#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i3t s GLN 2 N 0.00 0.59 -0.33 2.12 0.74 -0.15 -4.96 119.66 117.67 2i3t s GLN 2 Ca 0.00 -0.03 -0.12 0.00 0.05 0.00 0.00 55.36 55.26 2i3t s GLN 2 Cb 0.00 -0.66 -0.02 0.00 1.10 0.00 0.00 33.01 33.43 2i3t s GLN 2 CO 0.00 -0.10 0.22 0.42 -0.55 0.00 0.00 175.29 175.28 2i3t s ILE 3 N 0.91 5.13 -0.13 -2.34 1.01 -1.26 -0.56 121.20 123.96 2i3t s ILE 3 Ca -0.11 -0.23 0.02 0.00 0.00 0.00 0.00 60.65 60.33 2i3t s ILE 3 Cb -0.14 -3.62 0.01 0.00 0.01 0.00 0.00 42.46 38.73 2i3t s ILE 3 CO -0.01 0.03 -0.20 0.54 0.00 0.00 0.00 174.94 175.31 2i3t s VAL 4 N 1.70 1.87 0.24 2.92 0.11 -0.90 -4.98 120.40 121.35 2i3t s VAL 4 Ca 0.06 -0.86 -0.27 0.00 -2.93 0.00 0.00 61.98 57.98 2i3t s VAL 4 Cb -0.17 -1.67 -0.09 0.00 -1.53 0.00 0.00 36.38 32.92 2i3t s VAL 4 CO 0.10 0.51 0.87 -1.58 -3.33 0.00 0.00 175.10 171.67 2i3t s GLN 5 N 0.91 4.65 0.10 1.54 0.74 -1.26 -1.84 119.66 124.51 2i3t s GLN 5 Ca -0.06 1.30 -0.30 0.00 0.05 0.00 0.00 55.36 56.35 2i3t s GLN 5 Cb -0.15 -3.12 -0.06 0.00 1.10 0.00 0.00 33.01 30.78 2i3t s GLN 5 CO -0.03 0.47 0.95 0.42 -0.55 0.00 0.00 175.29 176.55 2i3t s ILE 6 N -1.31 4.53 -0.03 -2.34 1.01 0.23 -4.95 121.20 118.34 2i3t s ILE 6 Ca 0.42 2.04 0.09 0.00 0.00 0.00 0.00 60.65 63.20 2i3t s ILE 6 Cb -0.23 -4.31 -0.24 0.00 0.01 0.00 0.00 42.46 37.70 2i3t s ILE 6 CO 0.27 0.32 0.72 -0.33 0.00 0.00 0.00 174.94 175.91 2i3t h GLU 7 N 5.62 0.05 -3.54 2.79 4.39 -1.91 -3.41 114.58 118.57 2i3t h GLU 7 Ca -0.43 -0.08 -0.79 0.00 0.34 0.00 0.00 59.36 58.40 2i3t h GLU 7 Cb 1.21 0.03 -0.26 0.00 -0.10 0.00 0.00 28.75 29.63 2i3t h GLU 7 CO 0.72 0.68 0.79 1.04 -1.16 0.00 0.00 179.01 181.07 2i3t n GLN 8 N -3.16 3.79 -4.50 2.33 6.02 -1.26 -5.01 117.38 115.59 2i3t n GLN 8 Ca -0.17 -4.34 -0.29 0.00 -0.01 0.00 0.00 57.00 52.20 2i3t n GLN 8 Cb 1.04 -2.63 -0.13 0.00 1.02 0.00 0.00 30.24 29.53 2i3t n GLN 8 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2i3t s ALA 9 N -1.21 2.30 0.60 -1.58 0.00 -1.26 -4.95 121.76 115.67 2i3t s ALA 9 Ca 0.33 -1.41 -0.19 0.00 0.00 0.00 0.00 51.96 50.69 2i3t s ALA 9 Cb -0.03 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.66 2i3t s ALA 9 CO -0.01 0.52 1.17 -2.30 0.00 0.00 0.00 175.76 175.15 2i3t n PRO 10 N 1.12 1.16 0.04 0.00 -0.02 -1.26 -4.90 135.00 131.13 2i3t n PRO 10 Ca -0.18 0.44 -0.12 0.00 -2.02 0.00 0.00 63.50 61.62 2i3t n PRO 10 Cb 0.53 -2.39 -0.14 0.00 -0.02 0.00 0.00 33.50 31.49 2i3t n PRO 10 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2i3t h LYS 11 N 0.73 0.12 -7.35 -0.52 1.79 -1.96 -3.32 116.57 106.06 2i3t h LYS 11 Ca -0.50 -0.20 -0.47 0.00 -2.18 0.00 0.00 60.65 57.30 2i3t h LYS 11 Cb 1.34 0.08 0.15 0.00 -1.58 0.00 0.00 32.23 32.21 2i3t h LYS 11 CO 0.53 0.92 0.24 0.34 -1.08 0.00 0.00 179.45 180.41 2i3t s ASP 12 N -6.68 3.32 0.29 0.86 -1.08 -1.26 -0.73 116.67 111.40 2i3t s ASP 12 Ca -0.06 1.38 -0.29 0.00 -0.52 0.00 0.00 52.55 53.07 2i3t s ASP 12 Cb 0.08 -2.06 -0.14 0.00 -1.46 0.00 0.00 42.92 39.35 2i3t s ASP 12 CO 0.83 -2.72 1.12 0.00 0.52 0.00 0.00 175.17 174.92 2i3t n TYR 13 N -3.92 1.58 -3.74 -5.34 4.19 -1.26 -4.50 117.16 104.16 2i3t n TYR 13 Ca 0.06 0.65 -0.35 0.00 3.31 0.00 0.00 57.90 61.57 2i3t n TYR 13 Cb 0.56 -2.31 -0.08 0.00 0.49 0.00 0.00 39.34 38.00 2i3t n TYR 13 CO 0.00 0.00 0.00 0.42 0.91 0.00 0.00 176.86 178.19 2i3t s ILE 14 N -0.94 5.40 -0.04 2.97 1.01 -1.26 -0.83 121.20 127.51 2i3t s ILE 14 Ca 0.59 0.19 0.19 0.00 0.00 0.00 0.00 60.65 61.62 2i3t s ILE 14 Cb -0.68 -3.46 -0.29 0.00 0.01 0.00 0.00 42.46 38.05 2i3t s ILE 14 CO 0.59 0.45 0.37 -1.54 0.00 0.00 0.00 174.94 174.82 2i3t n SER 15 N 3.46 0.64 -3.50 3.58 3.41 -0.18 -4.83 113.62 116.19 2i3t n SER 15 Ca -0.16 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.30 2i3t n SER 15 Cb 0.52 1.76 -0.04 0.00 -0.26 0.00 0.00 64.21 66.18 2i3t n SER 15 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2i3t s ASP 16 N -4.32 -0.58 -0.04 4.04 -1.08 -1.19 -4.70 116.67 108.80 2i3t s ASP 16 Ca -0.07 0.43 -0.02 0.00 -0.52 0.00 0.00 52.55 52.37 2i3t s ASP 16 Cb 0.11 0.52 0.03 0.00 -1.46 0.00 0.00 42.92 42.12 2i3t s ASP 16 CO 0.78 -0.68 0.08 -0.63 0.52 0.00 0.00 175.17 175.24 2i3t s ILE 17 N -2.04 -0.10 -0.03 4.11 1.01 -1.26 -2.26 121.20 120.62 2i3t s ILE 17 Ca -0.05 0.30 0.02 0.00 0.00 0.00 0.00 60.65 60.92 2i3t s ILE 17 Cb -0.00 -0.16 0.01 0.00 0.01 0.00 0.00 42.46 42.31 2i3t s ILE 17 CO 0.01 0.12 -0.09 -0.54 0.00 0.00 0.00 174.94 174.45 2i3t s LYS 18 N 1.60 0.97 -0.13 2.79 -0.14 -0.54 -4.71 119.74 119.58 2i3t s LYS 18 Ca -0.03 -0.28 -0.04 0.00 -1.36 0.00 0.00 55.97 54.26 2i3t s LYS 18 Cb -0.12 -0.91 -0.03 0.00 -1.68 0.00 0.00 37.83 35.09 2i3t s LYS 18 CO -0.04 0.08 0.02 0.42 -0.76 0.00 0.00 175.35 175.07 2i3t s ILE 19 N 0.31 4.44 -0.83 2.17 1.01 -1.26 -0.16 121.20 126.87 2i3t s ILE 19 Ca -0.05 -0.18 -0.01 0.00 0.00 0.00 0.00 60.65 60.42 2i3t s ILE 19 Cb -0.10 -2.93 0.20 0.00 0.01 0.00 0.00 42.46 39.65 2i3t s ILE 19 CO 0.01 0.54 0.69 -0.63 0.00 0.00 0.00 174.94 175.54 2i3t s ILE 20 N -0.25 4.02 0.25 2.92 1.01 -0.17 -4.96 121.20 124.02 2i3t s ILE 20 Ca 0.06 -3.83 -0.06 0.00 0.00 0.00 0.00 60.65 56.83 2i3t s ILE 20 Cb -0.12 -3.53 0.26 0.00 0.01 0.00 0.00 42.46 39.08 2i3t s ILE 20 CO 0.02 -1.05 1.65 1.55 0.00 0.00 0.00 174.94 177.11 2i3t h PRO 21 N 6.03 0.15 -1.00 2.79 0.13 -1.95 -0.80 132.00 137.34 2i3t h PRO 21 Ca 0.13 -0.01 0.19 0.00 -0.87 0.00 0.00 66.00 65.45 2i3t h PRO 21 Cb 0.82 -0.03 -0.11 0.00 0.13 0.00 0.00 31.00 31.81 2i3t h PRO 21 CO 0.81 0.10 0.61 0.66 -0.23 0.00 0.00 178.00 179.95 2i3t h SER 22 N 0.16 0.78 -0.43 1.44 4.64 -1.96 -1.50 113.55 116.67 2i3t h SER 22 Ca 0.42 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.84 2i3t h SER 22 Cb 0.76 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 2i3t h SER 22 CO -0.61 0.26 0.00 0.29 -0.87 0.00 0.00 176.83 175.90 2i3t n LYS 23 N -4.78 2.64 -3.94 4.77 4.01 -0.83 -4.97 118.16 115.06 2i3t n LYS 23 Ca 0.24 -2.18 -0.31 0.00 -0.51 0.00 0.00 58.31 55.55 2i3t n LYS 23 Cb 0.58 -1.37 0.01 0.00 -0.51 0.00 0.00 35.03 33.75 2i3t n LYS 23 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 2i3t n SER 24 N 0.91 -4.40 -4.89 4.39 7.64 -0.38 -4.88 113.62 112.01 2i3t n SER 24 Ca 0.15 -0.80 -0.21 0.00 1.01 0.00 0.00 58.87 59.02 2i3t n SER 24 Cb 0.48 -3.54 -0.03 0.00 -1.01 0.00 0.00 64.21 60.11 2i3t n SER 24 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2i3t s LEU 25 N -7.22 3.94 -0.07 -3.43 1.43 -0.76 -1.82 118.68 110.75 2i3t s LEU 25 Ca 0.67 -0.19 -0.01 0.00 -1.03 0.00 0.00 54.13 53.56 2i3t s LEU 25 Cb -0.34 -2.51 0.03 0.00 0.03 0.00 0.00 46.19 43.39 2i3t s LEU 25 CO 0.82 -0.14 0.01 -0.22 0.23 0.00 0.00 176.35 177.05 2i3t s LEU 26 N -3.94 0.57 -0.19 1.79 2.96 -0.69 -1.00 118.68 118.18 2i3t s LEU 26 Ca 0.36 -0.09 -0.08 0.00 -0.22 0.00 0.00 54.13 54.09 2i3t s LEU 26 Cb -0.08 -0.43 -0.04 0.00 0.50 0.00 0.00 46.19 46.14 2i3t s LEU 26 CO 0.27 -0.20 0.09 -0.76 -1.32 0.00 0.00 176.35 174.43 2i3t s LEU 27 N 1.98 3.97 -0.05 -0.68 1.43 0.77 -1.25 118.68 124.85 2i3t s LEU 27 Ca 0.05 0.13 -0.00 0.00 -1.03 0.00 0.00 54.13 53.28 2i3t s LEU 27 Cb -0.12 -2.02 0.03 0.00 0.03 0.00 0.00 46.19 44.11 2i3t s LEU 27 CO -0.05 0.17 -0.01 -0.63 0.23 0.00 0.00 176.35 176.06 2i3t s ILE 28 N 0.40 0.35 -0.11 -0.59 1.01 -0.71 -1.46 121.20 120.09 2i3t s ILE 28 Ca 0.05 0.06 -0.02 0.00 0.00 0.00 0.00 60.65 60.74 2i3t s ILE 28 Cb -0.12 -0.46 -0.03 0.00 0.01 0.00 0.00 42.46 41.86 2i3t s ILE 28 CO -0.00 0.22 -0.01 0.42 0.00 0.00 0.00 174.94 175.56 2i3t s THR 29 N 1.47 4.15 0.41 2.92 -4.23 -0.96 -1.09 115.64 118.32 2i3t s THR 29 Ca -0.03 -0.29 0.07 0.00 -1.18 0.00 0.00 61.69 60.26 2i3t s THR 29 Cb -0.13 -2.77 -0.07 0.00 1.34 0.00 0.00 72.50 70.87 2i3t s THR 29 CO -0.03 0.57 0.04 -0.55 -0.54 0.00 0.00 174.62 174.11 2i3t s SER 30 N -0.47 3.98 0.00 3.99 0.15 -0.64 -1.02 113.70 119.69 2i3t s SER 30 Ca 0.08 -1.31 0.30 0.00 0.70 0.00 0.00 55.95 55.72 2i3t s SER 30 Cb -0.12 -0.41 1.40 0.00 -1.71 0.00 0.00 66.02 65.17 2i3t s SER 30 CO 0.02 -0.46 1.97 0.79 1.20 0.00 0.00 173.24 176.76 2i3t n TRP 31 N -1.01 0.00 1.69 3.44 7.02 -0.01 -2.23 117.44 126.34 2i3t n TRP 31 Ca -0.04 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.55 2i3t n TRP 31 Cb 0.66 -0.20 0.55 0.00 -2.42 0.00 0.00 31.31 29.90 2i3t n TRP 31 CO 0.00 0.00 0.00 -0.40 -2.02 0.00 0.00 177.69 175.27 2i3t n ASP 32 N -1.06 0.71 0.00 -0.99 3.85 -1.26 -4.29 116.55 113.50 2i3t n ASP 32 Ca 0.15 -1.46 0.00 0.00 -0.71 0.00 0.00 54.79 52.77 2i3t n ASP 32 Cb 0.25 -0.03 0.00 0.00 -1.35 0.00 0.00 41.12 39.98 2i3t n ASP 32 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2i3t n GLY 33 N 0.97 0.75 3.92 6.12 0.00 -1.16 -4.75 105.19 111.05 2i3t n GLY 33 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 2i3t n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2i3t s SER 34 N -2.26 6.38 -0.26 1.61 1.04 -1.26 0.82 113.70 119.76 2i3t s SER 34 Ca 0.00 0.32 0.01 0.00 0.48 0.00 0.00 55.95 56.76 2i3t s SER 34 Cb 0.00 -1.98 0.07 0.00 0.10 0.00 0.00 66.02 64.21 2i3t s SER 34 CO 0.00 0.10 -0.03 -0.22 0.98 0.00 0.00 173.24 174.08 2i3t s LEU 35 N -2.77 3.02 -0.13 2.42 2.96 0.12 -1.61 118.68 122.70 2i3t s LEU 35 Ca 0.36 -1.42 -0.02 0.00 -0.22 0.00 0.00 54.13 52.83 2i3t s LEU 35 Cb -0.12 -1.27 -0.03 0.00 0.50 0.00 0.00 46.19 45.27 2i3t s LEU 35 CO 0.28 -0.27 -0.05 0.28 -1.32 0.00 0.00 176.35 175.26 2i3t s THR 36 N 1.30 3.82 -0.21 3.68 -1.32 -0.25 -0.83 115.64 121.82 2i3t s THR 36 Ca -0.02 -0.40 -0.07 0.00 -1.21 0.00 0.00 61.69 60.00 2i3t s THR 36 Cb -0.19 -2.64 -0.03 0.00 -1.51 0.00 0.00 72.50 68.13 2i3t s THR 36 CO -0.08 0.53 0.05 -0.69 -2.21 0.00 0.00 174.62 172.21 2i3t s VAL 37 N -0.01 4.34 0.38 5.08 1.01 -0.75 -1.74 120.40 128.72 2i3t s VAL 37 Ca 0.00 -0.18 0.08 0.00 0.00 0.00 0.00 61.98 61.89 2i3t s VAL 37 Cb -0.13 -2.99 -0.04 0.00 0.00 0.00 0.00 36.38 33.21 2i3t s VAL 37 CO 0.03 0.40 0.18 -0.31 0.00 0.00 0.00 175.10 175.40 2i3t s TYR 38 N 1.06 2.65 -0.06 5.22 1.51 -0.38 -0.99 117.35 126.36 2i3t s TYR 38 Ca 0.03 -0.49 0.01 0.00 -1.01 0.00 0.00 57.07 55.61 2i3t s TYR 38 Cb -0.14 -1.84 0.02 0.00 -0.11 0.00 0.00 41.96 39.88 2i3t s TYR 38 CO 0.03 0.22 -0.07 0.21 -1.11 0.00 0.00 175.55 174.82 2i3t s LYS 39 N -3.90 1.23 0.26 -0.62 2.36 -0.49 -1.70 119.74 116.88 2i3t s LYS 39 Ca 0.40 -0.23 0.12 0.00 -2.55 0.00 0.00 55.97 53.71 2i3t s LYS 39 Cb 0.00 -1.16 -0.05 0.00 -1.05 0.00 0.00 37.83 35.58 2i3t s LYS 39 CO 0.23 -0.08 -0.21 -0.59 1.55 0.00 0.00 175.35 176.25 2i3t s PHE 40 N 0.99 2.27 -0.20 4.03 -0.12 -0.76 -0.31 117.98 123.89 2i3t s PHE 40 Ca -0.09 -0.34 -0.02 0.00 -0.05 0.00 0.00 56.93 56.43 2i3t s PHE 40 Cb -0.15 -1.02 0.06 0.00 -0.63 0.00 0.00 43.02 41.29 2i3t s PHE 40 CO 0.00 0.66 0.00 0.34 -0.05 0.00 0.00 175.22 176.17 2i3t s ASP 41 N -3.32 3.15 0.35 1.98 3.68 -0.02 -4.84 116.67 117.65 2i3t s ASP 41 Ca 0.28 -0.90 0.03 0.00 2.13 0.00 0.00 52.55 54.09 2i3t s ASP 41 Cb -0.06 -0.79 0.66 0.00 -1.45 0.00 0.00 42.92 41.28 2i3t s ASP 41 CO 0.14 -0.27 1.98 0.16 0.13 0.00 0.00 175.17 177.30 2i3t h ILE 42 N 6.55 1.10 0.51 4.11 -2.65 -1.97 0.76 117.51 125.91 2i3t h ILE 42 Ca -0.17 -0.29 -0.02 0.00 1.03 0.00 0.00 64.86 65.40 2i3t h ILE 42 Cb 1.10 0.18 0.00 0.00 -2.05 0.00 0.00 36.82 36.06 2i3t h ILE 42 CO 0.36 0.15 -0.24 1.56 0.03 0.00 0.00 178.15 180.01 2i3t h GLN 43 N 0.85 -0.66 0.00 0.16 1.08 -1.97 -3.28 115.11 111.29 2i3t h GLN 43 Ca 0.28 0.04 -0.02 0.00 -1.45 0.00 0.00 58.65 57.51 2i3t h GLN 43 Cb 0.07 0.15 -0.00 0.00 -0.05 0.00 0.00 27.48 27.65 2i3t h GLN 43 CO -0.08 -0.38 -0.08 0.00 -0.95 0.00 0.00 178.83 177.34 2i3t h ALA 44 N -0.97 1.00 -4.25 3.87 0.00 -1.97 -3.47 119.26 113.47 2i3t h ALA 44 Ca -0.07 -0.07 -0.30 0.00 0.00 0.00 0.00 54.91 54.47 2i3t h ALA 44 Cb 0.58 -0.01 0.09 0.00 0.00 0.00 0.00 17.79 18.44 2i3t h ALA 44 CO 0.11 0.10 -0.49 1.63 0.00 0.00 0.00 179.25 180.60 2i3t n LYS 45 N -3.18 -5.24 -4.29 0.00 4.01 0.26 -5.03 118.16 104.70 2i3t n LYS 45 Ca 0.01 0.64 -0.15 0.00 -0.51 0.00 0.00 58.31 58.30 2i3t n LYS 45 Cb 0.38 -5.05 -0.10 0.00 -0.51 0.00 0.00 35.03 29.75 2i3t n LYS 45 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 2i3t s ASN 46 N -3.09 1.86 -0.02 4.39 4.22 -1.16 -4.92 114.94 116.22 2i3t s ASN 46 Ca 0.37 -1.09 0.00 0.00 -2.14 0.00 0.00 52.86 50.01 2i3t s ASN 46 Cb -0.16 -0.01 0.02 0.00 1.28 0.00 0.00 41.25 42.38 2i3t s ASN 46 CO 0.46 -0.39 0.00 0.54 -2.04 0.00 0.00 177.10 175.68 2i3t s VAL 47 N -3.34 0.11 -0.05 3.54 0.11 -1.26 -0.84 120.40 118.67 2i3t s VAL 47 Ca 0.21 0.08 0.06 0.00 -2.93 0.00 0.00 61.98 59.41 2i3t s VAL 47 Cb 0.03 -0.19 -0.01 0.00 -1.53 0.00 0.00 36.38 34.68 2i3t s VAL 47 CO 0.04 0.11 -0.25 -1.81 -3.33 0.00 0.00 175.10 169.86 2i3t s ASP 48 N 0.79 3.12 0.15 3.54 1.01 0.57 -4.92 116.67 120.94 2i3t s ASP 48 Ca -0.07 -0.49 -0.31 0.00 0.71 0.00 0.00 52.55 52.39 2i3t s ASP 48 Cb -0.11 -0.74 -0.09 0.00 1.01 0.00 0.00 42.92 43.00 2i3t s ASP 48 CO -0.02 0.27 1.41 -0.22 0.21 0.00 0.00 175.17 176.82 2i3t s LEU 49 N -0.28 4.38 -0.23 1.23 0.20 -1.26 -1.40 118.68 121.32 2i3t s LEU 49 Ca 0.00 2.42 -0.02 0.00 0.69 0.00 0.00 54.13 57.22 2i3t s LEU 49 Cb -0.13 -3.60 -0.13 0.00 -0.43 0.00 0.00 46.19 41.90 2i3t s LEU 49 CO 0.02 -0.66 -0.23 -0.11 -0.29 0.00 0.00 176.35 175.09 2i3t n LEU 50 N 3.55 2.61 -3.83 -0.68 7.94 -0.16 -4.91 117.00 121.52 2i3t n LEU 50 Ca 0.10 -0.00 -0.06 0.00 -1.11 0.00 0.00 56.01 54.94 2i3t n LEU 50 Cb 0.42 -0.76 0.01 0.00 0.53 0.00 0.00 43.42 43.62 2i3t n LEU 50 CO 0.59 0.77 0.61 -1.58 -1.11 0.00 0.00 177.39 176.66 2i3t s GLN 51 N -2.44 1.78 -0.29 1.96 0.74 -1.01 -5.02 119.66 115.39 2i3t s GLN 51 Ca -0.31 -1.09 -0.15 0.00 0.05 0.00 0.00 55.36 53.85 2i3t s GLN 51 Cb 0.09 0.54 