#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iga n VAL 2 N 0.00 0.37 -0.02 -0.39 0.31 -1.26 -4.86 118.33 112.48 3iga n VAL 2 Ca 0.00 -0.07 -0.09 0.00 -0.01 0.00 0.00 64.34 64.17 3iga n VAL 2 Cb 0.00 -1.43 -0.14 0.00 -0.91 0.00 0.00 33.84 31.36 3iga n VAL 2 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3iga n GLN 3 N 5.57 0.64 -3.91 5.55 6.02 -1.26 -4.65 117.38 125.33 3iga n GLN 3 Ca 0.24 0.29 -0.29 0.00 -0.01 0.00 0.00 57.00 57.24 3iga n GLN 3 Cb 0.19 -1.79 -0.16 0.00 1.02 0.00 0.00 30.24 29.50 3iga n GLN 3 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3iga s LEU 4 N -6.13 1.73 -0.27 1.08 1.43 -1.26 -1.36 118.68 113.89 3iga s LEU 4 Ca -0.06 -0.71 -0.10 0.00 -1.03 0.00 0.00 54.13 52.24 3iga s LEU 4 Cb 0.08 -0.97 -0.04 0.00 0.03 0.00 0.00 46.19 45.29 3iga s LEU 4 CO 0.82 -0.18 0.15 -1.10 0.23 0.00 0.00 176.35 176.28 3iga s GLN 5 N 1.59 3.86 -0.01 1.70 -0.21 0.70 -4.30 119.66 122.99 3iga s GLN 5 Ca 0.00 -0.37 0.06 0.00 0.02 0.00 0.00 55.36 55.08 3iga s GLN 5 Cb -0.15 -3.55 -0.02 0.00 1.00 0.00 0.00 33.01 30.29 3iga s GLN 5 CO -0.08 -0.18 -0.20 -0.65 -2.12 0.00 0.00 175.29 172.06 3iga s GLN 6 N 1.71 1.59 -0.01 2.91 -0.21 -1.26 -1.27 119.66 123.12 3iga s GLN 6 Ca 0.07 -0.73 -0.30 0.00 0.02 0.00 0.00 55.36 54.42 3iga s GLN 6 Cb -0.16 -1.55 -0.07 0.00 1.00 0.00 0.00 33.01 32.23 3iga s GLN 6 CO 0.09 0.42 1.79 -2.14 -2.12 0.00 0.00 175.29 173.33 3iga s PRO 7 N -0.53 4.16 0.42 2.91 0.02 -1.26 -4.79 135.00 135.94 3iga s PRO 7 Ca 0.08 2.38 0.22 0.00 0.02 0.00 0.00 61.00 63.70 3iga s PRO 7 Cb -0.08 -4.04 1.21 0.00 0.02 0.00 0.00 34.50 31.61 3iga s PRO 7 CO -0.01 -0.89 1.74 0.78 -0.33 0.00 0.00 177.00 178.29 3iga h GLY 8 N 10.32 1.16 -3.19 0.52 0.00 -1.95 -3.35 103.07 106.58 3iga h GLY 8 Ca -0.44 -0.17 -0.06 0.00 0.00 0.00 0.00 47.33 46.66 3iga h GLY 8 CO 0.95 -0.19 -0.16 0.00 0.00 0.00 0.00 176.54 177.14 3iga s ALA 9 N -5.41 -0.75 -0.17 3.60 0.00 -1.26 0.37 121.76 118.15 3iga s ALA 9 Ca -0.08 -0.16 -0.05 0.00 0.00 0.00 0.00 51.96 51.67 3iga s ALA 9 Cb 0.26 0.60 0.08 0.00 0.00 0.00 0.00 23.12 24.06 3iga s ALA 9 CO 0.80 -0.58 0.31 -1.21 0.00 0.00 0.00 175.76 175.08 3iga s GLU 10 N -3.65 0.21 0.22 0.00 0.41 -0.25 -4.78 118.70 110.86 3iga s GLU 10 Ca 0.02 0.74 -0.14 0.00 -0.41 0.00 0.00 54.97 55.18 3iga s GLU 10 Cb 0.02 -0.11 -0.08 0.00 -1.78 0.00 0.00 34.13 32.18 3iga s GLU 10 CO -0.11 -0.35 0.62 -1.17 -0.49 0.00 0.00 175.26 173.76 3iga s LEU 11 N 2.47 4.23 -0.13 1.80 2.96 -1.26 -2.48 118.68 126.27 3iga s LEU 11 Ca 0.02 1.13 -0.10 0.00 -0.22 0.00 0.00 54.13 54.97 3iga s LEU 11 Cb -0.13 -3.61 0.04 0.00 0.50 0.00 0.00 46.19 43.00 3iga s LEU 11 CO -0.11 -0.02 0.33 -0.69 -1.32 0.00 0.00 176.35 174.55 3iga s VAL 12 N -1.68 -0.01 0.37 1.68 1.01 -0.73 -4.95 120.40 116.10 3iga s VAL 12 Ca 0.45 0.04 -0.12 0.00 0.00 0.00 0.00 61.98 62.35 3iga s VAL 12 Cb -0.13 -0.48 -0.07 0.00 0.00 0.00 0.00 36.38 35.69 3iga s VAL 12 CO 0.20 0.02 0.75 -0.54 0.00 0.00 0.00 175.10 175.53 3iga s LYS 13 N 0.58 3.86 0.99 2.72 1.02 -1.25 -0.97 119.74 126.69 3iga s LYS 13 Ca -0.03 0.54 -0.17 0.00 0.02 0.00 0.00 55.97 56.33 3iga s LYS 13 Cb -0.05 -2.41 -0.08 0.00 -0.52 0.00 0.00 37.83 34.78 3iga s LYS 13 CO -0.03 0.04 -0.44 -2.30 -0.92 0.00 0.00 175.35 171.70 3iga n PRO 14 N -0.93 -0.22 -0.24 -1.68 -0.02 -1.26 -1.89 135.00 128.75 3iga n PRO 14 Ca 0.03 -0.05 -0.00 0.00 -2.02 0.00 0.00 63.50 61.46 3iga n PRO 14 Cb 0.54 -1.33 -0.00 0.00 -0.02 0.00 0.00 33.50 32.68 3iga n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3iga n GLY 15 N 2.74 0.02 0.00 -1.23 0.00 0.43 -4.82 105.19 102.33 3iga n GLY 15 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3iga n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iga n ALA 16 N -0.08 0.00 -3.41 4.61 0.00 -0.79 -3.97 120.51 116.87 3iga n ALA 16 Ca -0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.31 3iga n ALA 16 Cb 0.04 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.37 3iga n ALA 16 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3iga s SER 17 N -1.00 -0.27 0.24 0.00 0.01 -1.26 0.19 113.70 111.61 3iga s SER 17 Ca 0.00 0.52 0.08 0.00 1.31 0.00 0.00 55.95 57.86 3iga s SER 17 Cb 0.00 0.47 -0.05 0.00 0.21 0.00 0.00 66.02 66.65 3iga s SER 17 CO 0.00 -0.12 -0.12 0.54 0.41 0.00 0.00 173.24 173.95 3iga s VAL 18 N 0.66 1.80 -0.26 3.43 0.11 -0.97 -5.02 120.40 120.15 3iga s VAL 18 Ca -0.04 -2.21 0.01 0.00 -2.93 0.00 0.00 61.98 56.81 3iga s VAL 18 Cb -0.06 -2.22 0.07 0.00 -1.53 0.00 0.00 36.38 32.65 3iga s VAL 18 CO -0.04 -0.47 -0.02 -0.75 -3.33 0.00 0.00 175.10 170.49 3iga s LYS 19 N -3.66 1.53 0.23 1.54 2.20 -1.26 -2.26 119.74 118.06 3iga s LYS 19 Ca 0.26 -1.17 -0.23 0.00 -0.36 0.00 0.00 55.97 54.47 3iga s LYS 19 Cb 0.00 -2.64 -0.08 0.00 -1.51 0.00 0.00 37.83 33.60 3iga s LYS 19 CO 0.10 -0.70 0.78 -0.51 -0.36 0.00 0.00 175.35 174.66 3iga s LEU 20 N 1.32 4.41 0.38 5.43 1.43 -0.50 -4.90 118.68 126.24 3iga s LEU 20 Ca -0.02 1.57 0.08 0.00 -1.03 0.00 0.00 54.13 54.73 3iga s LEU 20 Cb -0.19 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 42.40 3iga s LEU 20 CO -0.09 0.06 0.21 -0.94 0.23 0.00 0.00 176.35 175.82 3iga s SER 21 N -1.50 4.71 -0.23 2.29 1.04 -1.26 -1.71 113.70 117.04 3iga s SER 21 Ca 0.42 -0.84 -0.11 0.00 0.48 0.00 0.00 55.95 55.90 3iga s SER 21 Cb -0.19 -0.64 0.09 0.00 0.10 0.00 0.00 66.02 65.38 3iga s SER 21 CO 0.23 -0.44 0.54 0.00 0.98 0.00 0.00 173.24 174.55 3iga s LYS 23 N 2.03 2.76 0.27 0.00 -0.14 -0.39 0.01 119.74 124.27 3iga s LYS 23 Ca -0.07 -0.65 0.10 0.00 -1.36 0.00 0.00 55.97 53.98 3iga s LYS 23 Cb -0.09 -2.50 -0.04 0.00 -1.68 0.00 0.00 37.83 33.52 3iga s LYS 23 CO -0.16 0.55 -0.01 0.00 -0.76 0.00 0.00 175.35 174.97 3iga s ALA 24 N -0.52 3.15 0.19 5.17 0.00 -0.78 -0.22 121.76 128.76 3iga s ALA 24 Ca 0.07 -1.67 -0.20 0.00 0.00 0.00 0.00 51.96 50.16 3iga s ALA 24 Cb -0.12 -0.75 0.05 0.00 0.00 0.00 0.00 23.12 22.30 3iga s ALA 24 CO 0.02 0.26 0.59 -1.54 0.00 0.00 0.00 175.76 175.08 3iga s SER 25 N -3.67 -0.39 0.00 0.00 1.04 -0.47 -4.92 113.70 105.29 3iga s SER 25 Ca 0.31 -0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.46 3iga s SER 25 Cb -0.06 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.67 3iga s SER 25 CO 0.20 -1.06 0.00 0.61 0.98 0.00 0.00 173.24 173.97 3iga n GLY 26 N -0.37 -1.80 3.76 7.32 0.00 -1.26 -4.61 105.19 108.23 3iga n GLY 26 Ca -0.12 -1.93 -0.41 0.00 0.00 0.00 0.00 46.02 43.55 3iga n GLY 26 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3iga n TYR 27 N 0.00 2.90 -4.44 1.61 4.02 -1.26 -5.01 117.16 114.99 3iga n TYR 27 Ca 0.00 0.33 -0.23 0.00 -0.01 0.00 0.00 57.90 58.00 3iga n TYR 27 Cb 0.00 -2.57 -0.16 0.00 -0.02 0.00 0.00 39.34 36.59 3iga n TYR 27 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 3iga s THR 28 N -0.46 0.91 0.16 -0.72 2.01 -1.26 -5.14 115.64 111.13 3iga s THR 28 Ca 0.60 -0.36 0.07 0.00 0.31 0.00 0.00 61.69 62.31 3iga s THR 28 Cb -0.49 -0.85 -0.04 0.00 0.01 0.00 0.00 72.50 71.13 3iga s THR 28 CO 0.55 0.30 -0.15 -0.36 -0.69 0.00 0.00 174.62 174.26 3iga s PHE 29 N 0.66 1.62 0.40 4.92 0.08 -1.26 -5.03 117.98 119.37 3iga s PHE 29 Ca -0.12 -0.54 0.15 0.00 0.12 0.00 0.00 56.93 56.54 3iga s PHE 29 Cb -0.14 -0.81 0.93 0.00 -0.57 0.00 0.00 43.02 42.43 3iga s PHE 29 CO 0.02 0.26 1.93 1.79 -0.10 0.00 0.00 175.22 179.12 