.05 3ihi s GLU 293 N 1.45 3.07 0.00 2.79 2.02 -0.13 -4.68 118.70 123.22 3ihi s GLU 293 Ca 0.25 -0.85 0.00 0.00 0.02 0.00 0.00 54.97 54.39 3ihi s GLU 293 Cb -0.15 -2.35 0.00 0.00 0.10 0.00 0.00 34.13 31.73 3ihi s GLU 293 CO 0.10 0.20 0.00 0.41 0.02 0.00 0.00 175.26 175.99 3ihi n GLY 294 N 3.48 0.45 3.46 -1.39 0.00 -1.26 -1.16 105.19 108.77 3ihi n GLY 294 Ca -0.19 -0.88 -0.43 0.00 0.00 0.00 0.00 46.02 44.52 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 -2.00 2.77 -0.69 1.61 6.04 -1.26 -4.25 117.35 119.57 3ihi s TYR 295 Ca 0.00 -0.48 0.05 0.00 0.04 0.00 0.00 57.07 56.68 3ihi s TYR 295 Cb 0.00 -4.14 0.22 0.00 -1.04 0.00 0.00 41.96 37.01 3ihi s TYR 295 CO 0.00 -1.48 0.69 -1.71 -1.54 0.00 0.00 175.55 171.51 3ihi n ASN 296 N 7.35 3.65 -4.86 4.32 4.05 -1.26 -5.08 115.26 123.42 3ihi n ASN 296 Ca -0.04 -3.36 -0.31 0.00 0.45 0.00 0.00 54.58 51.32 3ihi n ASN 296 Cb 0.45 -0.74 -0.05 0.00 1.23 0.00 0.00 39.78 40.68 3ihi n ASN 296 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 3ihi s PRO 297 N -2.13 3.88 1.08 1.20 0.04 -1.26 -4.79 135.00 133.03 3ihi s PRO 297 Ca 0.34 0.56 -0.17 0.00 0.04 0.00 0.00 61.00 61.78 3ihi s PRO 297 Cb 0.07 -2.41 0.11 0.00 0.04 0.00 0.00 34.50 32.31 3ihi s PRO 297 CO -0.06 0.06 0.19 0.72 0.04 0.00 0.00 177.00 177.95 3ihi n HIS 298 N -0.85 -1.39 -0.42 0.56 8.25 0.05 -4.87 115.22 116.56 3ihi n HIS 298 Ca 0.03 0.14 -0.28 0.00 -0.26 0.00 0.00 57.72 57.35 3ihi n HIS 298 Cb 0.54 -1.63 0.25 0.00 1.12 0.00 0.00 29.99 30.26 3ihi n HIS 298 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 3ihi n PRO 299 N -2.24 -3.26 -1.59 -0.41 -0.02 -1.26 -3.44 135.00 122.78 3ihi n PRO 299 Ca 0.02 -0.95 -0.32 0.00 -2.02 0.00 0.00 63.50 60.23 3ihi n PRO 299 Cb 0.59 -1.91 0.06 0.00 -0.02 0.00 0.00 33.50 32.22 3ihi n PRO 299 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3ihi s THR 300 N -2.22 3.20 -0.05 3.45 2.01 -1.26 -3.25 115.64 117.52 3ihi s THR 300 Ca 0.62 0.51 0.01 0.00 0.31 0.00 0.00 61.69 63.15 3ihi s THR 300 Cb -0.16 -3.02 0.02 0.00 0.01 0.00 0.00 72.50 69.35 3ihi s THR 300 CO 0.59 -0.40 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.42 3ihi s ILE 301 N -2.48 0.76 0.14 1.82 1.01 -1.26 -4.96 121.20 116.23 3ihi s ILE 301 Ca 0.66 -0.25 -0.22 0.00 0.00 0.00 0.00 60.65 60.85 3ihi s ILE 301 Cb -0.20 -0.74 -0.08 0.00 0.01 0.00 0.00 42.46 41.45 3ihi s ILE 301 CO 0.46 0.28 0.68 -0.75 0.00 0.00 0.00 174.94 175.61 3ihi s LYS 302 N 0.89 4.35 0.00 2.79 2.47 -1.26 -5.03 119.74 123.95 3ihi s LYS 302 Ca -0.11 0.93 0.00 0.00 -1.56 0.00 0.00 55.97 55.22 3ihi s LYS 302 Cb -0.15 -3.17 0.00 0.00 -1.46 0.00 0.00 37.83 33.05 3ihi s LYS 302 CO 0.01 0.56 0.00 -1.33 0.16 0.00 0.00 175.35 174.75