0.12 0.00 1.10 0.00 0.00 33.01 34.85 2i3t s GLN 51 CO 0.49 -0.83 0.82 0.45 -0.55 0.00 0.00 175.29 175.67 2i3t s SER 52 N -3.08 -0.76 -0.06 6.67 0.15 -1.26 -1.81 113.70 113.54 2i3t s SER 52 Ca 0.15 1.19 0.05 0.00 0.70 0.00 0.00 55.95 58.04 2i3t s SER 52 Cb -0.04 1.42 -0.01 0.00 -1.71 0.00 0.00 66.02 65.67 2i3t s SER 52 CO 0.08 -0.18 -0.22 -0.76 1.20 0.00 0.00 173.24 173.35 2i3t s LEU 53 N 1.70 2.25 -0.08 3.45 1.43 -0.01 -4.95 118.68 122.45 2i3t s LEU 53 Ca -0.09 -0.44 0.03 0.00 -1.03 0.00 0.00 54.13 52.61 2i3t s LEU 53 Cb -0.05 -1.42 -0.01 0.00 0.03 0.00 0.00 46.19 44.73 2i3t s LEU 53 CO -0.18 0.26 -0.19 -0.60 0.23 0.00 0.00 176.35 175.88 2i3t s ARG 54 N -0.26 2.84 0.29 1.70 3.52 -1.26 0.13 118.95 125.92 2i3t s ARG 54 Ca -0.00 -0.79 0.09 0.00 -0.13 0.00 0.00 55.73 54.90 2i3t s ARG 54 Cb -0.13 -2.37 -0.04 0.00 -1.56 0.00 0.00 34.95 30.85 2i3t s ARG 54 CO 0.03 0.37 0.02 -0.47 -0.81 0.00 0.00 175.30 174.43 2i3t s TYR 55 N -0.09 2.66 0.46 5.12 5.04 0.24 -4.95 117.35 125.83 2i3t s TYR 55 Ca -0.04 -0.29 0.14 0.00 -2.44 0.00 0.00 57.07 54.44 2i3t s TYR 55 Cb -0.14 -1.32 1.03 0.00 0.35 0.00 0.00 41.96 41.88 2i3t s TYR 55 CO 0.04 0.55 2.01 1.57 -1.34 0.00 0.00 175.55 178.38 2i3t h LYS 56 N 1.82 0.02 -6.35 4.97 2.10 -1.93 -3.41 116.57 113.78 2i3t h LYS 56 Ca -0.44 -0.00 -0.61 0.00 -2.00 0.00 0.00 60.65 57.60 2i3t h LYS 56 Cb 1.25 -0.00 -0.12 0.00 -0.90 0.00 0.00 32.23 32.46 2i3t h LYS 56 CO 0.62 0.16 -0.67 -1.01 -2.00 0.00 0.00 179.45 176.55 2i3t s HIS 57 N -4.72 2.79 0.35 0.07 3.76 -1.26 -4.96 115.29 111.31 2i3t s HIS 57 Ca -0.04 -0.16 -0.29 0.00 -0.15 0.00 0.00 55.06 54.42 2i3t s HIS 57 Cb 0.16 -1.35 -0.11 0.00 1.11 0.00 0.00 32.58 32.39 2i3t s HIS 57 CO 0.70 0.52 1.49 -2.14 -0.85 0.00 0.00 174.74 174.45 2i3t s PRO 58 N -2.96 4.15 -0.16 8.40 0.02 -1.26 -4.16 135.00 139.03 2i3t s PRO 58 Ca 0.27 2.52 -0.15 0.00 0.02 0.00 0.00 61.00 63.66 2i3t s PRO 58 Cb -0.09 -3.00 -0.04 0.00 0.02 0.00 0.00 34.50 31.39 2i3t s PRO 58 CO 0.18 -0.51 0.36 -0.51 -0.33 0.00 0.00 177.00 176.18 2i3t s LEU 59 N -1.64 4.23 -0.01 -5.54 1.43 -0.94 -1.85 118.68 114.36 2i3t s LEU 59 Ca 0.55 0.58 0.22 0.00 -1.03 0.00 0.00 54.13 54.44 2i3t s LEU 59 Cb -0.46 -2.47 -0.27 0.00 0.03 0.00 0.00 46.19 43.02 2i3t s LEU 59 CO 0.58 0.04 0.69 0.18 0.23 0.00 0.00 176.35 178.07 2i3t n LEU 60 N 3.77 0.46 -3.77 1.79 4.77 0.18 -4.24 117.00 119.95 2i3t n LEU 60 Ca -0.10 -0.21 -0.01 0.00 -0.03 0.00 0.00 56.01 55.66 2i3t n LEU 60 Cb 0.52 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 2i3t n LEU 60 CO 0.41 0.10 0.90 0.00 -1.33 0.00 0.00 177.39 177.47 2i3t s ASN 63 N -2.75 -0.07 0.09 0.00 3.84 -0.79 -4.71 114.94 110.55 2i3t s ASN 63 Ca 0.08 -0.54 -0.09 0.00 0.21 0.00 0.00 52.86 52.53 2i3t s ASN 63 Cb -0.02 0.48 -0.00 0.00 -0.55 0.00 0.00 41.25 41.15 2i3t s ASN 63 CO -0.03 -0.92 0.19 0.72 -2.79 0.00 0.00 177.10 174.27 2i3t s PHE 64 N -2.63 0.18 -0.13 0.43 -0.12 -1.26 -1.34 117.98 113.11 2i3t s PHE 64 Ca 0.17 -0.61 0.02 0.00 -0.05 0.00 0.00 56.93 56.47 2i3t s PHE 64 Cb -0.02 -0.07 0.01 0.00 -0.63 0.00 0.00 43.02 42.32 2i3t s PHE 64 CO 0.04 -0.55 -0.20 0.42 -0.05 0.00 0.00 175.22 174.87 2i3t s ILE 65 N -3.87 1.92 -0.39 -4.49 1.01 -0.79 -5.00 121.20 109.60 2i3t s ILE 65 Ca 0.06 -0.90 0.11 0.00 0.00 0.00 0.00 60.65 59.92 2i3t s ILE 65 Cb 0.05 -1.71 0.44 0.00 0.01 0.00 0.00 42.46 41.24 2i3t s ILE 65 CO -0.10 0.52 1.03 -0.67 0.00 0.00 0.00 174.94 175.72 2i3t n ASP 66 N 4.08 3.17 0.16 3.58 2.03 -1.26 -1.66 116.55 126.64 2i3t n ASP 66 Ca -0.20 -3.25 0.03 0.00 0.52 0.00 0.00 54.79 51.89 2i3t n ASP 66 Cb 0.51 -0.50 0.14 0.00 -0.72 0.00 0.00 41.12 40.56 2i3t n ASP 66 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2i3t h ASN 67 N 2.78 0.00 0.00 1.67 7.08 -1.97 -3.45 115.58 121.69 2i3t h ASN 67 Ca 0.11 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.33 2i3t h ASN 67 Cb 1.03 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.27 2i3t h ASN 67 CO 0.69 0.48 0.00 0.35 -2.08 0.00 0.00 177.43 176.86 2i3t n THR 68 N -3.34 0.00 -3.70 6.14 -2.24 -1.26 -5.09 114.28 104.79 2i3t n THR 68 Ca 0.01 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.43 2i3t n THR 68 Cb 0.66 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.79 2i3t n THR 68 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2i3t s ASP 69 N -1.65 6.09 -0.02 3.42 1.11 -1.26 -5.05 116.67 119.31 2i3t s ASP 69 Ca 0.00 0.13 -0.30 0.00 0.18 0.00 0.00 52.55 52.56 2i3t s ASP 69 Cb 0.00 -2.09 -0.05 0.00 1.07 0.00 0.00 42.92 41.85 2i3t s ASP 69 CO 0.00 0.10 1.47 -0.22 1.18 0.00 0.00 175.17 177.70 2i3t s LEU 70 N 0.86 4.31 -0.08 1.23 2.96 -1.26 -4.55 118.68 122.15 2i3t s LEU 70 Ca 0.07 2.14 -0.00 0.00 -0.22 0.00 0.00 54.13 56.12 2i3t s LEU 70 Cb -0.13 -3.55 0.02 0.00 0.50 0.00 0.00 46.19 43.03 2i3t s LEU 70 CO 0.03 -0.79 -0.04 0.00 -1.32 0.00 0.00 176.35 174.22 2i3t s GLN 71 N 2.89 1.04 -0.00 1.98 -2.07 -0.67 -5.01 119.66 117.82 2i3t s GLN 71 Ca 0.66 -0.10 -0.00 0.00 -1.82 0.00 0.00 55.36 54.10 2i3t s GLN 71 Cb -0.32 -1.17 -0.04 0.00 -1.09 0.00 0.00 33.01 30.39 2i3t s GLN 71 CO 0.27 -0.21 0.09 0.42 -1.32 0.00 0.00 175.29 174.53 2i3t s ILE 72 N 1.53 4.77 0.05 3.63 1.01 -1.26 -1.88 121.20 129.05 2i3t s ILE 72 Ca -0.00 -0.41 0.03 0.00 0.00 0.00 0.00 60.65 60.27 2i3t s ILE 72 Cb -0.13 -3.19 -0.02 0.00 0.01 0.00 0.00 42.46 39.12 2i3t s ILE 72 CO -0.04 0.34 -0.10 -0.31 0.00 0.00 0.00 174.94 174.82 2i3t s TYR 73 N -1.21 0.88 0.12 3.97 1.51 -0.45 -0.31 117.35 121.86 2i3t s TYR 73 Ca 0.24 -0.46 0.01 0.00 -1.01 0.00 0.00 57.07 55.85 2i3t s TYR 73 Cb -0.12 -0.51 -0.04 0.00 -0.11 0.00 0.00 41.96 41.17 2i3t s TYR 73 CO 0.15 -0.03 -0.02 0.14 -1.11 0.00 0.00 175.55 174.68 2i3t s VAL 74 N -1.25 0.56 -0.02 0.71 -7.23 -0.76 -1.89 120.40 110.52 2i3t s VAL 74 Ca -0.06 -1.93 0.07 0.00 -1.81 0.00 0.00 61.98 58.25 2i3t s VAL 74 Cb -0.09 -1.86 -0.02 0.00 0.56 0.00 0.00 36.38 34.96 2i3t s VAL 74 CO 0.01 -0.70 -0.25 -0.83 -0.31 0.00 0.00 175.10 173.03 2i3t s GLY 75 N -3.08 1.21 0.29 2.32 0.00 -0.71 -1.37 107.32 105.98 2i3t s GLY 75 Ca 0.17 -1.06 0.07 0.00 0.00 0.00 0.00 44.72 43.91 2i3t s GLY 75 CO -0.01 -0.87 0.21 -0.51 0.00 0.00 0.00 173.10 171.92 2i3t s THR 76 N -0.55 3.98 0.38 0.90 -4.23 -0.44 0.48 115.64 116.15 2i3t s THR 76 Ca 0.09 -1.45 0.27 0.00 -1.18 0.00 0.00 61.69 59.41 2i3t s THR 76 Cb -0.10 -3.26 0.28 0.00 1.34 0.00 0.00 72.50 70.76 2i3t s THR 76 CO -0.01 -0.29 2.03 0.58 -0.54 0.00 0.00 174.62 176.40 2i3t h VAL 77 N 1.45 0.58 0.00 2.29 2.07 -1.69 -1.54 116.25 119.41 2i3t h VAL 77 Ca -0.47 -0.62 0.00 0.00 0.82 0.00 0.00 66.70 66.43 2i3t h VAL 77 Cb 1.25 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 32.42 2i3t h VAL 77 CO 0.60 0.14 0.00 0.00 0.02 0.00 0.00 177.57 178.33 2i3t n GLN 78 N -3.62 0.08 -0.08 1.57 1.13 -1.26 -1.93 117.38 113.27 2i3t n GLN 78 Ca -0.02 0.07 