3iga h THR 30 N 3.15 1.12 0.00 0.64 1.35 -2.01 -2.43 112.91 114.73 3iga h THR 30 Ca -0.40 -0.91 0.00 0.00 -0.55 0.00 0.00 66.41 64.55 3iga h THR 30 Cb 1.21 1.50 0.00 0.00 -1.73 0.00 0.00 68.15 69.13 3iga h THR 30 CO 0.54 0.25 0.00 -1.54 -0.25 0.00 0.00 175.52 174.53 3iga n SER 31 N -4.13 0.00 -4.74 5.36 3.41 -1.26 -4.28 113.62 107.98 3iga n SER 31 Ca -0.02 -0.49 -0.41 0.00 -0.26 0.00 0.00 58.87 57.69 3iga n SER 31 Cb 0.32 -0.11 -0.03 0.00 -0.26 0.00 0.00 64.21 64.14 3iga n SER 31 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3iga s ASP 32 N -2.21 6.71 -0.10 4.04 1.01 -0.92 -3.80 116.67 121.40 3iga s ASP 32 Ca 0.31 2.59 0.03 0.00 0.71 0.00 0.00 52.55 56.18 3iga s ASP 32 Cb 0.16 -2.62 -0.01 0.00 1.01 0.00 0.00 42.92 41.46 3iga s ASP 32 CO 0.30 -0.67 -0.19 0.26 0.21 0.00 0.00 175.17 175.09 3iga s TRP 33 N 0.14 2.66 -0.18 4.23 0.52 0.38 -4.10 118.94 122.59 3iga s TRP 33 Ca 0.60 -0.73 -0.08 0.00 0.02 0.00 0.00 56.10 55.90 3iga s TRP 33 Cb -0.40 -1.74 -0.04 0.00 -1.15 0.00 0.00 33.47 30.13 3iga s TRP 33 CO 0.41 -0.24 0.09 0.42 0.02 0.00 0.00 176.95 177.65 3iga s ILE 34 N 0.15 5.07 0.14 2.03 -1.09 0.54 0.01 121.20 128.05 3iga s ILE 34 Ca -0.10 0.07 0.09 0.00 -2.23 0.00 0.00 60.65 58.47 3iga s ILE 34 Cb -0.16 -3.29 -0.04 0.00 -1.58 0.00 0.00 42.46 37.39 3iga s ILE 34 CO 0.06 0.47 -0.15 -1.00 -1.23 0.00 0.00 174.94 173.09 3iga s HIS 35 N 0.23 2.57 -0.06 3.97 3.76 0.46 -0.94 115.29 125.28 3iga s HIS 35 Ca 0.06 -0.24 0.06 0.00 -0.15 0.00 0.00 55.06 54.79 3iga s HIS 35 Cb -0.12 -1.32 -0.01 0.00 1.11 0.00 0.00 32.58 32.25 3iga s HIS 35 CO -0.00 0.45 -0.24 -1.58 -0.85 0.00 0.00 174.74 172.51 3iga s TRP 36 N -1.39 2.33 -0.06 1.40 0.52 -0.74 -0.33 118.94 120.66 3iga s TRP 36 Ca 0.21 -0.69 0.02 0.00 0.02 0.00 0.00 56.10 55.65 3iga s TRP 36 Cb -0.10 -1.53 0.02 0.00 -1.15 0.00 0.00 33.47 30.71 3iga s TRP 36 CO 0.12 -0.21 -0.09 0.08 0.02 0.00 0.00 176.95 176.87 3iga s VAL 37 N -0.13 0.92 -0.13 4.03 1.01 0.14 -1.84 120.40 124.41 3iga s VAL 37 Ca -0.04 -0.34 -0.12 0.00 0.00 0.00 0.00 61.98 61.48 3iga s VAL 37 Cb -0.13 -0.88 -0.05 0.00 0.00 0.00 0.00 36.38 35.32 3iga s VAL 37 CO 0.04 0.31 0.27 -0.75 0.00 0.00 0.00 175.10 174.97 3iga s LYS 38 N 0.86 4.04 -0.15 2.72 2.20 0.12 0.21 119.74 129.74 3iga s LYS 38 Ca -0.11 0.09 -0.04 0.00 -0.36 0.00 0.00 55.97 55.54 3iga s LYS 38 Cb -0.15 -3.34 0.05 0.00 -1.51 0.00 0.00 37.83 32.88 3iga s LYS 38 CO 0.01 0.42 0.07 -1.14 -0.36 0.00 0.00 175.35 174.36 3iga s GLN 39 N -0.09 0.20 0.18 4.03 0.74 0.49 -0.94 119.66 124.27 3iga s GLN 39 Ca 0.17 -0.09 -0.13 0.00 0.05 0.00 0.00 55.36 55.36 3iga s GLN 39 Cb -0.13 -1.69 -0.07 0.00 1.10 0.00 0.00 33.01 32.22 3iga s GLN 39 CO 0.05 -0.60 0.57 1.03 -0.55 0.00 0.00 175.29 175.79 3iga s ARG 40 N 2.07 3.95 0.35 1.67 0.52 -1.26 -1.12 118.95 125.13 3iga s ARG 40 Ca 0.02 0.47 -0.25 0.00 -0.52 0.00 0.00 55.73 55.45 3iga s ARG 40 Cb -0.16 -2.82 -0.14 0.00 0.52 0.00 0.00 34.95 32.36 3iga s ARG 40 CO -0.08 0.41 0.68 -0.35 0.02 0.00 0.00 175.30 175.98 3iga n PRO 41 N 0.47 0.72 -0.09 3.54 -0.04 -1.26 -1.57 135.00 136.76 3iga n PRO 41 Ca -0.03 0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.69 3iga n PRO 41 Cb 0.52 -1.54 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 3iga n PRO 41 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3iga n GLY 42 N 1.65 0.58 3.99 0.55 0.00 -1.26 -4.91 105.19 105.79 3iga n GLY 42 Ca 0.12 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.93 3iga n GLY 42 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3iga s HIS 43 N -1.46 1.67 0.00 1.61 3.76 -0.61 -5.14 115.29 115.11 3iga s HIS 43 Ca 0.00 -0.71 0.00 0.00 -0.15 0.00 0.00 55.06 54.20 3iga s HIS 43 Cb 0.00 -2.15 0.00 0.00 1.11 0.00 0.00 32.58 31.54 3iga s HIS 43 CO 0.00 -0.85 0.00 0.41 -0.85 0.00 0.00 174.74 173.45 3iga n GLY 44 N -2.04 1.82 3.69 -2.22 0.00 -1.26 -4.70 105.19 100.48 3iga n GLY 44 Ca 0.10 -2.07 -0.42 0.00 0.00 0.00 0.00 46.02 43.64 3iga n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3iga s LEU 45 N 0.00 4.25 -0.19 0.99 1.43 -1.26 -4.31 118.68 119.59 3iga s LEU 45 Ca 0.00 1.37 0.01 0.00 -1.03 0.00 0.00 54.13 54.48 3iga s LEU 45 Cb 0.00 -3.37 0.02 0.00 0.03 0.00 0.00 46.19 42.87 3iga s LEU 45 CO 0.00 -0.35 -0.18 -0.70 0.23 0.00 0.00 176.35 175.35 3iga s GLU 46 N 1.71 2.91 -0.60 1.70 2.12 -0.12 -4.99 118.70 121.43 3iga s GLU 46 Ca 0.44 -0.89 -0.28 0.00 0.36 0.00 0.00 54.97 54.60 3iga s GLU 46 Cb -0.18 -2.63 0.02 0.00 0.26 0.00 0.00 34.13 31.60 3iga s GLU 46 CO 0.18 -0.26 1.36 -0.46 -0.54 0.00 0.00 175.26 175.54 3iga s TRP 47 N 1.27 2.33 0.01 5.30 -0.00 -1.26 -0.70 118.94 125.90 3iga s TRP 47 Ca 0.03 0.38 -0.21 0.00 -0.00 0.00 0.00 56.10 56.30 3iga s TRP 47 Cb -0.14 -4.45 -0.19 0.00 -0.00 0.00 0.00 33.47 28.69 3iga s TRP 47 CO -0.12 -1.92 1.20 0.82 -0.00 0.00 0.00 176.95 176.94 3iga h ILE 48 N 6.28 1.42 0.00 5.86 2.04 -1.74 -3.38 117.51 127.99 3iga h ILE 48 Ca -0.27 -1.69 0.00 0.00 1.00 0.00 0.00 64.86 63.90 3iga h ILE 48 Cb 1.08 2.29 0.00 0.00 -0.74 0.00 0.00 36.82 39.45 3iga h ILE 48 CO 1.20 0.49 0.00 0.61 0.00 0.00 0.00 178.15 180.45 3iga n GLY 49 N 0.65 -1.77 3.22 5.37 0.00 -1.23 0.69 105.19 112.12 3iga n GLY 49 Ca -0.08 -1.12 -0.09 0.00 0.00 0.00 0.00 46.02 44.73 3iga n GLY 49 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3iga s GLU 50 N -1.86 0.91 0.01 1.61 -1.05 0.15 -1.80 118.70 116.68 3iga s GLU 50 Ca 0.00 -1.14 -0.15 0.00 -0.15 0.00 0.00 54.97 53.54 3iga s GLU 50 Cb 0.00 0.32 0.02 0.00 -0.44 0.00 0.00 34.13 34.03 3iga s GLU 50 CO 0.00 -0.29 0.31 -1.50 0.95 0.00 0.00 175.26 174.74 3iga s ILE 51 N -3.93 0.07 -0.31 1.83 2.07 -0.11 -0.72 121.20 120.09 3iga s ILE 51 Ca 0.12 -0.55 0.01 0.00 -1.41 0.00 0.00 60.65 58.82 3iga s ILE 51 Cb 0.05 -0.75 0.07 0.00 0.13 0.00 0.00 42.46 41.97 3iga s ILE 51 CO -0.06 -0.30 -0.01 -0.51 -1.91 0.00 0.00 174.94 172.16 3iga s ILE 52 N -1.80 2.57 0.16 2.00 2.07 -0.31 -0.34 121.20 125.55 3iga s ILE 52 Ca -0.10 -1.77 -0.16 0.00 -1.41 0.00 0.00 60.65 57.21 3iga s ILE 52 Cb -0.03 -2.62 0.05 0.00 0.13 0.00 0.00 42.46 39.99 3iga s ILE 52 CO 0.01 -0.26 1.71 -0.65 -1.91 0.00 0.00 174.94 173.85 3iga h PRO 53 N 7.84 0.13 -0.98 3.50 0.11 -1.88 1.19 132.00 141.91 3iga h PRO 53 Ca -0.16 -0.01 0.36 0.00 0.11 0.00 0.00 66.00 66.31 3iga h PRO 53 Cb 1.04 -0.03 -0.12 0.00 0.11 0.00 0.00 31.00 32.00 3iga h PRO 53 CO 0.52 0.08 0.60 0.43 -0.21 0.00 0.00 178.00 179.42 3iga n SER 54 N -5.16 0.21 0.00 -2.05 7.64 -1.26 -2.32 113.62 110.68 3iga n SER 54 Ca 0.02 1.17 0.00 0.00 1.01 0.00 0.00 58.87 61.07 3iga n SER 54 Cb 0.19 -0.57 0.00 0.00 -1.01 0.00 0.00 64.21 62.81 3iga n SER 54 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3iga n TYR 55 N -4.45 0.00 -0.28 1.43 9.36 -0.50 -5.03 117.16 117.69 3iga n TYR 55 Ca 0.31 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.53 3iga n TYR 55 Cb 1.15 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.86 3iga n TYR 55 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3iga n GLY 56 N 2.53 0.76 3.73 2.98 0.00 0.40 -5.05 105.19 110.54 3iga n GLY 56 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3iga n GLY 56 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3iga s ARG 57 N -0.65 4.62 0.10 1.61 6.06 -1.22 -4.79 118.95 124.67 3iga s ARG 57 Ca 0.00 1.59 0.05 0.00 -2.50 