0.00 0.00 -1.94 0.00 0.00 57.00 55.11 2i3t n GLN 78 Cb 0.27 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.12 2i3t n GLN 78 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2i3t n GLY 79 N 1.01 0.95 3.93 1.08 0.00 -0.62 -4.65 105.19 106.89 2i3t n GLY 79 Ca 0.07 -0.06 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 2i3t n GLY 79 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2i3t s GLU 80 N -0.39 3.44 -0.26 1.61 2.02 -1.26 -4.69 118.70 119.18 2i3t s GLU 80 Ca 0.00 -0.52 0.02 0.00 0.02 0.00 0.00 54.97 54.49 2i3t s GLU 80 Cb 0.00 -3.00 0.05 0.00 0.10 0.00 0.00 34.13 31.28 2i3t s GLU 80 CO 0.00 0.56 -0.10 0.42 0.02 0.00 0.00 175.26 176.17 2i3t s ILE 81 N -1.63 2.37 -0.06 -1.63 1.01 -1.26 -1.33 121.20 118.66 2i3t s ILE 81 Ca 0.35 -1.47 -0.03 0.00 0.00 0.00 0.00 60.65 59.51 2i3t s ILE 81 Cb -0.12 -2.33 -0.04 0.00 0.01 0.00 0.00 42.46 39.98 2i3t s ILE 81 CO 0.28 0.04 0.07 -0.76 0.00 0.00 0.00 174.94 174.56 2i3t s LEU 82 N 1.17 3.90 -0.06 2.97 1.43 -0.47 -0.98 118.68 126.64 2i3t s LEU 82 Ca -0.06 0.23 -0.21 0.00 -1.03 0.00 0.00 54.13 53.06 2i3t s LEU 82 Cb -0.19 -2.05 -0.04 0.00 0.03 0.00 0.00 46.19 43.93 2i3t s LEU 82 CO -0.05 0.35 0.59 -0.75 0.23 0.00 0.00 176.35 176.72 2i3t s LYS 83 N -1.24 4.36 -0.16 1.70 2.20 0.48 -1.84 119.74 125.25 2i3t s LYS 83 Ca 0.17 0.69 -0.08 0.00 -0.36 0.00 0.00 55.97 56.40 2i3t s LYS 83 Cb -0.12 -3.40 -0.04 0.00 -1.51 0.00 0.00 37.83 32.76 2i3t s LYS 83 CO 0.07 0.22 0.10 0.08 -0.36 0.00 0.00 175.35 175.46 2i3t s VAL 84 N 0.33 5.17 -0.27 4.02 1.01 0.58 -2.03 120.40 129.21 2i3t s VAL 84 Ca 0.31 0.09 -0.00 0.00 0.00 0.00 0.00 61.98 62.38 2i3t s VAL 84 Cb -0.17 -3.30 0.05 0.00 0.00 0.00 0.00 36.38 32.95 2i3t s VAL 84 CO 0.15 0.52 -0.05 -0.62 0.00 0.00 0.00 175.10 175.10 2i3t s ASP 85 N -0.19 4.57 0.22 3.32 -1.08 0.08 -4.28 116.67 119.32 2i3t s ASP 85 Ca 0.09 -1.19 0.07 0.00 -0.52 0.00 0.00 52.55 51.01 2i3t s ASP 85 Cb -0.12 -1.65 0.16 0.00 -1.46 0.00 0.00 42.92 39.85 2i3t s ASP 85 CO 0.01 -0.20 1.49 -0.07 0.52 0.00 0.00 175.17 176.92 2i3t h LEU 86 N 7.94 0.10 0.00 -1.34 3.38 -1.92 -3.41 115.31 120.06 2i3t h LEU 86 Ca -0.24 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.64 2i3t h LEU 86 Cb 1.07 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.79 2i3t h LEU 86 CO 0.53 0.80 -1.00 2.30 0.09 0.00 0.00 178.44 181.16 2i3t n ILE 87 N -3.70 1.49 -0.93 1.22 -5.35 -1.26 -5.05 119.36 105.78 2i3t n ILE 87 Ca -0.02 0.13 0.00 0.00 -0.27 0.00 0.00 62.75 62.59 2i3t n ILE 87 Cb 0.71 -2.34 0.00 0.00 -1.74 0.00 0.00 39.64 36.28 2i3t n ILE 87 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2i3t n GLY 88 N 1.47 -1.16 3.18 3.28 0.00 -1.26 -5.07 105.19 105.62 2i3t n GLY 88 Ca -0.15 -1.66 -0.22 0.00 0.00 0.00 0.00 46.02 44.00 2i3t n GLY 88 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2i3t s SER 89 N -1.02 1.91 0.89 1.61 0.15 -1.26 -4.21 113.70 111.77 2i3t s SER 89 Ca 0.00 -0.49 -0.11 0.00 0.70 0.00 0.00 55.95 56.05 2i3t s SER 89 Cb 0.00 -0.13 0.13 0.00 -1.71 0.00 0.00 66.02 64.30 2i3t s SER 89 CO 0.00 0.07 1.09 -2.84 1.20 0.00 0.00 173.24 172.76 2i3t s PRO 90 N -1.19 1.28 0.07 5.44 0.02 -1.26 -5.09 135.00 134.27 2i3t s PRO 90 Ca 0.03 0.96 -0.06 0.00 0.02 0.00 0.00 61.00 61.95 2i3t s PRO 90 Cb -0.08 -1.80 -0.29 0.00 0.02 0.00 0.00 34.50 32.35 2i3t s PRO 90 CO 0.02 -2.27 1.13 0.77 -0.33 0.00 0.00 177.00 176.32 2i3t h SER 91 N -1.57 0.49 -4.13 2.53 0.02 -1.80 -3.40 113.55 105.68 2i3t h SER 91 Ca -0.48 -0.52 -0.63 0.00 -0.84 0.00 0.00 61.79 59.32 2i3t h SER 91 Cb 1.28 -0.16 -0.23 0.00 0.14 0.00 0.00 62.40 63.42 2i3t h SER 91 CO 0.52 1.40 -0.85 -0.36 -1.14 0.00 0.00 176.83 176.40 2i3t s PHE 92 N -2.67 2.05 -0.19 3.45 0.40 -1.26 -0.74 117.98 119.01 2i3t s PHE 92 Ca -0.05 -0.40 -0.04 0.00 -0.60 0.00 0.00 56.93 55.84 2i3t s PHE 92 Cb 0.07 -1.15 0.10 0.00 0.51 0.00 0.00 43.02 42.54 2i3t s PHE 92 CO 0.89 0.21 0.31 -1.14 0.70 0.00 0.00 175.22 176.20 2i3t s GLN 93 N -1.70 0.25 0.19 0.44 0.74 -0.86 -4.92 119.66 113.80 2i3t s GLN 93 Ca 0.10 0.59 -0.31 0.00 0.05 0.00 0.00 55.36 55.79 2i3t s GLN 93 Cb -0.10 -0.41 -0.10 0.00 1.10 0.00 0.00 33.01 33.50 2i3t s GLN 93 CO 0.04 -0.49 1.49 0.00 -0.55 0.00 0.00 175.29 175.79 2i3t s ALA 94 N 2.47 3.70 0.54 1.58 0.00 -1.26 -0.38 121.76 128.39 2i3t s ALA 94 Ca 0.06 1.32 -0.17 0.00 0.00 0.00 0.00 51.96 53.17 2i3t s ALA 94 Cb -0.14 -3.59 -0.06 0.00 0.00 0.00 0.00 23.12 19.33 2i3t s ALA 94 CO -0.12 -0.74 1.02 -0.51 0.00 0.00 0.00 175.76 175.41 2i3t s LEU 95 N 0.57 3.63 0.62 0.00 1.43 -0.15 -4.91 118.68 119.87 2i3t s LEU 95 Ca 0.65 1.74 0.02 0.00 -1.03 0.00 0.00 54.13 55.50 2i3t s LEU 95 Cb -0.42 -4.53 0.08 0.00 0.03 0.00 0.00 46.19 41.35 2i3t s LEU 95 CO 0.35 -0.84 0.87 0.42 0.23 0.00 0.00 176.35 177.38 2i3t s THR 96 N -2.42 2.38 -1.29 5.49 -4.23 0.17 -4.44 115.64 111.30 2i3t s THR 96 Ca 0.62 -0.68 0.00 0.00 -1.18 0.00 0.00 61.69 60.45 2i3t s THR 96 Cb -0.13 -2.70 0.00 0.00 1.34 0.00 0.00 72.50 71.01 2i3t s THR 96 CO 0.31 0.00 0.00 0.59 -0.54 0.00 0.00 174.62 174.98 2i3t n ASN 97 N -2.53 -4.84 -4.59 3.99 3.02 -1.26 -0.66 115.26 108.39 2i3t n ASN 97 Ca 0.12 0.30 -0.43 0.00 -0.03 0.00 0.00 54.58 54.54 2i3t n ASN 97 Cb 0.60 -3.41 -0.03 0.00 -0.61 0.00 0.00 39.78 36.33 2i3t n ASN 97 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2i3t s ASN 98 N -2.70 6.62 0.00 6.41 2.47 -1.26 -4.61 114.94 121.87 2i3t s ASN 98 Ca 0.00 0.43 0.26 0.00 0.42 0.00 0.00 52.86 53.97 2i3t s ASN 98 Cb 0.00 -2.48 0.68 0.00 -1.45 0.00 0.00 41.25 37.99 2i3t s ASN 98 CO 0.00 -1.01 1.52 -0.62 -3.72 0.00 0.00 177.10 173.27 2i3t n GLU 99 N 7.15 0.28 -1.87 0.43 1.02 -1.26 -4.94 120.64 121.46 2i3t n GLU 99 Ca 0.08 -0.15 -0.41 0.00 -0.02 0.00 0.00 57.16 56.66 2i3t n GLU 99 Cb 0.48 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.40 2i3t n GLU 99 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2i3t s ALA 100 N -2.83 3.59 -0.11 0.62 0.00 -1.26 -4.93 121.76 116.84 2i3t s ALA 100 Ca 0.16 1.51 0.06 0.00 0.00 0.00 0.00 51.96 53.69 2i3t s ALA 100 Cb 0.18 -3.59 -0.11 0.00 0.00 0.00 0.00 23.12 19.60 2i3t s ALA 100 CO 0.62 -0.96 -0.02 0.09 0.00 0.00 0.00 175.76 175.49 2i3t n ASN 101 N 0.85 2.67 -4.97 0.00 3.02 -1.26 -4.86 115.26 110.71 2i3t n ASN 101 Ca 0.02 -0.03 -0.19 0.00 -0.03 0.00 0.00 54.58 54.36 2i3t n ASN 101 Cb 0.39 0.39 -0.00 0.00 -0.61 0.00 0.00 39.78 39.95 2i3t n ASN 101 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2i3t s LEU 102 N -5.14 3.75 0.51 3.41 1.43 -1.26 -4.59 118.68 116.78 2i3t s LEU 102 Ca -0.10 -0.37 -0.19 0.00 -1.03 0.00 0.00 54.13 52.44 2i3t s LEU 102 Cb 0.04 -2.59 -0.11 0.00 0.03 0.00 0.00 46.19 43.56 2i3t s LEU 102 CO 0.37 -0.58 0.40 0.61 0.23 0.00 0.00 176.35 177.38 2i3t n GLY 103 N -1.69 -1.85 3.47 -3.19 0.00 -0.81 -4.07 105.19 97.05 2i3t n GLY 103 Ca 0.03 -0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.52 2i3t n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2i3t s ILE 104 N -1.70 4.40 -0.32 -0.61 -1.09 -0.94 -0.87 121.20 120.08 2i3t s ILE 104 Ca 0.65 -0.22 0.20 0.00 -2.23 0.00 0.00 60.65 59.05 2i3t s ILE 104 Cb -0.51 -4.61 0.20 0.00 -1.58 0.00 0.00 42.46 35.97 2i3t s ILE 104 CO 0.58 -1.30 1.49 0.00 -1.23 0.00 0.00 174.94 174.48 2i3t s ARG 106 N -3.12 0.73 -0.19 0.00 6.06 -1.16 -4.70 118.95 116.57 2i3t s ARG 106 Ca 0.05 0.65 -0.00 0.00 -2.50 0.00 0.00 55.73 53.93 2i3t s ARG 106 Cb 0.06 0.35 0.05 0.00 0.06 0.00 0.00 34.95 35.48 2i3t s ARG 106 CO 0.71 -0.12 -0.04 0.42 -2.50 0.00 0.00 175.30 173.77 2i3t s ILE 107 N -0.04 1.16 0.30 4.11 1.01 -1.26 -0.57 121.20 125.92 2i3t s ILE 107 Ca -0.03 -0.82 0.08 0.00 0.00 0.00 0.00 60.65 59.89 2i3t s ILE 107 Cb -0.04 -1.42 -0.04 0.00 0.01 0.00 0.00 42.46 40.98 2i3t s ILE 107 CO 0.02 0.00 0.17 0.00 0.00 0.00 0.00 174.94 175.13 2i3t s LYS 109 N -3.85 4.37 -0.59 0.00 2.47 -1.26 -0.64 119.74 120.24 2i3t s LYS 109 Ca 0.36 2.07 0.05 0.00 -1.56 0.00 0.00 55.97 56.89 2i3t s LYS 109 Cb -0.06 -3.21 0.19 0.00 -1.46 0.00 0.00 37.83 33.29 2i3t s LYS 109 CO 0.24 -0.31 0.49 0.98 0.16 0.00 0.00 175.35 176.91 2i3t n TYR 110 N 2.97 1.78 -3.10 4.03 -0.00 -0.67 -4.72 117.16 117.45 2i3t n TYR 110 Ca 0.08 -3.94 0.00 0.00 -0.00 0.00 0.00 57.90 54.04 2i3t n TYR 110 Cb 0.43 -0.33 0.00 0.00 -0.00 0.00 0.00 39.34 39.44 2i3t n TYR 110 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 2i3t n GLY 111 N 2.03 -0.69 0.23 2.98 0.00 -1.26 -3.06 105.19 105.41 2i3t n GLY 111 Ca 0.24 -1.33 0.02 0.00 0.00 0.00 0.00 46.02 44.96 2i3t n GLY 111 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2i3t n ASP 112 N 0.55 1.77 0.00 1.61 5.68 -1.26 -4.57 116.55 120.34 2i3t n ASP 112 Ca 0.00 -1.50 0.00 0.00 -0.50 0.00 0.00 54.79 52.79 2i3t n ASP 112 Cb 0.00 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 39.94 2i3t n ASP 112 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 2i3t n ASP 113 N 0.15 0.79 -4.15 -1.12 5.75 -1.26 -4.44 116.55 112.27 2i3t n ASP 113 Ca 0.04 -0.97 -0.16 0.00 -0.01 0.00 0.00 54.79 53.69 2i3t n ASP 113 Cb 0.20 0.04 -0.10 0.00 -1.03 0.00 0.00 41.12 40.23 2i3t n ASP 113 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2i3t s LYS 114 N -0.04 1.42 0.05 0.11 1.02 -1.17 -4.52 119.74 116.61 2i3t s LYS 114 Ca 0.00 -1.78 -0.02 0.00 0.02 0.00 0.00 55.97 54.19 2i3t s LYS 114 Cb 0.00 -0.04 -0.03 0.00 -0.52 0.00 0.00 37.83 37.24 2i3t s LYS 114 CO 0.00 -0.38 0.00 -0.51 -0.92 0.00 0.00 175.35 173.54 2i3t s LEU 115 N -3.29 2.31 -0.03 3.17 1.43 -0.69 -1.67 118.68 119.91 2i3t s LEU 115 Ca 0.38 -0.90 -0.00 0.00 -1.03 0.00 0.00 54.13 52.57 2i3t s LEU 115 Cb 0.07 0.31 0.03 0.00 0.03 0.00 0.00 46.19 46.63 2i3t s LEU 115 CO 0.15 -0.59 0.03 -0.51 0.23 0.00 0.00 176.35 175.66 2i3t s ILE 116 N -3.69 -0.01 0.12 -0.59 2.07 0.19 0.46 121.20 119.75 2i3t s ILE 116 Ca 0.05 0.23 0.06 0.00 -1.41 0.00 0.00 60.65 59.58 2i3t s ILE 116 Cb 0.06 -0.15 -0.04 0.00 0.13 0.00 0.00 42.46 42.46 2i3t s ILE 116 CO -0.09 0.13 0.00 0.00 -1.91 0.00 0.00 174.94 173.07 2i3t s ALA 117 N 1.34 3.27 0.04 1.50 0.00 0.16 0.07 121.76 128.14 2i3t s ALA 117 Ca -0.06 -1.21 0.06 0.00 0.00 0.00 0.00 51.96 50.75 2i3t s ALA 117 Cb -0.13 -1.13 -0.02 0.00 0.00 0.00 0.00 23.12 21.84 2i3t s ALA 117 CO -0.03 0.62 -0.16 0.00 0.00 0.00 0.00 175.76 176.19 2i3t s ALA 118 N -1.46 1.34 0.23 0.00 0.00 0.27 -0.51 121.76 121.64 2i3t s ALA 118 Ca 0.26 -0.90 0.11 0.00 0.00 0.00 0.00 51.96 51.43 2i3t s ALA 118 Cb -0.11 -0.22 -0.05 0.00 0.00 0.00 0.00 23.12 22.74 2i3t s ALA 118 CO 0.18 0.27 -0.19 -1.54 0.00 0.00 0.00 175.76 174.49 2i3t s SER 119 N -1.19 3.69 0.53 0.00 1.04 -0.57 -1.35 113.70 115.85 2i3t s SER 119 Ca 0.03 -0.88 0.19 0.00 0.48 0.00 0.00 55.95 55.77 2i3t s SER 119 Cb -0.08 -0.38 1.32 0.00 0.10 0.00 0.00 66.02 66.98 2i3t s SER 119 CO 0.01 0.08 2.11 -0.50 0.98 0.00 0.00 173.24 175.92 2i3t h TRP 120 N 2.67 0.00 -0.10 5.02 6.55 -1.14 -1.37 115.95 127.58 2i3t h TRP 120 Ca -0.44 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.40 2i3t h TRP 120 Cb 1.23 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.53 2i3t h TRP 120 CO 0.73 0.00 0.00 -0.40 -1.05 0.00 0.00 178.44 177.72 2i3t n ASP 121 N -4.47 1.36 0.00 -3.49 3.85 -1.26 -2.65 116.55 109.89 2i3t n ASP 121 Ca 0.00 -2.10 0.00 0.00 -0.71 0.00 0.00 54.79 51.99 2i3t n ASP 121 Cb 0.22 -0.37 0.00 0.00 -1.35 0.00 0.00 41.12 39.62 2i3t n ASP 121 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2i3t n GLY 122 N 0.30 0.72 3.79 6.12 0.00 -0.51 -4.75 105.19 110.86 2i3t n GLY 122 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 2i3t n GLY 122 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2i3t s LEU 123 N 0.00 4.47 -0.24 0.99 1.43 -1.25 -1.21 118.68 122.87 2i3t s LEU 123 Ca 0.00 1.16 0.02 0.00 -1.03 0.00 0.00 54.13 54.28 2i3t s LEU 123 Cb 0.00 -2.85 0.05 0.00 0.03 0.00 0.00 46.19 43.42 2i3t s LEU 123 CO 0.00 0.20 -0.12 -0.63 0.23 0.00 0.00 176.35 176.03 2i3t s ILE 124 N -0.67 2.07 0.02 -0.59 1.01 -0.41 -1.51 121.20 121.12 2i3t s ILE 124 Ca 0.29 -1.46 0.07 0.00 0.00 0.00 0.00 60.65 59.56 2i3t s ILE 124 Cb -0.18 -2.14 -0.03 0.00 0.01 0.00 0.00 42.46 40.12 2i3t s ILE 124 CO 0.17 0.07 -0.21 -1.61 0.00 0.00 0.00 174.94 173.36 2i3t s GLU 125 N 1.17 2.05 -0.08 2.79 2.02 0.34 -1.62 118.70 125.36 2i3t s GLU 125 Ca -0.06 -0.98 -0.07 0.00 0.02 0.00 0.00 54.97 53.88 2i3t s GLU 125 Cb -0.19 -2.13 -0.04 0.00 0.10 0.00 0.00 34.13 31.87 2i3t s GLU 125 CO -0.07 0.55 0.18 0.08 0.02 0.00 0.00 175.26 176.02 2i3t s VAL 126 N -0.82 5.44 -0.36 2.63 1.01 -0.64 0.38 120.40 128.04 2i3t s VAL 126 Ca 0.13 0.20 -0.03 0.00 0.00 0.00 0.00 61.98 62.28 2i3t s VAL 126 Cb -0.10 -3.46 0.08 0.00 0.00 0.00 0.00 36.38 32.90 2i3t s VAL 126 CO 0.03 0.55 0.12 -0.63 0.00 0.00 0.00 175.10 175.17 2i3t s ILE 127 N -1.10 3.26 -0.40 2.22 1.01 0.17 -1.83 121.20 124.54 2i3t s ILE 127 Ca 0.19 -1.69 0.04 0.00 0.00 0.00 0.00 60.65 59.18 2i3t s ILE 127 Cb -0.13 -3.06 0.11 0.00 0.01 0.00 0.00 42.46 39.40 2i3t s ILE 127 CO 0.08 -0.42 0.13 -0.62 0.00 0.00 0.00 174.94 174.11 2i3t s ASP 128 N 1.57 4.52 0.03 3.58 -1.08 -1.26 -1.71 116.67 122.32 2i3t s ASP 128 Ca 0.02 -2.40 -0.25 0.00 -0.52 0.00 0.00 52.55 49.40 2i3t s ASP 128 Cb -0.21 -1.55 -0.18 0.00 -1.46 0.00 0.00 42.92 39.52 2i3t s ASP 128 CO -0.02 -0.33 1.45 -0.65 0.52 0.00 0.00 175.17 176.14 2i3t h PRO 129 N 7.27 -0.11 -0.21 4.34 0.11 -1.79 -0.95 132.00 140.65 2i3t h PRO 129 Ca -0.06 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.06 2i3t h PRO 129 Cb 0.98 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2i3t h PRO 129 CO 0.57 0.16 0.00 2.89 -0.21 0.00 0.00 178.00 181.41 2i3t n ARG 130 N -5.02 0.48 0.00 1.05 1.85 -1.26 -0.03 116.66 113.73 2i3t n ARG 130 Ca -0.08 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.77 