0.00 0.00 55.73 54.87 3iga s ARG 57 Cb 0.00 -3.34 -0.03 0.00 0.06 0.00 0.00 34.95 31.63 3iga s ARG 57 CO 0.00 0.08 -0.12 0.00 -2.50 0.00 0.00 175.30 172.76 3iga s ALA 58 N 0.11 1.27 0.01 6.12 0.00 -1.26 -1.16 121.76 126.85 3iga s ALA 58 Ca 0.50 -1.19 0.04 0.00 0.00 0.00 0.00 51.96 51.31 3iga s ALA 58 Cb -0.26 -0.04 -0.01 0.00 0.00 0.00 0.00 23.12 22.81 3iga s ALA 58 CO 0.32 0.06 -0.13 -0.80 0.00 0.00 0.00 175.76 175.20 3iga s ASN 59 N -2.29 1.58 0.13 0.00 0.01 0.10 -4.99 114.94 109.48 3iga s ASN 59 Ca 0.05 -0.33 0.09 0.00 -0.71 0.00 0.00 52.86 51.96 3iga s ASN 59 Cb -0.05 -0.14 -0.04 0.00 0.41 0.00 0.00 41.25 41.43 3iga s ASN 59 CO 0.02 0.10 -0.22 -0.31 -1.51 0.00 0.00 177.10 175.18 3iga s TYR 60 N -0.54 1.96 -0.02 2.20 1.51 -1.26 0.35 117.35 121.54 3iga s TYR 60 Ca 0.03 -0.42 -0.30 0.00 -1.01 0.00 0.00 57.07 55.38 3iga s TYR 60 Cb -0.06 -1.03 -0.08 0.00 -0.11 0.00 0.00 41.96 40.68 3iga s TYR 60 CO 0.00 0.30 2.00 1.21 -1.11 0.00 0.00 175.55 177.94 3iga s ASN 61 N -2.21 6.27 0.00 2.29 3.84 0.22 -4.81 114.94 120.54 3iga s ASN 61 Ca 0.12 2.49 0.20 0.00 0.21 0.00 0.00 52.86 55.88 3iga s ASN 61 Cb -0.09 -2.53 0.77 0.00 -0.55 0.00 0.00 41.25 38.85 3iga s ASN 61 CO 0.06 -1.22 1.55 -0.62 -2.79 0.00 0.00 177.10 174.08 3iga n GLU 62 N 7.76 1.67 0.00 0.43 1.02 -1.26 -3.81 120.64 126.44 3iga n GLU 62 Ca 0.22 -1.00 0.12 0.00 -0.02 0.00 0.00 57.16 56.47 3iga n GLU 62 Cb 0.42 -1.38 0.23 0.00 -0.02 0.00 0.00 31.44 30.69 3iga n GLU 62 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 3iga n LYS 63 N 0.23 1.17 -4.05 3.49 4.81 -1.26 -4.93 118.16 117.62 3iga n LYS 63 Ca 0.16 -0.83 -0.09 0.00 -0.87 0.00 0.00 58.31 56.68 3iga n LYS 63 Cb 0.31 -1.48 -0.10 0.00 0.02 0.00 0.00 35.03 33.77 3iga n LYS 63 CO 0.00 0.00 0.00 0.96 1.17 0.00 0.00 177.40 179.53 3iga s ILE 64 N -2.41 0.24 0.25 3.15 -4.36 -1.25 -5.13 121.20 111.70 3iga s ILE 64 Ca 0.24 -1.43 -0.29 0.00 -0.26 0.00 0.00 60.65 58.92 3iga s ILE 64 Cb 0.19 -0.99 -0.15 0.00 1.25 0.00 0.00 42.46 42.76 3iga s ILE 64 CO 0.50 -0.75 0.88 0.00 0.24 0.00 0.00 174.94 175.81 3iga n GLN 65 N 0.76 0.91 -2.85 0.37 3.00 -1.26 -4.87 117.38 113.44 3iga n GLN 65 Ca -0.18 0.32 -0.43 0.00 -0.01 0.00 0.00 57.00 56.70 3iga n GLN 65 Cb 0.58 -1.59 -0.04 0.00 0.00 0.00 0.00 30.24 29.19 3iga n GLN 65 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.06 177.27 3iga s LYS 66 N -1.25 3.21 -0.02 -1.09 2.20 -1.26 -4.73 119.74 116.80 3iga s LYS 66 Ca 0.62 -0.55 0.15 0.00 -0.36 0.00 0.00 55.97 55.83 3iga s LYS 66 Cb -0.79 -4.14 -0.23 0.00 -1.51 0.00 0.00 37.83 31.16 3iga s LYS 66 CO 0.58 -1.65 0.39 1.63 -0.36 0.00 0.00 175.35 175.94 3iga n LYS 67 N 7.59 0.75 -4.01 4.03 4.76 -1.26 -4.97 118.16 125.05 3iga n LYS 67 Ca -0.01 -0.12 -0.22 0.00 -2.87 0.00 0.00 58.31 55.10 3iga n LYS 67 Cb 0.46 -1.34 -0.04 0.00 -1.84 0.00 0.00 35.03 32.28 3iga n LYS 67 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3iga s ALA 68 N -2.96 3.70 -0.12 7.82 0.00 -1.25 -0.87 121.76 128.08 3iga s ALA 68 Ca -0.04 -1.45 -0.06 0.00 0.00 0.00 0.00 51.96 50.41 3iga s ALA 68 Cb 0.10 -1.33 0.05 0.00 0.00 0.00 0.00 23.12 21.94 3iga s ALA 68 CO 0.64 0.19 0.27 0.99 0.00 0.00 0.00 175.76 177.85 3iga s THR 69 N -2.16 -0.08 -0.01 0.00 2.01 -0.73 -4.91 115.64 109.77 3iga s THR 69 Ca 0.35 0.15 0.01 0.00 0.31 0.00 0.00 61.69 62.52 3iga s THR 69 Cb -0.08 -0.43 -0.04 0.00 0.01 0.00 0.00 72.50 71.97 3iga s THR 69 CO 0.26 0.06 0.00 -0.76 -0.69 0.00 0.00 174.62 173.50 3iga s LEU 70 N 1.41 3.53 0.28 4.42 1.43 -1.26 0.10 118.68 128.59 3iga s LEU 70 Ca -0.08 0.01 -0.09 0.00 -1.03 0.00 0.00 54.13 52.93 3iga s LEU 70 Cb -0.10 -2.02 -0.00 0.00 0.03 0.00 0.00 46.19 44.10 3iga s LEU 70 CO -0.09 0.29 0.47 0.42 0.23 0.00 0.00 176.35 177.67 3iga s THR 71 N -1.08 0.00 -0.26 5.49 -4.23 -0.35 -4.90 115.64 110.32 3iga s THR 71 Ca 0.19 -1.48 -0.22 0.00 -1.18 0.00 0.00 61.69 59.01 3iga s THR 71 Cb -0.12 -2.39 0.07 0.00 1.34 0.00 0.00 72.50 71.40 3iga s THR 71 CO 0.10 0.00 0.68 0.00 -0.54 0.00 0.00 174.62 174.85 3iga s ALA 72 N -3.64 -1.70 -0.41 3.99 0.00 -1.26 -0.33 121.76 118.40 3iga s ALA 72 Ca 0.25 2.01 -0.12 0.00 0.00 0.00 0.00 51.96 54.10 3iga s ALA 72 Cb -0.00 -1.17 0.05 0.00 0.00 0.00 0.00 23.12 22.00 3iga s ALA 72 CO 0.13 -0.33 0.27 0.34 0.00 0.00 0.00 175.76 176.16 3iga s ASP 73 N 0.63 5.82 0.24 0.00 -1.08 -0.17 -4.99 116.67 117.13 3iga s ASP 73 Ca -0.02 -1.21 -0.05 0.00 -0.52 0.00 0.00 52.55 50.75 3iga s ASP 73 Cb -0.05 -2.06 0.26 0.00 -1.46 0.00 0.00 42.92 39.62 3iga s ASP 73 CO -0.03 -0.49 1.83 0.11 0.52 0.00 0.00 175.17 177.10 3iga h LYS 74 N 8.51 1.11 -0.30 4.34 1.57 -1.94 0.16 116.57 130.03 3iga h LYS 74 Ca -0.25 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 3iga h LYS 74 Cb 1.10 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 33.20 3iga h LYS 74 CO 0.74 0.88 0.19 0.66 -0.57 0.00 0.00 179.45 181.35 3iga h SER 75 N 1.09 0.33 0.11 0.86 4.64 -1.96 -2.25 113.55 116.36 3iga h SER 75 Ca 0.26 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 3iga h SER 75 Cb 0.16 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 3iga h SER 75 CO -0.03 0.24 -0.14 -1.54 -0.87 0.00 0.00 176.83 174.49 3iga n SER 76 N -4.89 1.35 -4.13 4.97 3.41 -1.20 -4.94 113.62 108.20 3iga n SER 76 Ca -0.01 -1.23 -0.34 0.00 -0.26 0.00 0.00 58.87 57.03 3iga n SER 76 Cb 0.03 0.08 -0.02 0.00 -0.26 0.00 0.00 64.21 64.05 3iga n SER 76 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3iga n SER 77 N -0.18 -3.19 -4.50 4.04 3.41 0.52 -4.66 113.62 109.06 3iga n SER 77 Ca 0.15 -0.97 -0.33 0.00 -0.26 0.00 0.00 58.87 57.46 3iga n SER 77 Cb 0.37 -3.02 -0.12 0.00 -0.26 0.00 0.00 64.21 61.18 3iga n SER 77 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3iga s THR 78 N -3.38 3.59 -0.07 6.66 2.01 -0.85 -1.86 115.64 121.74 3iga s THR 78 Ca 0.63 -0.49 -0.00 0.00 0.31 0.00 0.00 61.69 62.13 3iga s THR 78 Cb -0.34 -2.51 -0.03 0.00 0.01 0.00 0.00 72.50 69.63 3iga s THR 78 CO 0.90 0.54 -0.02 0.00 -0.69 0.00 0.00 174.62 175.36 3iga s ALA 79 N -0.12 3.20 0.16 7.40 0.00 0.10 -1.00 121.76 131.50 3iga s ALA 79 Ca 0.01 -0.86 0.10 0.00 0.00 0.00 0.00 51.96 51.21 3iga s ALA 79 Cb -0.13 -1.39 -0.04 0.00 0.00 0.00 0.00 23.12 21.56 3iga s ALA 79 CO 0.03 0.59 -0.23 -0.06 0.00 0.00 0.00 175.76 176.10 3iga s PHE 80 N -0.90 2.09 -0.10 0.00 0.40 0.55 -1.51 117.98 118.50 3iga s PHE 80 Ca 0.14 -0.40 -0.01 0.00 -0.60 0.00 0.00 56.93 56.06 3iga s PHE 80 Cb -0.11 -1.07 0.03 0.00 0.51 0.00 0.00 43.02 42.37 3iga s PHE 80 CO 0.03 0.37 -0.04 1.41 0.70 0.00 0.00 175.22 177.69 3iga s MET 81 N -2.44 1.14 -0.45 0.44 1.75 -0.69 -1.21 119.30 117.84 3iga s MET 81 Ca 0.15 -0.12 -0.14 0.00 -1.25 0.00 0.00 55.69 54.33 3iga s MET 81 Cb -0.08 -1.36 0.07 0.00 2.84 0.00 0.00 34.83 36.29 3iga s MET 81 CO 0.07 -0.29 0.36 -1.14 -0.65 0.00 0.00 175.02 173.36 3iga s GLN 82 N 1.81 2.90 0.04 4.11 2.00 0.12 -1.42 119.66 129.23 3iga s GLN 82 Ca 0.05 -1.34 -0.18 0.00 -2.00 0.00 0.00 55.36 51.89 3iga s GLN 82 Cb -0.13 -4.04 -0.06 0.00 0.80 0.00 0.00 33.01 29.58 3iga s GLN 82 CO -0.07 -0.98 0.52 -0.51 -0.50 0.00 0.00 175.29 173.75 3iga s LEU 83 N 1.60 4.50 0.01 3.68 1.43 -0.96 -1.77 118.68 127.17 3iga s LEU 83 Ca 0.04 1.16 -0.04 0.00 -1.03 0.00 0.00 54.13 54.26 3iga s LEU 83 Cb -0.23 -2.80 -0.01 0.00 0.03 0.00 0.00 46.19 43.18 3iga s