2i3t n ARG 130 Cb 0.18 -1.11 0.00 0.00 -1.05 0.00 0.00 32.46 30.48 2i3t n ARG 130 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2i3t n ASN 131 N -0.16 0.00 0.00 2.89 3.02 -1.20 -4.93 115.26 114.88 2i3t n ASN 131 Ca 0.00 -1.00 0.00 0.00 -0.03 0.00 0.00 54.58 53.55 2i3t n ASN 131 Cb 0.05 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.22 2i3t n ASN 131 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2i3t n TYR 132 N 0.00 0.00 0.00 3.10 4.01 -0.37 -5.05 117.16 118.84 2i3t n TYR 132 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2i3t n TYR 132 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.30 2i3t n TYR 132 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2i3t n GLY 133 N 0.00 3.87 2.36 2.72 0.00 0.95 -2.63 105.19 112.46 2i3t n GLY 133 Ca 0.00 0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 2i3t n GLY 133 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2i3t n ASP 134 N 9.14 7.16 -3.78 1.61 10.43 -1.26 -4.31 116.55 135.54 2i3t n ASP 134 Ca 0.00 -3.79 -0.27 0.00 2.57 0.00 0.00 54.79 53.30 2i3t n ASP 134 Cb 0.00 -0.87 -0.17 0.00 1.84 0.00 0.00 41.12 41.92 2i3t n ASP 134 CO 0.00 0.00 0.00 -0.83 -1.07 0.00 0.00 177.20 175.30 2i3t s GLY 135 N -2.07 0.76 0.61 0.44 0.00 -1.08 0.46 107.32 106.44 2i3t s GLY 135 Ca 0.61 -0.69 -0.16 0.00 0.00 0.00 0.00 44.72 44.48 2i3t s GLY 135 CO -0.06 1.27 1.08 -1.34 0.00 0.00 0.00 173.10 174.05 2i3t s VAL 136 N 1.80 3.56 -0.22 1.40 -7.23 0.16 -4.73 120.40 115.14 2i3t s VAL 136 Ca -0.00 0.76 0.01 0.00 -1.81 0.00 0.00 61.98 60.94 2i3t s VAL 136 Cb -0.16 -3.28 0.05 0.00 0.56 0.00 0.00 36.38 33.55 2i3t s VAL 136 CO -0.07 -0.41 -0.08 -0.51 -0.31 0.00 0.00 175.10 173.71 2i3t s ILE 137 N -2.34 1.66 1.05 -0.62 1.10 -0.76 -4.56 121.20 116.73 2i3t s ILE 137 Ca 0.66 -1.16 -0.16 0.00 -0.51 0.00 0.00 60.65 59.48 2i3t s ILE 137 Cb -0.18 -1.81 0.08 0.00 0.15 0.00 0.00 42.46 40.70 2i3t s ILE 137 CO 0.37 0.05 0.18 0.00 -2.11 0.00 0.00 174.94 173.42 2i3t n ALA 138 N 4.65 -3.51 0.00 1.50 0.00 -1.26 -1.62 120.51 120.27 2i3t n ALA 138 Ca -0.14 -1.01 0.00 0.00 0.00 0.00 0.00 53.44 52.30 2i3t n ALA 138 Cb 0.45 -1.64 0.00 0.00 0.00 0.00 0.00 19.45 18.26 2i3t n ALA 138 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2i3t n VAL 139 N -4.08 0.00 -4.11 0.00 0.31 -0.64 -4.73 118.33 105.08 2i3t n VAL 139 Ca 0.03 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.22 2i3t n VAL 139 Cb 0.59 -0.13 -0.12 0.00 -0.91 0.00 0.00 33.84 33.27 2i3t n VAL 139 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2i3t s LYS 140 N -1.52 0.57 -0.30 5.55 -0.14 -1.10 -5.03 119.74 117.76 2i3t s LYS 140 Ca 0.00 -0.68 -0.03 0.00 -1.36 0.00 0.00 55.97 53.90 2i3t s LYS 140 Cb 0.00 -0.41 0.11 0.00 -1.68 0.00 0.00 37.83 35.85 2i3t s LYS 140 CO 0.00 0.09 0.14 1.21 -0.76 0.00 0.00 175.35 176.03 2i3t s ASN 141 N -1.31 3.45 0.00 2.83 3.84 -1.26 -1.29 114.94 121.19 2i3t s ASN 141 Ca -0.06 -1.48 0.00 0.00 0.21 0.00 0.00 52.86 51.53 2i3t s ASN 141 Cb -0.08 -0.38 0.03 0.00 -0.55 0.00 0.00 41.25 40.26 2i3t s ASN 141 CO 0.01 -0.41 0.47 0.18 -2.79 0.00 0.00 177.10 174.56 2i3t n LEU 142 N 4.99 0.00 -2.39 3.21 4.77 -0.35 -1.80 117.00 125.43 2i3t n LEU 142 Ca -0.02 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.80 2i3t n LEU 142 Cb 0.41 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.53 2i3t n LEU 142 CO 0.06 0.00 0.10 0.59 -1.33 0.00 0.00 177.39 176.81 2i3t n ASN 143 N -0.95 3.55 -0.68 -1.43 3.02 -1.26 -4.67 115.26 112.83 2i3t n ASN 143 Ca 0.00 -3.12 0.05 0.00 -0.03 0.00 0.00 54.58 51.49 2i3t n ASN 143 Cb 0.00 -0.42 0.16 0.00 -0.61 0.00 0.00 39.78 38.91 2i3t n ASN 143 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2i3t n SER 144 N -0.59 1.97 -2.28 6.41 3.41 -0.74 -3.84 113.62 117.95 2i3t n SER 144 Ca 0.29 -2.04 -0.07 0.00 -0.26 0.00 0.00 58.87 56.79 2i3t n SER 144 Cb 0.86 -0.26 0.05 0.00 -0.26 0.00 0.00 64.21 64.60 2i3t n SER 144 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2i3t n ASN 145 N 0.50 2.63 0.00 4.04 3.02 -1.26 -5.09 115.26 119.09 2i3t n ASN 145 Ca 0.12 -2.71 0.00 0.00 -0.03 0.00 0.00 54.58 51.95 2i3t n ASN 145 Cb 0.33 -0.42 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 2i3t n ASN 145 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2i3t n ASN 146 N -0.56 0.00 -0.03 6.41 6.94 -1.25 -5.05 115.26 121.72 2i3t n ASN 146 Ca 0.20 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.76 2i3t n ASN 146 Cb 0.88 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.31 2i3t n ASN 146 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 2i3t n THR 147 N 0.11 0.00 -4.30 5.53 -2.24 -1.26 -5.02 114.28 107.10 2i3t n THR 147 Ca 0.00 -0.50 -0.29 0.00 -2.27 0.00 0.00 64.05 60.99 2i3t n THR 147 Cb 0.00 1.01 -0.04 0.00 -2.10 0.00 0.00 70.33 69.20 2i3t n THR 147 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2i3t s LYS 148 N -0.08 2.22 0.20 -0.78 2.36 -1.26 -5.03 119.74 117.36 2i3t s LYS 148 Ca 0.01 -2.17 -0.11 0.00 -2.55 0.00 0.00 55.97 51.14 2i3t s LYS 148 Cb 0.01 -1.83 0.13 0.00 -1.05 0.00 0.00 37.83 35.08 2i3t s LYS 148 CO 0.01 -0.45 1.84 -0.39 1.55 0.00 0.00 175.35 177.90 2i3t h VAL 149 N 1.08 1.20 0.00 4.02 -1.51 -1.96 -3.44 116.25 115.64 2i3t h VAL 149 Ca -0.41 -0.44 0.00 0.00 -1.23 0.00 0.00 66.70 64.62 2i3t h VAL 149 Cb 1.30 0.25 0.00 0.00 -2.13 0.00 0.00 31.29 30.71 2i3t h VAL 149 CO 0.66 0.21 0.00 0.29 -1.23 0.00 0.00 177.57 177.50 2i3t n LYS 150 N -4.55 0.00 -3.32 5.19 4.76 -1.26 -4.44 118.16 114.55 2i3t n LYS 150 Ca 0.06 0.00 -0.38 0.00 -2.87 0.00 0.00 58.31 55.12 2i3t n LYS 150 Cb 0.06 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 33.19 2i3t n LYS 150 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 2i3t s ASN 151 N -4.00 6.71 0.36 4.39 0.02 -1.26 -4.97 114.94 116.19 2i3t s ASN 151 Ca 0.00 0.84 0.09 0.00 -1.02 0.00 0.00 52.86 52.77 2i3t s ASN 151 Cb 0.00 -2.29 -0.06 0.00 0.02 0.00 0.00 41.25 38.92 2i3t s ASN 151 CO 0.00 0.02 -0.02 -0.54 0.02 0.00 0.00 177.10 176.59 2i3t s LYS 152 N 0.50 1.97 -0.18 -0.60 1.02 -1.26 -4.15 119.74 117.04 2i3t s LYS 152 Ca 0.26 -1.90 0.01 0.00 0.02 0.00 0.00 55.97 54.36 2i3t s LYS 152 Cb -0.15 -1.79 0.03 0.00 -0.52 0.00 0.00 37.83 35.39 2i3t s LYS 152 CO 0.11 0.08 -0.16 0.42 -0.92 0.00 0.00 175.35 174.88 2i3t s ILE 153 N -2.60 1.85 -0.20 2.17 1.01 -1.08 -3.37 121.20 118.98 2i3t s ILE 153 Ca 0.34 -0.88 0.16 0.00 0.00 0.00 0.00 60.65 60.27 2i3t s ILE 153 Cb 0.03 -1.73 -0.23 0.00 0.01 0.00 0.00 42.46 40.53 2i3t s ILE 153 CO 0.18 0.43 0.05 0.49 0.00 0.00 0.00 174.94 176.09 2i3t n PHE 154 N 4.67 0.00 -3.92 3.97 0.99 0.30 -4.04 117.46 119.43 2i3t n PHE 154 Ca -0.18 0.00 -0.09 0.00 -0.00 0.00 0.00 57.45 57.17 2i3t n PHE 154 Cb 0.49 -0.96 -0.05 0.00 -1.00 0.00 0.00 39.48 37.96 2i3t n PHE 154 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.76 