LEU 83 CO 0.06 0.28 0.06 -0.94 0.23 0.00 0.00 176.35 176.03 3iga s SER 84 N -1.02 0.13 -1.38 2.29 1.04 -0.05 -2.30 113.70 112.41 3iga s SER 84 Ca 0.27 -0.35 -0.05 0.00 0.48 0.00 0.00 55.95 56.31 3iga s SER 84 Cb -0.19 0.15 0.03 0.00 0.10 0.00 0.00 66.02 66.12 3iga s SER 84 CO 0.17 -0.34 0.84 -1.20 0.98 0.00 0.00 173.24 173.70 3iga n SER 85 N 1.52 -2.73 -4.69 7.02 7.64 0.51 -4.87 113.62 118.04 3iga n SER 85 Ca -0.23 -0.78 -0.30 0.00 1.01 0.00 0.00 58.87 58.57 3iga n SER 85 Cb 0.55 -4.13 0.15 0.00 -1.01 0.00 0.00 64.21 59.77 3iga n SER 85 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3iga s LEU 86 N -6.90 2.33 0.30 -3.43 1.43 -0.96 -4.41 118.68 107.05 3iga s LEU 86 Ca 0.25 1.71 -0.01 0.00 -1.03 0.00 0.00 54.13 55.05 3iga s LEU 86 Cb -0.12 -4.10 -0.01 0.00 0.03 0.00 0.00 46.19 41.98 3iga s LEU 86 CO 0.81 -2.85 0.37 0.42 0.23 0.00 0.00 176.35 175.33 3iga s THR 87 N -2.80 0.00 0.47 5.49 -4.23 -1.26 -0.43 115.64 112.88 3iga s THR 87 Ca 0.64 -1.74 0.27 0.00 -1.18 0.00 0.00 61.69 59.68 3iga s THR 87 Cb -0.20 -2.53 0.46 0.00 1.34 0.00 0.00 72.50 71.58 3iga s THR 87 CO 0.58 0.00 1.81 0.77 -0.54 0.00 0.00 174.62 177.24 3iga h SER 88 N 2.23 0.21 -0.05 3.99 4.64 -1.99 0.66 113.55 123.25 3iga h SER 88 Ca -0.29 0.04 0.01 0.00 -0.47 0.00 0.00 61.79 61.09 3iga h SER 88 Cb 1.24 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3iga h SER 88 CO 0.40 0.04 0.08 -0.08 -0.87 0.00 0.00 176.83 176.40 3iga h GLU 89 N 0.19 0.00 -0.11 4.77 4.57 -1.95 -1.40 114.58 120.65 3iga h GLU 89 Ca 0.55 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.73 3iga h GLU 89 Cb 1.79 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.38 3iga h GLU 89 CO -0.14 0.00 0.00 -0.25 -1.18 0.00 0.00 179.01 177.44 3iga n ASP 90 N -3.63 2.40 -4.65 1.04 8.00 0.23 -4.88 116.55 115.06 3iga n ASP 90 Ca -0.02 -1.80 -0.43 0.00 0.71 0.00 0.00 54.79 53.26 3iga n ASP 90 Cb 0.16 -0.06 -0.02 0.00 -0.02 0.00 0.00 41.12 41.18 3iga n ASP 90 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3iga s SER 91 N -1.84 6.80 -0.07 -2.24 0.01 -0.53 -4.92 113.70 110.91 3iga s SER 91 Ca 0.34 1.63 -0.30 0.00 1.31 0.00 0.00 55.95 58.93 3iga s SER 91 Cb 0.20 -2.54 0.10 0.00 0.21 0.00 0.00 66.02 63.99 3iga s SER 91 CO 0.31 -0.90 1.33 0.00 0.41 0.00 0.00 173.24 174.39 3iga n ALA 92 N 7.06 -3.80 -2.69 1.44 0.00 -0.50 -4.79 120.51 117.23 3iga n ALA 92 Ca 0.15 -0.74 -0.38 0.00 0.00 0.00 0.00 53.44 52.47 3iga n ALA 92 Cb 0.45 0.05 -0.07 0.00 0.00 0.00 0.00 19.45 19.88 3iga n ALA 92 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3iga s VAL 93 N -2.01 5.21 -0.25 0.00 1.01 -0.28 -1.21 120.40 122.87 3iga s VAL 93 Ca 0.32 0.75 -0.05 0.00 0.00 0.00 0.00 61.98 63.00 3iga s VAL 93 Cb -0.00 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.64 3iga s VAL 93 CO -0.02 0.29 0.01 -0.31 0.00 0.00 0.00 175.10 175.07 3iga s TYR 94 N 1.02 3.06 -0.06 5.22 2.02 -0.69 -0.38 117.35 127.54 3iga s TYR 94 Ca 0.20 -1.00 -0.04 0.00 -0.37 0.00 0.00 57.07 55.86 3iga s TYR 94 Cb -0.15 -2.16 -0.04 0.00 -0.40 0.00 0.00 41.96 39.21 3iga s TYR 94 CO 0.08 -0.57 0.15 0.71 -1.57 0.00 0.00 175.55 174.35 3iga s TYR 95 N 1.47 3.52 0.07 2.71 2.02 0.13 -1.52 117.35 125.76 3iga s TYR 95 Ca 0.04 0.40 0.04 0.00 -0.37 0.00 0.00 57.07 57.18 3iga s TYR 95 Cb -0.16 -1.86 -0.04 0.00 -0.40 0.00 0.00 41.96 39.50 3iga s TYR 95 CO -0.01 0.67 -0.01 0.00 -1.57 0.00 0.00 175.55 174.63 3iga s ALA 97 N -1.25 -0.36 -0.17 0.00 0.00 0.55 -1.67 121.76 118.87 3iga s ALA 97 Ca 0.24 -0.05 -0.09 0.00 0.00 0.00 0.00 51.96 52.06 3iga s ALA 97 Cb -0.12 0.07 -0.05 0.00 0.00 0.00 0.00 23.12 23.03 3iga s ALA 97 CO 0.16 -0.20 0.13 0.50 0.00 0.00 0.00 175.76 176.35 3iga s ARG 98 N -1.24 3.87 -0.14 0.00 3.52 -0.61 -0.41 118.95 123.95 3iga s ARG 98 Ca -0.13 -0.19 0.01 0.00 -0.13 0.00 0.00 55.73 55.29 3iga s ARG 98 Cb -0.07 -3.32 0.02 0.00 -1.56 0.00 0.00 34.95 30.03 3iga s ARG 98 CO 0.02 0.50 -0.15 -2.00 -0.81 0.00 0.00 175.30 172.86 3iga s GLU 99 N -0.22 2.29 0.00 5.12 2.12 0.10 -2.96 118.70 125.16 3iga s GLU 99 Ca 0.11 -0.56 -0.02 0.00 0.36 0.00 0.00 54.97 54.85 3iga s GLU 99 Cb -0.11 -2.05 -0.10 0.00 0.26 0.00 0.00 34.13 32.12 3iga s GLU 99 CO 0.01 -0.19 2.47 0.54 -0.54 0.00 0.00 175.26 177.55 3iga n ARG 100 N 4.61 1.30 -1.23 4.30 5.12 -1.26 -0.47 116.66 129.02 3iga n ARG 100 Ca -0.18 -0.36 -0.11 0.00 -1.93 0.00 0.00 57.85 55.28 3iga n ARG 100 Cb 0.50 -1.40 -0.05 0.00 -1.16 0.00 0.00 32.46 30.36 3iga n ARG 100 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3iga n GLY 101 N 1.92 1.01 0.47 -0.13 0.00 -1.25 -4.78 105.19 102.43 3iga n GLY 101 Ca 0.16 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.24 3iga n GLY 101 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3iga n ASP 102 N -0.32 2.92 0.00 1.61 5.68 -1.26 -5.01 116.55 120.17 3iga n ASP 102 Ca -0.11 -2.53 0.00 0.00 -0.50 0.00 0.00 54.79 51.65 3iga n ASP 102 Cb 0.41 -0.32 0.00 0.00 -1.14 0.00 0.00 41.12 40.07 3iga n ASP 102 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3iga n GLY 103 N -0.40 2.90 3.62 6.12 0.00 -1.26 -5.05 105.19 111.12 3iga n GLY 103 Ca 0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 3iga n GLY 103 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3iga s TYR 104 N -2.47 2.56 -0.39 1.61 -0.85 -1.26 -5.09 117.35 111.47 3iga s TYR 104 Ca 0.00 -0.35 -0.12 0.00 -0.52 0.00 0.00 57.07 56.08 3iga s TYR 104 Cb 0.00 -1.34 0.03 0.00 0.38 0.00 0.00 41.96 41.04 3iga s TYR 104 CO 0.00 0.55 0.23 -0.06 -1.52 0.00 0.00 175.55 174.75 3iga s PHE 105 N -2.45 3.25 -0.06 -3.49 2.99 -1.26 -4.38 117.98 112.58 3iga s PHE 105 Ca 0.33 -0.96 -0.24 0.00 0.00 0.00 0.00 56.93 56.06 3iga s PHE 105 Cb -0.03 -2.51 -0.25 0.00 0.00 0.00 0.00 43.02 40.23 3iga s PHE 105 CO 0.19 -0.66 0.96 0.00 -0.00 0.00 0.00 175.22 175.71 3iga h ALA 106 N 8.47 0.01 -3.38 5.36 0.00 -1.95 -3.47 119.26 124.30 3iga h ALA 106 Ca -0.25 -0.53 -0.38 0.00 0.00 0.00 0.00 54.91 53.75 3iga h ALA 106 Cb 1.10 0.03 -0.22 0.00 0.00 0.00 0.00 17.79 18.71 3iga h ALA 106 CO 0.69 0.15 -0.77 0.14 0.00 0.00 0.00 179.25 179.46 3iga s VAL 107 N -2.84 0.95 0.24 0.00 -7.23 -1.26 -5.04 120.40 105.23 3iga s VAL 107 Ca -0.16 -1.21 0.06 0.00 -1.81 0.00 0.00 61.98 58.86 3iga s VAL 107 Cb 0.00 -0.93 -0.05 0.00 0.56 0.00 0.00 36.38 35.96 3iga s VAL 107 CO 0.76 -0.24 -0.07 0.26 -0.31 0.00 0.00 175.10 175.50 3iga s TRP 108 N -1.25 1.74 0.60 2.82 0.52 -1.26 -1.57 118.94 120.53 3iga s TRP 108 Ca -0.04 -0.73 0.01 0.00 0.02 0.00 0.00 56.10 55.36 3iga s TRP 108 Cb -0.10 -0.95 0.06 0.00 -1.15 0.00 0.00 33.47 31.33 3iga s TRP 108 CO 0.02 0.20 0.83 0.20 0.02 0.00 0.00 176.95 178.22 3iga s GLY 109 N -3.36 1.81 0.00 0.98 0.00 -0.67 -4.60 107.32 101.48 3iga s GLY 109 Ca 0.27 -1.43 0.20 0.00 0.00 0.00 0.00 44.72 43.76 3iga s GLY 109 CO 0.09 -1.07 1.64 0.00 0.00 0.00 0.00 173.10 173.76 3iga n ALA 110 N -2.47 2.07 -0.30 3.20 0.00 -1.26 -4.76 120.51 116.99 3iga n ALA 110 Ca 0.10 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3iga n ALA 110 Cb 0.60 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.72 3iga n ALA 110 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3iga n GLY 111 N 0.44 -3.08 3.44 0.00 0.00 -1.26 -4.95 105.19 99.78 3iga n GLY 111 Ca 0.10 -1.19 -0.35 0.00 0.00 0.00 0.00 46.02 44.57 3iga n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3iga s THR 112 N -3.92 3.98 -0.11 2.61 2.01 -0.58 -4.47 115.64 115.16 3iga s THR 112 Ca 0.00 -0.30 -0.28 0.00 0.31 0.00 0.00 61.69 61.42 3iga s THR 112 Cb 0.00 -2.81 -0.01 0.00 0.01 0.00 0.00 72.50 69.68 3iga s THR 112 CO 0.00 0.41 0.95 -0.89 -0.69 0.00 0.00 174.62 174.40 3iga s THR 113 N 1.16 4.83 -0.22 -0.82 2.01 0.16 -1.71 115.64 121.05 3iga s THR 113 Ca 0.03 1.91 0.01 0.00 0.31 0.00 0.00 61.69 63.95 3iga s THR 113 Cb -0.14 -4.26 0.03 0.00 0.01 0.00 0.00 72.50 68.14 3iga s THR 113 CO 0.02 0.03 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.15 3iga s VAL 114 N 1.92 2.33 0.12 3.82 1.01 -0.35 -1.09 120.40 128.15 3iga s VAL 114 Ca 0.46 -1.11 0.04 0.00 0.00 0.00 0.00 61.98 61.36 3iga s VAL 114 Cb -0.18 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.03 3iga s VAL 114 CO 0.17 0.32 0.11 -0.89 0.00 0.00 0.00 175.10 174.81 3iga s THR 115 N 1.26 4.52 -0.18 3.92 2.01 -1.04 -1.41 115.64 124.72 3iga s THR 115 Ca 0.00 -0.92 -0.03 0.00 0.31 0.00 0.00 61.69 61.06 3iga s THR 115 Cb -0.16 -3.24 0.06 0.00 0.01 0.00 0.00 72.50 69.17 3iga s THR 115 CO -0.09 0.01 0.04 -0.69 -0.69 0.00 0.00 174.62 173.20 3iga s VAL 116 N -1.57 0.47 0.12 3.82 1.01 -1.26 -1.77 120.40 121.22 3iga s VAL 116 Ca 0.30 -0.46 -0.24 0.00 0.00 0.00 0.00 61.98 61.58 3iga s VAL 116 Cb -0.11 -0.95 0.08 0.00 0.00 0.00 0.00 36.38 35.40 3iga s VAL 116 CO 0.23 -0.17 1.13 -0.94 0.00 0.00 0.00 175.10 175.34 3iga s SER 117 N 1.89 0.02 0.04 3.32 1.04 -0.15 -4.58 113.70 115.28 3iga s SER 117 Ca -0.00 -0.53 0.22 0.00 0.48 0.00 0.00 55.95 56.12 3iga s SER 117 Cb -0.17 0.38 -0.06 0.00 0.10 0.00 0.00 66.02 66.27 3iga s SER 117 CO -0.08 -0.76 0.91 -1.54 0.98 0.00 0.00 173.24 172.75 3iga n SER 118 N -1.23 0.56 -4.77 7.02 3.41 -1.26 -3.87 113.62 113.49 3iga n SER 118 Ca -0.00 -0.22 -0.41 0.00 -0.26 0.00 0.00 58.87 57.97 3iga n SER 118 Cb 0.59 1.03 -0.00 0.00 -0.26 0.00 0.00 64.21 65.56 3iga n SER 118 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3iga n ALA 119 N -1.90 2.26 -1.88 7.33 0.00 -1.26 -4.99 120.51 120.07 3iga n ALA 119 Ca 0.01 0.34 -0.35 0.00 0.00 0.00 0.00 53.44 53.44 3iga n ALA 119 Cb 0.46 -2.40 -0.07 0.00 0.00 0.00 0.00 19.45 17.44 3iga n ALA 119 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 3iga s LYS 120 N -2.05 4.36 0.26 0.00 0.00 -1.26 -5.01 119.74 116.04 3iga s LYS 120 Ca 0.54 1.12 -0.31 0.00 0.00 0.00 0.00 55.97 57.32 3iga s LYS 120 Cb -0.49 -2.57 -0.12 0.00 0.00 0.00 0.00 37.83 34.65 3iga s LYS 120 CO 0.63 0.18 1.52 2.41 0.00 0.00 0.00 175.35 180.10 3iga n THR 121 N 0.10 0.92 -3.75 3.79 -1.04 -1.26 -4.76 114.28 108.27 3iga n THR 121 Ca 0.03 -0.23 -0.26 0.00 -2.04 0.00 0.00 64.05 61.55 3iga n THR 121 Cb 0.52 -1.75 -0.17 0.00 -1.82 0.00 0.00 70.33 67.11 3iga n THR 121 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 3iga s THR 122 N 0.05 0.51 0.93 12.58 2.01 -1.13 -4.92 115.64 125.67 3iga s THR 122 Ca 0.67 -0.37 -0.10 0.00 0.31 0.00 0.00 61.69 62.20 3iga s THR 122 Cb -0.56 -0.90 0.15 0.00 0.01 0.00 0.00 72.50 71.20 3iga s THR 122 CO 0.48 -0.06 1.14 -2.16 -0.69 0.00 0.00 174.62 173.34 3iga s PRO 123 N 1.88 0.90 0.34 4.92 0.04 -1.26 -1.14 135.00 140.67 3iga s PRO 123 Ca 0.01 1.53 -0.08 0.00 0.04 0.00 0.00 61.00 62.50 3iga s PRO 123 Cb -0.16 -1.72 -0.06 0.00 0.04 0.00 0.00 34.50 32.61 3iga s PRO 123 CO -0.07 -2.71 0.65 -1.25 0.04 0.00 0.00 177.00 173.66 3iga s PRO 124 N -4.64 3.72 -0.19 0.56 0.04 -1.26 -4.37 135.00 128.86 3iga s PRO 124 Ca 0.67 0.25 -0.09 0.00 0.04 0.00 0.00 61.00 61.86 3iga s PRO 124 Cb -0.23 -2.53 -0.05 0.00 0.04 0.00 0.00 34.50 31.73 3iga s PRO 124 CO 0.58 0.11 0.13 -1.12 0.04 0.00 0.00 177.00 176.74 3iga s SER 125 N -3.07 6.21 -0.21 6.66 0.01 0.26 -4.90 113.70 118.66 3iga s SER 125 Ca 0.48 0.26 -0.02 0.00 1.31 0.00 0.00 55.95 57.98 3iga s SER 125 Cb -0.11 -2.08 0.01 0.00 0.21 0.00 0.00 66.02 64.05 3iga s SER 125 CO 0.29 0.21 -0.10 -0.69 0.41 0.00 0.00 173.24 173.37 3iga s VAL 126 N 0.15 2.88 -0.06 3.43 1.01 -1.26 -0.65 120.40 125.90 3iga s VAL 126 Ca 0.09 -0.70 0.06 0.00 0.00 0.00 0.00 61.98 61.42 3iga s VAL 126 Cb -0.11 -2.30 -0.01 0.00 0.00 0.00 0.00 36.38 33.95 3iga s VAL 126 CO -0.01 0.43 -0.25 -0.31 0.00 0.00 0.00 175.10 174.97 3iga s TYR 127 N 1.40 2.45 1.15 5.22 2.02 -0.94 -4.95 117.35 123.69 3iga s TYR 127 Ca 0.05 -0.72 -0.13 0.00 -0.37 0.00 0.00 57.07 55.90 3iga s TYR 127 Cb -0.14 -1.61 0.28 0.00 -0.40 0.00 0.00 41.96 40.09 3iga s TYR 127 CO -0.07 -0.22 1.03 -2.14 -1.57 0.00 0.00 175.55 172.59 3iga s PRO 128 N -0.15 -0.81 -0.16 -1.71 0.02 -1.26 -0.77 135.00 130.16 3iga s PRO 128 Ca -0.04 0.76 -0.04 0.00 0.02 0.00 0.00 61.00 61.70 3iga s PRO 128 Cb -0.14 -1.57 0.08 0.00 0.02 0.00 0.00 34.50 32.89 3iga s PRO 128 CO 0.04 -3.63 0.27 -0.51 -0.33 0.00 0.00 177.00 172.83 3iga s LEU 129 N -7.13 -0.30 0.03 -5.54 1.43 0.19 -4.63 118.68 102.73 3iga s LEU 129 Ca 0.68 0.41 0.01 0.00 -1.03 0.00 0.00 54.13 54.19 3iga s LEU 129 Cb -0.24 0.68 -0.02 0.00 0.03 0.00 0.00 46.19 46.64 3iga s LEU 129 CO 0.64 -0.26 -0.05 0.00 0.23 0.00 0.00 176.35 176.91 3iga s ALA 130 N 2.42 0.30 1.19 4.21 0.00 -1.26 -2.82 121.76 125.79 3iga s ALA 130 Ca 0.03 -0.70 -0.16 0.00 0.00 0.00 0.00 51.96 51.13 3iga s ALA 130 Cb -0.13 0.13 0.23 0.00 0.00 0.00 0.00 23.12 23.34 3iga s ALA 130 CO -0.10 -0.13 0.56 -2.30 0.00 0.00 0.00 175.76 173.79 3iga n PRO 131 N 1.43 -2.41 -3.84 0.00 -0.02 -1.26 -4.93 135.00 123.97 3iga n PRO 131 Ca -0.23 -0.69 -0.27 0.00 -2.02 0.00 0.00 63.50 60.29 3iga n PRO 131 Cb 0.55 -1.92 -0.03 0.00 -0.02 0.00 0.00 33.50 32.08 3iga n PRO 131 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3iga s GLY 132 N -2.19 1.80 0.43 -1.23 0.00 -1.26 -4.61 107.32 100.25 3iga s GLY 132 Ca 0.62 -0.93 0.23 0.00 0.00 0.00 0.00 44.72 44.65 3iga s GLY 132 CO 0.64 -0.91 1.75 1.76 0.00 0.00 0.00 173.10 176.35 3iga h SER 133 N 2.19 0.34 -0.11 1.64 0.02 -1.95 0.23 113.55 115.91 3iga h SER 133 Ca -0.48 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 3iga h SER 133 Cb 1.19 0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.76 3iga h SER 133 CO 0.69 0.03 0.00 0.00 -1.14 0.00 0.00 176.83 176.41 3iga n ALA 134 N -2.53 2.52 -2.66 3.77 0.00 -1.26 -4.83 120.51 115.52 3iga n ALA 134 Ca 0.27 -0.57 -0.43 0.00 0.00 0.00 0.00 53.44 52.72 3iga n ALA 134 Cb 1.03 -1.06 -0.04 0.00 0.00 0.00 0.00 19.45 19.38 3iga n ALA 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3iga s ALA 135 N -1.88 3.10 0.77 0.00 0.00 0.07 -5.02 121.76 118.81 3iga s ALA 135 Ca 0.35 -1.26 -0.13 0.00 0.00 0.00 0.00 51.96 50.91 3iga s ALA 135 Cb 0.20 -3.83 0.06 0.00 0.00 0.00 0.00 23.12 19.55 3iga s ALA 135 CO 0.30 -2.53 1.18 1.14 0.00 0.00 0.00 175.76 175.85 3iga s GLN 136 N 4.22 1.90 0.12 0.00 0.00 -1.26 -4.82 119.66 119.83 3iga s GLN 136 Ca 0.31 1.65 0.07 0.00 -0.00 0.00 0.00 55.36 57.40 3iga s GLN 136 Cb -0.12 -1.82 -0.04 0.00 0.00 0.00 0.00 33.01 31.04 3iga s GLN 136 CO 0.19 -1.99 -0.17 0.95 0.00 0.00 0.00 175.29 174.26 3iga s THR 137 N -2.23 1.52 0.00 3.63 -4.23 -1.26 -5.12 115.64 107.95 3iga s THR 137 Ca 0.71 -1.64 0.00 0.00 -1.18 0.00 0.00 61.69 59.58 3iga s THR 137 Cb -0.26 -1.53 0.00 0.00 1.34 0.00 0.00 72.50 72.04 3iga s THR 137 CO 0.49 -0.26 0.00 -0.46 -0.54 0.00 0.00 174.62 173.85 3iga n ASN 138 N 0.77 0.77 0.00 3.99 6.94 -1.26 -4.96 115.26 