176.68 2i3t s THR 155 N -2.47 0.02 0.02 4.37 -1.32 -1.06 -4.94 115.64 110.27 2i3t s THR 155 Ca -0.11 -1.23 -0.28 0.00 -1.21 0.00 0.00 61.69 58.86 2i3t s THR 155 Cb 0.06 -1.97 0.08 0.00 -1.51 0.00 0.00 72.50 69.16 2i3t s THR 155 CO 0.78 -0.09 0.69 -0.32 -2.21 0.00 0.00 174.62 173.47 2i3t s MET 156 N -3.97 1.09 0.06 7.08 1.75 -1.26 -0.36 119.30 123.69 2i3t s MET 156 Ca 0.18 -0.07 -0.15 0.00 -1.25 0.00 0.00 55.69 54.40 2i3t s MET 156 Cb -0.00 0.51 0.02 0.00 2.84 0.00 0.00 34.83 38.20 2i3t s MET 156 CO 0.04 -0.41 0.34 0.34 -0.65 0.00 0.00 175.02 174.68 2i3t s ASP 157 N -1.87 -0.16 0.16 1.11 2.15 -0.61 -4.90 116.67 112.53 2i3t s ASP 157 Ca -0.05 -0.21 -0.05 0.00 0.43 0.00 0.00 52.55 52.68 2i3t s ASP 157 Cb -0.00 0.39 -0.02 0.00 -0.30 0.00 0.00 42.92 42.99 2i3t s ASP 157 CO -0.01 -0.68 0.19 0.42 -0.17 0.00 0.00 175.17 174.92 2i3t s THR 158 N -2.87 0.07 0.34 1.71 -4.23 -1.26 -1.53 115.64 107.87 2i3t s THR 158 Ca -0.03 -1.63 -0.10 0.00 -1.18 0.00 0.00 61.69 58.75 2i3t s THR 158 Cb 0.00 -1.97 0.04 0.00 1.34 0.00 0.00 72.50 71.91 2i3t s THR 158 CO -0.05 -0.34 0.62 -0.46 -0.54 0.00 0.00 174.62 173.86 2i3t n ASN 159 N -0.18 -1.80 -0.33 3.99 0.23 -0.58 -4.94 115.26 111.65 2i3t n ASN 159 Ca -0.06 -2.48 0.26 0.00 -0.53 0.00 0.00 54.58 51.78 2i3t n ASN 159 Cb 0.63 3.07 0.50 0.00 -2.08 0.00 0.00 39.78 41.90 2i3t n ASN 159 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2i3t h SER 160 N 1.74 0.19 0.00 0.53 4.64 -1.96 -3.01 113.55 115.68 2i3t h SER 160 Ca -0.28 0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2i3t h SER 160 Cb 1.08 0.29 0.00 0.00 -0.31 0.00 0.00 62.40 63.45 2i3t h SER 160 CO 0.36 -0.35 0.00 -1.54 -0.87 0.00 0.00 176.83 174.43 2i3t n SER 161 N -5.26 1.33 -3.72 4.97 3.41 -1.26 -4.63 113.62 108.45 2i3t n SER 161 Ca 0.33 -1.61 -0.14 0.00 -0.26 0.00 0.00 58.87 57.19 2i3t n SER 161 Cb 1.10 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.97 2i3t n SER 161 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2i3t s ARG 162 N -0.61 0.74 -0.03 4.33 3.52 -1.14 -1.59 118.95 124.17 2i3t s ARG 162 Ca 0.00 -0.10 0.04 0.00 -0.13 0.00 0.00 55.73 55.54 2i3t s ARG 162 Cb 0.00 0.33 -0.01 0.00 -1.56 0.00 0.00 34.95 33.72 2i3t s ARG 162 CO 0.00 -0.21 -0.15 -1.17 -0.81 0.00 0.00 175.30 172.96 2i3t s LEU 163 N -1.29 1.94 -0.01 -0.88 0.20 -0.68 -1.53 118.68 116.43 2i3t s LEU 163 Ca -0.13 -0.30 0.00 0.00 0.69 0.00 0.00 54.13 54.40 2i3t s LEU 163 Cb -0.04 -0.84 0.01 0.00 -0.43 0.00 0.00 46.19 44.88 2i3t s LEU 163 CO 0.05 0.16 -0.01 -0.51 -0.29 0.00 0.00 176.35 175.75 2i3t s ILE 164 N -0.10 0.13 0.04 6.68 2.07 -0.59 -0.72 121.20 128.71 2i3t s ILE 164 Ca 0.00 -0.02 0.08 0.00 -1.41 0.00 0.00 60.65 59.31 2i3t s ILE 164 Cb -0.09 -0.14 -0.03 0.00 0.13 0.00 0.00 42.46 42.33 2i3t s ILE 164 CO 0.01 0.06 -0.24 0.68 -1.91 0.00 0.00 174.94 173.54 2i3t s VAL 165 N 0.23 2.36 -0.19 4.00 -7.23 0.14 -1.58 120.40 118.14 2i3t s VAL 165 Ca -0.02 -1.31 -0.13 0.00 -1.81 0.00 0.00 61.98 58.71 2i3t s VAL 165 Cb -0.04 -1.94 -0.05 0.00 0.56 0.00 0.00 36.38 34.91 2i3t s VAL 165 CO -0.01 0.36 0.25 -0.83 -0.31 0.00 0.00 175.10 174.57 2i3t s GLY 166 N -1.29 2.12 0.11 2.32 0.00 0.51 -1.79 107.32 109.30 2i3t s GLY 166 Ca 0.13 -0.57 0.00 0.00 0.00 0.00 0.00 44.72 44.27 2i3t s GLY 166 CO 0.03 0.41 0.00 1.03 0.00 0.00 0.00 173.10 174.57 2i3t n MET 167 N 3.77 1.72 -1.67 2.90 2.81 -0.41 -0.54 117.12 125.70 2i3t n MET 167 Ca -0.13 -0.80 -0.30 0.00 -1.81 0.00 0.00 57.70 54.67 2i3t n MET 167 Cb 0.52 0.22 0.08 0.00 -0.71 0.00 0.00 33.22 33.32 2i3t n MET 167 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2i3t s ASN 168 N -1.60 4.78 -0.66 7.83 4.22 -1.22 -3.68 114.94 124.61 2i3t s ASN 168 Ca 0.00 1.22 0.00 0.00 -2.14 0.00 0.00 52.86 51.94 2i3t s ASN 168 Cb 0.00 -1.96 0.00 0.00 1.28 0.00 0.00 41.25 40.57 2i3t s ASN 168 CO 0.00 -1.78 0.00 0.59 -2.04 0.00 0.00 177.10 173.87 2i3t n ASN 169 N -3.30 -4.15 -3.75 3.54 3.02 -1.26 -3.64 115.26 105.72 2i3t n ASN 169 Ca 0.07 0.15 -0.28 0.00 -0.03 0.00 0.00 54.58 54.50 2i3t n ASN 169 Cb 0.57 -2.20 0.04 0.00 -0.61 0.00 0.00 39.78 37.58 2i3t n ASN 169 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2i3t n SER 170 N 0.24 -5.28 -4.24 6.41 2.88 -1.24 -4.95 113.62 107.45 2i3t n SER 170 Ca -0.06 -0.67 -0.16 0.00 -1.33 0.00 0.00 58.87 56.65 2i3t n SER 170 Cb 0.27 -4.20 -0.11 0.00 -0.75 0.00 0.00 64.21 59.42 2i3t n SER 170 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2i3t s GLN 171 N -6.46 1.01 0.31 -1.46 -2.07 -1.24 -2.57 119.66 107.18 2i3t s GLN 171 Ca 0.62 -1.29 0.09 0.00 -1.82 0.00 0.00 55.36 52.95 2i3t s GLN 171 Cb -0.30 -0.77 -0.05 0.00 -1.09 0.00 0.00 33.01 30.80 2i3t s GLN 171 CO 0.76 0.13 0.03 0.14 -1.32 0.00 0.00 175.29 175.04 2i3t s VAL 172 N -2.53 3.06 -0.08 3.63 -7.23 -0.36 -1.29 120.40 115.60 2i3t s VAL 172 Ca 0.11 -1.89 -0.04 0.00 -1.81 0.00 0.00 61.98 58.35 2i3t s VAL 172 Cb -0.02 -2.85 0.04 0.00 0.56 0.00 0.00 36.38 34.11 2i3t s VAL 172 CO 0.02 -0.27 0.18 -1.58 -0.31 0.00 0.00 175.10 173.14 2i3t s GLN 173 N -3.73 0.13 0.10 4.82 0.74 -0.74 -1.32 119.66 119.66 2i3t s GLN 173 Ca 0.34 0.43 0.08 0.00 0.05 0.00 0.00 55.36 56.26 2i3t s GLN 173 Cb -0.03 -0.16 -0.03 0.00 1.10 0.00 0.00 33.01 33.88 2i3t s GLN 173 CO 0.20 -0.17 -0.21 1.67 -0.55 0.00 0.00 175.29 176.24 2i3t s TRP 174 N 1.21 1.78 0.34 1.67 1.48 -1.19 -0.68 118.94 123.55 2i3t s TRP 174 Ca -0.09 -0.42 0.06 0.00 -1.06 0.00 0.00 56.10 54.59 2i3t s TRP 174 Cb -0.11 -0.98 -0.07 0.00 -1.16 0.00 0.00 33.47 31.15 2i3t s TRP 174 CO -0.07 0.20 -0.00 -0.06 -4.06 0.00 0.00 176.95 172.95 2i3t s PHE 175 N -1.14 2.16 0.18 1.66 0.40 0.10 -3.32 117.98 118.02 2i3t s PHE 175 Ca 0.06 -0.76 -0.06 0.00 -0.60 0.00 0.00 56.93 55.58 2i3t s PHE 175 Cb -0.10 -1.39 -0.06 0.00 0.51 0.00 0.00 43.02 41.99 2i3t s PHE 175 CO 0.04 0.27 0.43 1.03 0.70 0.00 0.00 175.22 177.69 2i3t s ARG 176 N -3.77 3.65 -0.06 0.44 0.52 -1.26 -1.68 118.95 116.80 2i3t s ARG 176 Ca 0.34 -0.02 0.04 0.00 -0.52 0.00 0.00 55.73 55.57 2i3t s ARG 176 Cb 0.07 -2.78 0.00 0.00 0.52 0.00 0.00 34.95 32.76 2i3t s ARG 176 CO 0.15 0.40 -0.18 -0.51 0.02 0.00 0.00 175.30 175.19 2i3t s LEU 177 N -2.83 1.90 0.50 2.53 1.43 -0.62 -2.75 118.68 118.84 2i3t s LEU 177 Ca 0.43 -0.39 -0.21 0.00 -1.03 0.00 0.00 54.13 52.92 2i3t s LEU 177 Cb -0.12 -1.06 -0.07 0.00 0.03 0.00 0.00 46.19 44.98 2i3t s LEU 177 CO 0.25 0.14 1.14 -2.16 0.23 0.00 0.00 176.35 175.95 2i3t s PRO 178 N 0.20 3.56 0.61 1.29 0.04 -1.26 -4.38 135.00 135.05 2i3t s PRO 178 Ca -0.09 1.68 -0.18 0.00 0.04 0.00 0.00 61.00 62.46 2i3t s PRO 178 Cb -0.14 -2.20 -0.07 0.00 0.04 0.00 0.00 34.50 32.13 2i3t s PRO 178 CO 0.04 -0.69 0.60 1.28 0.04 0.00 0.00 177.00 178.26 2i3t n LEU 179 N -0.90 1.30 -4.13 -3.56 4.77 -1.11 -5.03 117.00 108.34 2i3t n LEU 179 Ca 0.09 0.72 -0.28 0.00 -0.03 0.00 0.00 56.01 56.51 2i3t n