121.51 3iga n ASN 138 Ca -0.17 0.00 0.03 0.00 -0.02 0.00 0.00 54.58 54.42 3iga n ASN 138 Cb 0.55 0.00 0.15 0.00 -2.36 0.00 0.00 39.78 38.13 3iga n ASN 138 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 3iga n SER 139 N 0.00 0.00 -3.90 0.53 3.41 -1.26 -4.49 113.62 107.91 3iga n SER 139 Ca 0.00 0.33 -0.17 0.00 -0.26 0.00 0.00 58.87 58.77 3iga n SER 139 Cb 0.00 -0.38 -0.15 0.00 -0.26 0.00 0.00 64.21 63.42 3iga n SER 139 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 3iga s MET 140 N -2.76 0.49 0.10 4.33 -2.45 -1.26 -1.52 119.30 116.22 3iga s MET 140 Ca 0.05 -0.09 0.07 0.00 -1.25 0.00 0.00 55.69 54.47 3iga s MET 140 Cb 0.04 -0.53 -0.04 0.00 1.25 0.00 0.00 34.83 35.55 3iga s MET 140 CO 0.11 -0.01 -0.12 0.54 1.05 0.00 0.00 175.02 176.59 3iga s VAL 141 N 0.47 3.23 -0.19 10.11 0.11 0.15 -4.72 120.40 129.55 3iga s VAL 141 Ca -0.05 -1.28 0.00 0.00 -2.93 0.00 0.00 61.98 57.72 3iga s VAL 141 Cb -0.09 -2.49 0.02 0.00 -1.53 0.00 0.00 36.38 32.30 3iga s VAL 141 CO -0.00 0.14 -0.17 -0.89 -3.33 0.00 0.00 175.10 170.85 3iga s THR 142 N -1.17 2.26 0.22 5.04 2.01 -1.26 -2.07 115.64 120.67 3iga s THR 142 Ca 0.20 -0.95 0.01 0.00 0.31 0.00 0.00 61.69 61.26 3iga s THR 142 Cb -0.11 -2.00 0.01 0.00 0.01 0.00 0.00 72.50 70.41 3iga s THR 142 CO 0.12 0.47 0.06 0.18 -0.69 0.00 0.00 174.62 174.75 3iga n LEU 143 N 4.63 0.00 0.00 4.42 4.77 -0.52 -4.62 117.00 125.68 3iga n LEU 143 Ca -0.20 -1.29 0.00 0.00 -0.03 0.00 0.00 56.01 54.49 3iga n LEU 143 Cb 0.49 0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 3iga n LEU 143 CO 0.26 -0.26 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 3iga n GLY 144 N 2.39 0.60 2.86 -0.72 0.00 -1.13 -1.83 105.19 107.35 3iga n GLY 144 Ca -0.06 -1.01 -0.13 0.00 0.00 0.00 0.00 46.02 44.82 3iga n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iga s LEU 146 N 0.19 4.95 -0.33 0.00 2.96 0.05 -2.90 118.68 123.60 3iga s LEU 146 Ca -0.02 -0.78 -0.19 0.00 -0.22 0.00 0.00 54.13 52.92 3iga s LEU 146 Cb -0.02 -2.40 -0.01 0.00 0.50 0.00 0.00 46.19 44.26 3iga s LEU 146 CO -0.01 -0.67 0.56 -0.69 -1.32 0.00 0.00 176.35 174.23 3iga s VAL 147 N 2.22 4.98 0.21 1.68 1.01 -0.46 -2.23 120.40 127.82 3iga s VAL 147 Ca 0.12 0.55 0.05 0.00 0.00 0.00 0.00 61.98 62.70 3iga s VAL 147 Cb -0.18 -3.98 -0.05 0.00 0.00 0.00 0.00 36.38 32.17 3iga s VAL 147 CO 0.13 -0.19 -0.07 -0.75 0.00 0.00 0.00 175.10 174.22 3iga s LYS 148 N 2.50 1.30 -1.22 2.72 2.20 0.17 -0.78 119.74 126.63 3iga s LYS 148 Ca 0.21 -1.62 -0.25 0.00 -0.36 0.00 0.00 55.97 53.95 3iga s LYS 148 Cb -0.15 -0.81 0.02 0.00 -1.51 0.00 0.00 37.83 35.37 3iga s LYS 148 CO 0.13 0.02 0.67 0.41 -0.36 0.00 0.00 175.35 176.22 3iga n GLY 149 N -0.39 -0.81 3.42 5.54 0.00 -0.02 -0.57 105.19 112.37 3iga n GLY 149 Ca -0.07 0.36 -0.21 0.00 0.00 0.00 0.00 46.02 46.10 3iga n GLY 149 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3iga s TYR 150 N -3.59 1.94 0.01 1.61 -0.85 -0.98 -4.50 117.35 111.00 3iga s TYR 150 Ca 0.42 -0.65 -0.11 0.00 -0.52 0.00 0.00 57.07 56.22 3iga s TYR 150 Cb -0.20 -1.05 0.01 0.00 0.38 0.00 0.00 41.96 41.10 3iga s TYR 150 CO 0.93 0.33 0.22 0.12 -1.52 0.00 0.00 175.55 175.63 3iga s PHE 151 N -2.97 -0.04 0.14 -3.49 5.36 -0.29 0.04 117.98 116.74 3iga s PHE 151 Ca 0.28 -0.04 0.01 0.00 -0.96 0.00 0.00 56.93 56.22 3iga s PHE 151 Cb 0.02 0.01 0.01 0.00 -0.34 0.00 0.00 43.02 42.73 3iga s PHE 151 CO 0.11 -0.38 0.10 -0.35 -1.46 0.00 0.00 175.22 173.24 3iga n PRO 152 N 1.09 1.30 -1.98 10.12 -0.04 -1.26 -2.82 135.00 141.41 3iga n PRO 152 Ca -0.21 -0.87 -0.31 0.00 -0.04 0.00 0.00 63.50 62.07 3iga n PRO 152 Cb 0.57 0.10 0.00 0.00 -0.04 0.00 0.00 33.50 34.13 3iga n PRO 152 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3iga s GLU 153 N -2.56 3.56 0.00 0.54 0.41 -1.26 -4.81 118.70 114.57 3iga s GLU 153 Ca 0.08 0.89 0.00 0.00 -0.41 0.00 0.00 54.97 55.52 3iga s GLU 153 Cb -0.01 -2.08 0.00 0.00 -1.78 0.00 0.00 34.13 30.27 3iga s GLU 153 CO 0.05 -0.60 0.00 -0.35 -0.49 0.00 0.00 175.26 173.87 3iga n PRO 154 N -2.41 2.41 -3.97 0.39 -0.04 -1.26 -4.87 135.00 125.24 3iga n PRO 154 Ca 0.07 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.44 3iga n PRO 154 Cb 0.54 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.89 3iga n PRO 154 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3iga s VAL 155 N 0.27 0.11 -0.15 0.52 -7.23 -1.26 -4.30 120.40 108.36 3iga s VAL 155 Ca 0.00 -0.87 0.01 0.00 -1.81 0.00 0.00 61.98 59.31 3iga s VAL 155 Cb 0.00 -0.25 0.00 0.00 0.56 0.00 0.00 36.38 36.69 3iga s VAL 155 CO 0.00 -0.48 -0.18 -0.89 -0.31 0.00 0.00 175.10 173.24 3iga s THR 156 N -1.40 2.40 -0.17 5.32 2.01 -0.10 -4.97 115.64 118.73 3iga s THR 156 Ca -0.15 -0.86 -0.02 0.00 0.31 0.00 0.00 61.69 60.97 3iga s THR 156 Cb -0.10 -1.99 -0.01 0.00 0.01 0.00 0.00 72.50 70.41 3iga s THR 156 CO -0.01 0.53 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.66 3iga s VAL 157 N 0.83 3.13 0.36 3.82 1.01 -1.26 -0.74 120.40 127.55 3iga s VAL 157 Ca -0.06 -0.61 0.06 0.00 0.00 0.00 0.00 61.98 61.38 3iga s VAL 157 Cb -0.15 -2.36 -0.07 0.00 0.00 0.00 0.00 36.38 33.80 3iga s VAL 157 CO -0.01 0.49 0.00 0.42 0.00 0.00 0.00 175.10 176.00 3iga s THR 158 N 0.85 1.72 -0.13 3.92 -4.23 0.40 -4.96 115.64 113.23 3iga s THR 158 Ca -0.03 -2.04 0.00 0.00 -1.18 0.00 0.00 61.69 58.44 3iga s THR 158 Cb -0.15 -2.82 0.02 0.00 1.34 0.00 0.00 72.50 70.89 3iga s THR 158 CO 0.01 -0.06 -0.11 0.26 -0.54 0.00 0.00 174.62 174.17 3iga s TRP 159 N -2.93 1.81 -1.12 3.99 0.52 -1.26 -0.67 118.94 119.29 3iga s TRP 159 Ca 0.34 -0.95 -0.02 0.00 0.02 0.00 0.00 56.10 55.49 3iga s TRP 159 Cb 0.08 -1.39 -0.03 0.00 -1.15 0.00 0.00 33.47 30.98 3iga s TRP 159 CO 0.16 -0.57 0.95 0.09 0.02 0.00 0.00 176.95 177.61 3iga n ASN 160 N 4.76 -3.83 -3.29 2.95 3.02 0.24 -1.62 115.26 117.48 3iga n ASN 160 Ca -0.15 -0.64 -0.24 0.00 -0.03 0.00 0.00 54.58 53.52 3iga n ASN 160 Cb 0.50 -5.07 0.02 0.00 -0.61 0.00 0.00 39.78 34.61 3iga n ASN 160 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3iga n SER 161 N -3.13 -4.81 0.00 6.41 7.64 -1.26 -1.12 113.62 117.35 3iga n SER 161 Ca -0.20 -0.39 0.00 0.00 1.01 0.00 0.00 58.87 59.29 3iga n SER 161 Cb 0.65 -3.91 0.00 0.00 -1.01 0.00 0.00 64.21 59.93 3iga n SER 161 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3iga n GLY 162 N -1.38 3.15 0.36 0.23 0.00 -0.98 -4.89 105.19 101.69 3iga n GLY 162 Ca -0.05 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.11 3iga n GLY 162 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3iga h SER 163 N 0.00 0.32 -3.58 1.61 4.64 -1.04 -3.37 113.55 112.14 3iga h SER 163 Ca 0.00 0.01 -0.71 0.00 -0.47 0.00 0.00 61.79 60.62 3iga h SER 163 Cb 0.00 -0.06 -0.23 0.00 -0.31 0.00 0.00 62.40 61.80 3iga h SER 163 CO 0.00 0.19 -0.50 -0.22 -0.87 0.00 0.00 176.83 175.43 3iga s LEU 164 N -9.27 4.76 -0.01 5.97 2.96 -0.64 -4.89 118.68 117.55 3iga s LEU 164 Ca -0.07 -0.91 0.00 0.00 -0.22 0.00 0.00 54.13 52.94 3iga s LEU 164 Cb 0.20 -2.06 -0.01 0.00 0.50 0.00 0.00 46.19 44.82 3iga s LEU 164 CO 0.75 -0.38 -0.01 -0.24 -1.32 0.00 0.00 176.35 175.16 3iga n SER 165 N 5.04 4.24 -4.68 3.68 2.88 -1.26 -4.11 113.62 119.41 3iga n SER 165 Ca -0.12 -0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.00 3iga n SER 165 Cb 0.47 0.20 -0.03 0.00 -0.75 0.00 0.00 64.21 64.10 3iga n SER 165 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3iga s SER 166 N -3.72 6.48 0.00 -3.46 0.15 -1.26 -2.84 113.70 109.04 3iga s SER 166 Ca -0.01 2.65 0.00 0.00 0.70 0.00 0.00 55.95 59.28 3iga s SER 166 Cb 0.00 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.76 3iga s SER 166 CO 0.04 -1.00 0.00 0.61 1.20 0.00 0.00 173.24 174.09 3iga n GLY 167 N 4.30 0.67 3.74 9.45 0.00 -1.26 -4.56 105.19 117.53 3iga n GLY 167 Ca 0.18 -0.59 -0.35 0.00 0.00 0.00 0.00 46.02 45.26 3iga n GLY 167 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iga s VAL 168 N -2.00 5.29 -0.13 1.61 1.01 -1.13 -2.65 120.40 122.39 3iga s VAL 168 Ca 0.00 0.14 -0.00 0.00 0.00 0.00 0.00 61.98 62.12 3iga s VAL 168 Cb 0.00 -3.38 0.02 0.00 0.00 0.00 0.00 36.38 33.03 3iga s VAL 168 CO 0.00 0.49 -0.10 -1.00 0.00 0.00 0.00 175.10 174.48 3iga s HIS 169 N 0.04 1.80 -0.31 5.22 3.76 -0.37 -4.97 115.29 120.45 3iga s HIS 169 Ca 0.09 -0.97 -0.01 0.00 -0.15 0.00 0.00 55.06 54.01 3iga s HIS 169 Cb -0.11 -1.40 0.06 0.00 1.11 0.00 0.00 32.58 32.24 3iga s HIS 169 CO -0.00 -0.59 0.02 0.99 -0.85 0.00 0.00 174.74 174.31 3iga s THR 170 N 1.61 2.95 0.70 1.30 2.01 -1.26 0.94 115.64 123.89 3iga s THR 170 Ca 0.05 -1.51 -0.14 0.00 0.31 0.00 0.00 61.69 60.39 3iga s THR 170 Cb -0.13 -2.76 0.02 0.00 0.01 0.00 0.00 72.50 69.64 3iga s THR 170 CO -0.09 -0.19 1.12 -0.36 -0.69 0.00 0.00 174.62 174.41 3iga s PHE 171 N 1.22 2.48 0.32 4.92 0.08 -0.04 -4.98 117.98 121.98 3iga s PHE 171 Ca -0.03 1.57 -0.29 0.00 0.12 0.00 0.00 56.93 58.30 3iga s PHE 171 Cb -0.20 -3.21 -0.10 0.00 -0.57 0.00 0.00 43.02 38.94 3iga s PHE 171 CO -0.02 -1.90 1.37 -2.14 -0.10 0.00 0.00 175.22 172.43 3iga s PRO 172 N -4.20 4.29 0.49 0.24 0.02 -1.26 -4.55 135.00 130.04 3iga s PRO 172 Ca 0.67 2.30 -0.23 0.00 0.02 0.00 0.00 61.00 63.76 3iga s PRO 172 Cb -0.21 -3.06 -0.06 0.00 0.02 0.00 0.00 34.50 31.18 3iga s PRO 172 CO 0.45 -0.30 1.29 0.00 -0.33 0.00 0.00 177.00 178.11 3iga s ALA 173 N -0.90 2.95 -0.06 -1.55 0.00 -1.26 -4.80 121.76 116.13 3iga s ALA 173 Ca 0.52 1.19 0.02 0.00 0.00 0.00 0.00 51.96 53.69 3iga s ALA 173 Cb -0.41 -3.50 -0.03 0.00 0.00 0.00 0.00 23.12 19.18 3iga s ALA 173 CO 0.53 -1.06 -0.10 0.14 0.00 0.00 0.00 175.76 175.27 3iga s VAL 174 N -1.37 3.41 -0.16 0.00 -7.23 -0.28 -4.91 120.40 109.86 3iga s VAL 174 Ca 0.67 -0.59 -0.05 0.00 -1.81 0.00 0.00 61.98 60.20 3iga s VAL 174 Cb -0.36 -2.37 -0.03 0.00 0.56 0.00 0.00 36.38 34.17 3iga s VAL 174 CO 0.44 0.59 -0.01 -0.22 -0.31 0.00 0.00 175.10 175.60 3iga s LEU 175 N -0.74 3.43 -0.18 1.32 2.96 -1.26 -2.33 118.68 121.88 3iga s LEU 175 Ca 0.11 -0.06 -0.07 0.00 -0.22 0.00 0.00 54.13 53.89 3iga s LEU 175 Cb -0.11 -1.84 0.08 0.00 0.50 0.00 0.00 46.19 44.82 3iga s LEU 175 CO 0.01 0.18 0.39 -1.58 -1.32 0.00 0.00 176.35 174.03 3iga s GLN 176 N 0.34 0.31 -1.34 1.98 0.74 -0.76 -4.94 119.66 115.98 3iga s GLN 176 Ca -0.02 0.93 -0.02 0.00 0.05 0.00 0.00 55.36 56.30 3iga s GLN 176 Cb -0.14 0.19 0.01 0.00 1.10 0.00 0.00 33.01 34.17 3iga s GLN 176 CO 0.02 -0.23 0.71 0.43 -0.55 0.00 0.00 175.29 175.67 3iga n SER 177 N 5.09 -1.51 -1.21 6.67 7.64 -1.26 -2.37 113.62 126.67 3iga n SER 177 Ca -0.12 -0.83 -0.14 0.00 1.01 0.00 0.00 58.87 58.79 3iga n SER 177 Cb 0.51 -3.96 -0.05 0.00 -1.01 0.00 0.00 64.21 59.70 3iga n SER 177 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3iga n ASP 178 N -3.03 -4.64 -3.84 6.43 10.43 -1.26 -5.01 116.55 115.64 3iga n ASP 178 Ca -0.26 0.27 -0.12 0.00 2.57 0.00 0.00 54.79 57.25 3iga n ASP 178 Cb 0.66 -3.49 -0.11 0.00 1.84 0.00 0.00 41.12 40.02 3iga n ASP 178 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3iga s LEU 179 N -3.43 1.44 0.44 0.64 1.43 -1.00 -4.83 118.68 113.36 3iga s LEU 179 Ca 0.00 0.13 0.05 0.00 -1.03 0.00 0.00 54.13 53.28 3iga s LEU 179 Cb 0.00 0.61 0.01 0.00 0.03 0.00 0.00 46.19 46.84 3iga s LEU 179 CO 0.00 -0.17 0.61 -0.31 0.23 0.00 0.00 176.35 176.71 3iga s TYR 180 N -0.46 2.95 -0.13 0.29 1.51 0.11 -1.83 117.35 119.79 3iga s TYR 180 Ca -0.05 -0.17 -0.29 0.00 -1.01 0.00 0.00 57.07 55.55 3iga s TYR 180 Cb -0.04 -2.37 0.09 0.00 -0.11 0.00 0.00 41.96 39.53 3iga s TYR 180 CO 0.01 -0.43 0.79 0.99 -1.11 0.00 0.00 175.55 175.80 3iga s THR 181 N -2.44 0.00 -0.10 -0.71 2.01 -0.98 -0.84 115.64 112.58 3iga s THR 181 Ca 0.52 0.00 -0.30 0.00 0.31 0.00 0.00 61.69 62.22 3iga s THR 181 Cb -0.10 -1.00 0.12 0.00 0.01 0.00 0.00 72.50 71.53 3iga s THR 181 CO 0.35 0.00 0.97 -1.48 -0.69 0.00 0.00 174.62 173.76 3iga s LEU 182 N -0.79 -0.35 0.24 4.42 0.05 0.04 -1.12 118.68 121.17 3iga s LEU 182 Ca -0.06 0.20 0.10 0.00 0.05 0.00 0.00 54.13 54.42 3iga s LEU 182 Cb -0.01 1.89 -0.05 0.00 -2.05 0.00 0.00 46.19 45.97 3iga s LEU 182 CO 0.05 -0.45 -0.12 -0.44 -0.55 0.00 0.00 176.35 174.84 3iga s SER 183 N -1.79 4.01 -0.02 1.48 0.01 -1.26 -1.36 113.70 114.77 3iga s SER 183 Ca 0.02 -0.79 0.02 0.00 1.31 0.00 0.00 55.95 56.50 3iga s SER 183 Cb -0.01 -0.55 0.01 0.00 0.21 0.00 0.00 66.02 65.67 3iga s SER 183 CO -0.03 0.05 -0.05 -0.55 0.41 0.00 0.00 173.24 173.07 3iga s SER 184 N -3.31 0.76 0.24 2.44 0.15 -1.14 -0.86 113.70 111.98 3iga s SER 184 Ca 0.28 -0.11 0.11 0.00 0.70 0.00 0.00 55.95 56.93 3iga s SER 184 Cb -0.07 -0.21 -0.05 0.00 -1.71 0.00 0.00 66.02 63.99 3iga s SER 184 CO 0.16 0.02 -0.15 -0.94 1.20 0.00 0.00 173.24 173.53 3iga s SER 185 N 0.27 3.86 -0.02 5.45 1.04 0.27 -2.33 113.70 122.24 3iga s SER 185 Ca -0.03 -0.84 -0.06 0.00 0.48 0.00 0.00 55.95 55.50 3iga s SER 185 Cb -0.07 -0.47 0.01 0.00 0.10 0.00 0.00 66.02 65.58 3iga s SER 185 CO -0.00 0.06 0.13 0.54 0.98 0.00 0.00 173.24 174.94 3iga s VAL 186 N -2.16 0.05 -0.16 5.02 0.11 -0.76 -1.24 120.40 121.25 3iga s VAL 186 Ca 0.27 -0.40 -0.01 0.00 -2.93 0.00 0.00 61.98 58.92 3iga s VAL 186 Cb -0.07 -0.32 0.05 0.00 -1.53 0.00 0.00 36.38 34.51 3iga s VAL 186 CO 0.15 -0.22 -0.02 -0.89 -3.33 0.00 0.00 175.10 170.79 3iga s THR 187 N -0.73 0.84 0.25 5.04 2.01 -1.09 -1.44 115.64 120.53 3iga s THR 187 Ca -0.08 -0.51 0.10 0.00 0.31 0.00 0.00 61.69 61.51 3iga s THR 187 Cb -0.05 -1.11 -0.05 0.00 0.01 0.00 0.00 72.50 71.30 3iga s THR 187 CO 0.01 0.04 -0.18 0.68 -0.69 0.00 0.00 174.62 174.48 3iga s VAL 188 N 1.74 2.20 0.45 3.82 -7.23 -0.88 -4.74 120.40 115.76 3iga s VAL 188 Ca 0.01 -2.31 -0.24 0.00 -1.81 0.00 0.00 61.98 57.62 3iga s VAL 188 Cb -0.15 -2.19 -0.09 0.00 0.56 0.00 0.00 36.38 34.51 3iga s VAL 188 CO -0.07 -0.45 1.23 -2.65 -0.31 0.00 0.00 175.10 172.85 3iga n PRO 189 N -0.46 1.78 -0.19 4.82 -0.02 -1.26 -0.68 135.00 138.98 3iga n PRO 189 Ca -0.07 0.64 -0.00 0.00 -2.02 0.00 0.00 63.50 62.05 3iga n PRO 189 Cb 0.60 -2.35 0.10 0.00 -0.02 0.00 0.00 33.50 31.83 3iga n PRO 189 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3iga h SER 190 N 1.86 0.12 -0.50 2.55 0.02 -1.50 -2.63 113.55 113.47 3iga h SER 190 Ca -0.48 0.09 0.09 0.00 -0.84 0.00 0.00 61.79 60.65 3iga h SER 190 Cb 1.30 0.10 -0.07 0.00 0.14 0.00 0.00 62.40 63.87 3iga h SER 190 CO 0.59 0.07 0.10 0.77 -1.14 0.00 0.00 176.83 177.22 3iga h SER 191 N 0.33 -0.01 0.21 3.07 4.64 -1.90 -2.52 113.55 117.38 3iga h SER 191 Ca 0.30 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 3iga h SER 191 Cb 0.41 0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 3iga h SER 191 CO -0.34 0.02 0.00 0.77 -0.87 0.00 0.00 176.83 176.41 3iga h SER 192 N 0.23 0.00 -4.38 4.97 4.64 -1.83 -3.40 113.55 113.77 3iga h SER 192 Ca 0.25 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.97 3iga h SER 192 Cb 0.34 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 62.15 3iga h SER 192 CO -0.33 0.00 -0.85 0.86 -0.87 0.00 0.00 176.83 175.63 3iga s TRP 193 N -3.72 1.87 -1.41 4.77 -0.00 -0.95 0.35 118.94 119.84 3iga s TRP 193 Ca -0.02 -0.36 0.05 0.00 -0.00 0.00 0.00 56.10 55.77 3iga s TRP 193 Cb 0.09 -1.17 0.19 0.00 -0.00 0.00 0.00 33.47 32.58 3iga s TRP 193 CO 0.33 0.01 0.98 -0.35 -0.00 0.00 0.00 176.95 177.92 3iga n PRO 194 N 2.31 1.72 -0.29 5.86 -0.04 -1.26 -4.92 135.00 138.37 3iga n PRO 194 Ca -0.16 -0.74 0.12 0.00 -0.04 0.00 0.00 63.50 62.68 3iga n PRO 194 Cb 0.53 -1.42 0.27 0.00 -0.04 0.00 0.00 33.50 32.84 3iga n PRO 194 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3iga h SER 195 N 1.07 -0.09 -3.62 3.54 0.87 -1.74 -3.37 113.55 110.21 3iga h SER 195 Ca 0.00 0.20 -0.68 0.00 -1.23 0.00 0.00 61.79 60.09 3iga h SER 195 Cb 0.56 0.29 -0.21 0.00 -0.44 0.00 0.00 62.40 62.61 3iga h SER 195 CO 0.06 -0.18 -0.71 -1.61 -0.53 0.00 0.00 176.83 173.87 3iga s GLU 196 N -5.96 2.92 0.51 2.24 2.02 0.15 -5.09 118.70 115.50 3iga s GLU 196 Ca -0.12 -0.57 -0.22 0.00 0.02 0.00 0.00 54.97 54.08 3iga s GLU 196 Cb 0.26 -2.62 -0.06 0.00 0.10 0.00 0.00 34.13 31.81 3iga s GLU 196 CO 0.77 0.55 1.22 0.99 0.02 0.00 0.00 175.26 178.81 3iga s THR 197 N -0.51 2.75 -0.26 3.63 2.01 -1.26 -4.63 115.64 117.37 3iga s THR 197 Ca 0.07 0.53 -0.03 0.00 0.31 0.00 0.00 61.69 62.57 3iga s THR 197 Cb -0.12 -3.26 0.09 0.00 0.01 0.00 0.00 72.50 69.22 3iga s THR 197 CO 0.02 -0.03 0.10 -0.69 -0.69 0.00 0.00 174.62 173.33 3iga s VAL 198 N -1.51 0.16 0.03 3.82 1.01 -1.26 -4.99 120.40 117.66 3iga s VAL 198 Ca 0.69 -0.73 0.08 0.00 0.00 0.00 0.00 61.98 62.03 3iga s VAL 198 Cb -0.32 -1.02 -0.03 0.00 0.00 0.00 0.00 36.38 35.01 3iga s VAL 198 CO 0.37 -0.57 -0.24 -0.89 0.00 0.00 0.00 175.10 173.77 3iga s THR 199 N 1.99 2.30 -0.24 3.92 2.01 -1.26 -1.37 115.64 123.00 3iga s THR 199 Ca 0.07 -1.29 -0.08 0.00 0.31 0.00 0.00 61.69 60.70 3iga s THR 199 Cb -0.16 -1.90 -0.03 0.00 0.01 0.00 0.00 72.50 70.41 3iga s THR 199 CO -0.26 0.40 0.09 0.00 -0.69 0.00 0.00 174.62 174.16 3iga s ASN 201 N 1.39 6.43 -0.29 0.00 -0.87 0.16 -3.28 114.94 118.47 3iga s ASN 201 Ca 0.06 0.51 0.02 0.00 -1.57 0.00 0.00 52.86 51.87 3iga s ASN 201 Cb -0.15 -2.24 0.07 0.00 -0.02 0.00 0.00 41.25 38.91 3iga s ASN 201 CO 0.04 -0.12 -0.04 -0.69 -2.57 0.00 0.00 177.10 173.72 3iga s VAL 202 N 1.53 2.44 -0.17 1.60 1.01 -0.15 -0.45 120.40 126.21 3iga s VAL 202 Ca 0.19 -1.71 -0.09 0.00 0.00 0.00 0.00 61.98 60.38 3iga s VAL 202 Cb -0.15 -2.50 -0.05 0.00 0.00 0.00 0.00 36.38 33.69 3iga s VAL 202 CO 0.08 -0.17 0.12 0.00 0.00 0.00 0.00 175.10 175.13 3iga s ALA 203 N 1.11 3.68 -0.27 5.51 0.00 0.08 -1.87 121.76 129.99 3iga s ALA 203 Ca -0.04 -0.69 0.00 0.00 0.00 0.00 0.00 51.96 51.23 3iga s ALA 203 Cb -0.20 -2.06 0.08 0.00 0.00 0.00 0.00 23.12 20.95 3iga s ALA 203 CO -0.04 0.30 0.03 -1.58 0.00 0.00 0.00 175.76 174.46 3iga s HIS 204 N -0.04 2.20 0.38 0.00 2.46 0.63 -0.92 115.29 119.99 3iga s HIS 204 Ca 0.09 -1.83 0.05 0.00 0.47 0.00 0.00 55.06 53.84 3iga s HIS 204 Cb -0.11 -1.77 0.74 0.00 -0.13 0.00 0.00 32.58 31.30 3iga s HIS 204 CO 0.00 -0.82 2.02 -1.35 -2.47 0.00 0.00 174.74 172.13 3iga h PRO 205 N 7.98 0.71 0.00 2.88 0.11 -1.81 -2.29 132.00 139.58 3iga h PRO 205 Ca -0.14 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.91 3iga h PRO 205 Cb 1.05 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.00 3iga h PRO 205 CO 0.44 0.47 -0.08 0.00 -0.21 0.00 0.00 178.00 178.62 3iga h ALA 206 N 1.66 1.01 -0.14 -0.75 0.00 -1.86 -3.04 119.26 116.13 3iga h ALA 206 Ca 0.21 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3iga h ALA 206 Cb -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3iga h ALA 206 CO -0.05 0.10 0.00 -1.13 0.00 0.00 0.00 179.25 178.17 3iga n SER 207 N -3.20 2.21 -3.80 0.00 3.41 -1.17 -4.99 113.62 106.08 3iga n SER 207 Ca 0.01 -1.70 -0.26 0.00 -0.26 0.00 0.00 58.87 56.67 3iga n SER 207 Cb 0.36 -0.09 0.01 0.00 -0.26 0.00 0.00 64.21 64.23 3iga n SER 207 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3iga n SER 208 N 0.33 -1.95 -4.00 4.04 7.64 -1.04 -4.97 113.62 113.67 3iga n SER 208 Ca 0.07 -0.95 -0.16 0.00 1.01 0.00 0.00 58.87 58.84 3iga n SER 208 Cb 0.30 -3.47 -0.14 0.00 -1.01 0.00 0.00 64.21 59.89 3iga n SER 208 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3iga s THR 209 N -3.74 0.50 -0.21 0.44 -4.23 -0.89 -5.04 115.64 102.48 3iga s THR 209 Ca 0.13 -0.47 -0.04 0.00 -1.18 0.00 0.00 61.69 60.13 3iga s THR 209 Cb -0.05 -0.46 0.10 0.00 1.34 0.00 0.00 72.50 73.43 3iga s THR 209 CO 0.86 0.00 0.24 -0.75 -0.54 0.00 0.00 174.62 174.43 3iga s LYS 210 N -0.52 0.21 0.27 3.99 2.20 -1.26 -0.27 119.74 124.36 3iga s LYS 210 Ca -0.01 0.24 0.08 0.00 -0.36 0.00 0.00 55.97 55.93 3iga s LYS 210 Cb -0.04 -1.12 -0.04 0.00 -1.51 0.00 0.00 37.83 35.11 3iga s LYS 210 CO -0.00 -0.65 0.11 0.14 -0.36 0.00 0.00 175.35 174.59 3iga s VAL 211 N 2.35 3.82 0.39 4.02 -7.23 -0.78 -4.92 120.40 118.04 3iga s VAL 211 Ca 0.07 -1.65 0.08 0.00 -1.81 0.00 0.00 61.98 58.67 3iga s VAL 211 Cb -0.16 -3.11 -0.07 0.00 0.56 0.00 0.00 36.38 33.60 3iga s VAL 211 CO -0.12 -0.33 -0.00 -1.81 -0.31 0.00 0.00 175.10 172.52 3iga s ASP 212 N -3.78 3.91 -0.16 4.85 1.11 -1.26 -0.97 116.67 120.36 3iga s ASP 212 Ca 0.33 -1.28 -0.28 0.00 0.18 0.00 0.00 52.55 51.50 3iga s ASP 212 Cb -0.07 -0.40 0.08 0.00 1.07 0.00 0.00 42.92 43.60 3iga s ASP 212 CO 0.23 -0.39 0.73 -0.54 1.18 0.00 0.00 175.17 176.38 3iga s LYS 213 N -3.70 0.91 0.26 8.23 -0.14 -1.21 -5.00 119.74 119.10 3iga s LYS 213 Ca 0.35 0.59 0.06 0.00 -1.36 0.00 0.00 55.97 55.61 3iga s LYS 213 Cb 0.07 0.44 -0.03 0.00 -1.68 0.00 0.00 37.83 36.63 3iga s LYS 213 CO 0.18 -0.21 0.30 0.21 -0.76 0.00 0.00 175.35 175.07 3iga s LYS 214 N -0.44 3.18 -0.27 1.68 2.20 -1.26 -1.97 119.74 122.85 3iga s LYS 214 Ca -0.05 -0.92 -0.02 0.00 -0.36 0.00 0.00 55.97 54.62 3iga s LYS 214 Cb -0.02 -2.74 0.04 0.00 -1.51 0.00 0.00 37.83 33.60 3iga s LYS 214 CO 0.05 0.37 -0.03 0.42 -0.36 0.00 0.00 175.35 175.80 3iga s ILE 215 N -2.07 2.94 0.01 5.43 -1.09 -0.47 -4.89 121.20 121.06 3iga s ILE 215 Ca 0.35 -1.18 0.08 0.00 -2.23 0.00 0.00 60.65 57.66 3iga s ILE 215 Cb -0.08 -2.59 -0.03 0.00 -1.58 0.00 0.00 42.46 38.18 3iga s ILE 215 CO 0.27 0.06 -0.23 0.68 -1.23 0.00 0.00 174.94 174.49 3iga s VAL 216 N 1.29 2.37 0.64 2.92 -7.23 -1.26 -4.59 120.40 114.54 3iga s VAL 216 Ca -0.02 -1.17 -0.18 0.00 -1.81 0.00 0.00 61.98 58.79 3iga s VAL 216 Cb -0.18 -1.91 -0.02 0.00 0.56 0.00 0.00 36.38 34.82 3iga s VAL 216 CO -0.03 0.46 1.15 -0.81 -0.31 0.00 0.00 175.10 175.56 3iga n PRO 217 N 2.00 0.98 -1.27 4.82 -0.04 -1.26 -4.88 135.00 135.34 3iga n PRO 217 Ca -0.16 0.39 -0.34 0.00 -0.04 0.00 0.00 63.50 63.34 3iga n PRO 217 Cb 0.52 -2.38 0.11 0.00 -0.04 0.00 0.00 33.50 31.71 3iga n PRO 217 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3iga s ARG 218 N -3.15 1.88 0.00 0.54 0.52 -1.26 -5.14 118.95 112.33 3iga s ARG 218 Ca 0.80 1.77 0.00 0.00 -0.52 0.00 0.00 55.73 57.78 3iga s ARG 218 Cb -0.39 -1.80 0.00 0.00 0.52 0.00 0.00 34.95 33.28 3iga s ARG 218 CO 0.43 -2.03 0.00 -0.40 0.02 0.00 0.00 175.30 173.32