LEU 179 Cb 0.50 -1.22 -0.17 0.00 -2.33 0.00 0.00 43.42 40.20 2i3t n LEU 179 CO 0.45 -2.87 -0.51 0.00 -1.33 0.00 0.00 177.39 173.12 2i3t h GLU 181 N 6.72 0.00 0.00 0.00 3.07 -1.96 -3.40 114.58 119.02 2i3t h GLU 181 Ca -0.26 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.60 2i3t h GLU 181 Cb 1.21 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.12 2i3t h GLU 181 CO 0.47 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.84 2i3t n ASP 182 N -4.10 0.00 0.00 1.42 9.92 -1.26 -4.67 116.55 117.85 2i3t n ASP 182 Ca -0.03 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.23 2i3t n ASP 182 Cb 0.09 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.57 2i3t n ASP 182 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 2i3t n ASP 183 N 0.00 0.00 0.00 -2.24 -0.08 -1.26 -4.84 116.55 108.13 2i3t n ASP 183 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2i3t n ASP 183 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2i3t n ASP 183 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 2i3t n ASN 184 N 0.00 0.00 -4.03 1.67 6.94 -1.26 -4.65 115.26 113.93 2i3t n ASN 184 Ca 0.00 0.00 -0.29 0.00 -0.02 0.00 0.00 54.58 54.27 2i3t n ASN 184 Cb 0.00 0.00 0.24 0.00 -2.36 0.00 0.00 39.78 37.66 2i3t n ASN 184 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 2i3t s GLY 185 N 0.00 1.53 -0.44 4.83 0.00 -1.26 -4.79 107.32 107.19 2i3t s GLY 185 Ca 0.00 -0.65 0.07 0.00 0.00 0.00 0.00 44.72 44.14 2i3t s GLY 185 CO 0.00 0.18 0.68 -1.08 0.00 0.00 0.00 173.10 172.89 2i3t s THR 186 N -2.71 -0.96 0.66 0.90 -1.32 -1.21 -5.00 115.64 106.00 2i3t s THR 186 Ca 0.69 -0.30 -0.14 0.00 -1.21 0.00 0.00 61.69 60.72 2i3t s THR 186 Cb -0.15 0.00 -0.00 0.00 -1.51 0.00 0.00 72.50 70.83 2i3t s THR 186 CO 0.59 0.00 1.09 -0.63 -2.21 0.00 0.00 174.62 173.45 2i3t s ILE 187 N 1.55 3.48 0.02 5.08 1.01 -1.26 -3.14 121.20 127.94 2i3t s ILE 187 Ca 0.20 0.64 -0.28 0.00 0.00 0.00 0.00 60.65 61.22 2i3t s ILE 187 Cb -0.02 -3.18 0.10 0.00 0.01 0.00 0.00 42.46 39.36 2i3t s ILE 187 CO -0.07 -0.47 0.84 -0.70 0.00 0.00 0.00 174.94 174.54 2i3t s GLU 188 N -4.28 0.90 0.05 2.79 2.12 -0.43 -4.99 118.70 114.86 2i3t s GLU 188 Ca 0.64 -0.33 -0.31 0.00 0.36 0.00 0.00 54.97 55.34 2i3t s GLU 188 Cb -0.18 0.41 -0.06 0.00 0.26 0.00 0.00 34.13 34.56 2i3t s GLU 188 CO 0.43 -0.39 1.25 -1.21 -0.54 0.00 0.00 175.26 174.80 2i3t s GLU 189 N -3.22 4.39 0.51 4.30 0.41 -1.26 -1.22 118.70 122.60 2i3t s GLU 189 Ca 0.04 1.83 0.29 0.00 -0.41 0.00 0.00 54.97 56.72 2i3t s GLU 189 Cb -0.01 -3.37 1.32 0.00 -1.78 0.00 0.00 34.13 30.29 2i3t s GLU 189 CO -0.10 -0.34 1.99 0.66 -0.49 0.00 0.00 175.26 176.99 2i3t h SER 190 N 6.96 0.00 0.00 -0.19 4.64 -1.82 -3.45 113.55 119.69 2i3t h SER 190 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 2i3t h SER 190 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2i3t h SER 190 CO 0.84 0.12 0.00 0.61 -0.87 0.00 0.00 176.83 177.53 2i3t n GLY 191 N -0.26 0.87 3.94 -0.77 0.00 -1.26 -4.82 105.19 102.89 2i3t n GLY 191 Ca -0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 2i3t n GLY 191 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2i3t s LEU 192 N 0.00 3.64 -0.17 0.99 1.43 -1.26 -4.89 118.68 118.41 2i3t s LEU 192 Ca 0.00 0.42 -0.21 0.00 -1.03 0.00 0.00 54.13 53.31 2i3t s LEU 192 Cb 0.00 -3.30 -0.23 0.00 0.03 0.00 0.00 46.19 42.70 2i3t s LEU 192 CO 0.00 -0.69 0.40 0.50 0.23 0.00 0.00 176.35 176.80 2i3t h LYS 193 N 0.35 0.07 0.00 1.70 3.11 -1.96 -3.50 116.57 116.34 2i3t h LYS 193 Ca -0.47 -0.12 0.00 0.00 -2.81 0.00 0.00 60.65 57.26 2i3t h LYS 193 Cb 1.24 0.04 0.00 0.00 -1.00 0.00 0.00 32.23 32.52 2i3t h LYS 193 CO 0.59 1.06 0.00 0.66 -2.81 0.00 0.00 179.45 178.94 2i3t n TYR 194 N -4.30 0.00 -1.65 1.91 4.02 -1.26 -5.00 117.16 110.89 2i3t n TYR 194 Ca -0.26 0.00 -0.45 0.00 -0.01 0.00 0.00 57.90 57.18 2i3t n TYR 194 Cb 0.71 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 40.01 2i3t n TYR 194 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 176.86 176.79 2i3t n GLN 195 N 0.00 1.78 -2.86 -0.72 7.27 -1.26 -4.54 117.38 117.05 2i3t n GLN 195 Ca 0.00 0.63 -0.40 0.00 0.07 0.00 0.00 57.00 57.30 2i3t n GLN 195 Cb 0.00 -2.20 -0.06 0.00 2.41 0.00 0.00 30.24 30.39 2i3t n GLN 195 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 2i3t s ILE 196 N -0.41 4.23 -0.09 1.69 1.01 -1.26 -1.79 121.20 124.58 2i3t s ILE 196 Ca 0.66 1.91 0.05 0.00 0.00 0.00 0.00 60.65 63.26 2i3t s ILE 196 Cb -0.68 -4.24 -0.09 0.00 0.01 0.00 0.00 42.46 37.46 2i3t s ILE 196 CO 0.54 0.50 -0.02 0.54 0.00 0.00 0.00 174.94 176.50 2i3t n ARG 197 N 1.61 1.69 -3.56 2.79 1.74 0.17 -4.88 116.66 116.21 2i3t n ARG 197 Ca -0.04 0.02 -0.13 0.00 -0.77 0.00 0.00 57.85 56.93 2i3t n ARG 197 Cb 0.48 -1.21 -0.05 0.00 -1.02 0.00 0.00 32.46 30.66 2i3t n ARG 197 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2i3t s ASP 198 N -4.43 -0.44 0.02 0.55 2.15 -1.19 -4.75 116.67 108.58 2i3t s ASP 198 Ca -0.08 0.12 0.01 0.00 0.43 0.00 0.00 52.55 53.02 2i3t s ASP 198 Cb 0.03 0.50 -0.01 0.00 -0.30 0.00 0.00 42.92 43.14 2i3t s ASP 198 CO 0.31 -0.76 -0.03 0.54 -0.17 0.00 0.00 175.17 175.06 2i3t s VAL 199 N -2.69 0.19 -0.10 1.11 0.11 -1.26 -0.80 120.40 116.95 2i3t s VAL 199 Ca -0.04 -0.63 -0.05 0.00 -2.93 0.00 0.00 61.98 58.33 2i3t s VAL 199 Cb -0.00 -0.26 0.05 0.00 -1.53 0.00 0.00 36.38 34.63 2i3t s VAL 199 CO -0.04 -0.29 0.23 0.00 -3.33 0.00 0.00 175.10 171.68 2i3t s ALA 200 N -0.93 -0.50 0.39 1.54 0.00 0.70 -4.60 121.76 118.35 2i3t s ALA 200 Ca -0.09 0.94 -0.26 0.00 0.00 0.00 0.00 51.96 52.55 2i3t s ALA 200 Cb -0.07 -0.64 -0.09 0.00 0.00 0.00 0.00 23.12 22.33 2i3t s ALA 200 CO -0.00 -0.23 1.18 -0.51 0.00 0.00 0.00 175.76 176.19 2i3t s LEU 201 N 1.35 4.23 0.70 0.00 1.43 -1.26 -0.72 118.68 124.41 2i3t s LEU 201 Ca -0.08 2.37 -0.14 0.00 -1.03 0.00 0.00 54.13 55.25 2i3t s LEU 201 Cb -0.11 -3.97 0.02 0.00 0.03 0.00 0.00 46.19 42.16 2i3t s LEU 201 CO -0.08 -0.64 1.13 -0.76 0.23 0.00 0.00 176.35 176.23 2i3t s LEU 202 N -2.39 3.30 -0.54 1.79 1.43 -1.15 -4.74 118.68 116.37 2i3t s LEU 202 Ca 0.56 2.07 -0.18 0.00 -1.03 0.00 0.00 54.13 55.54 2i3t s LEU 202 Cb -0.31 -4.56 -0.17 0.00 0.03 0.00 0.00 46.19 41.17 2i3t s LEU 202 CO 0.40 -1.89 1.60 -2.65 0.23 0.00 0.00 176.35 174.04 2i3t n PRO 203 N -2.71 0.04 0.00 1.29 -0.02 -1.26 -4.63 135.00 127.72 2i3t n PRO 203 Ca 0.11 -1.00 0.00 0.00 -2.02 0.00 0.00 63.50 60.59 2i3t n PRO 203 Cb 0.52 -2.69 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 2i3t n PRO 203 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2i3t n LYS 204 N 6.74 0.00 0.00 -0.52 0.00 -1.26 -3.64 118.16 119.47 2i3t n LYS 204 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.58 2i3t n LYS 204 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.48 2i3t n LYS 204 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2i3t n GLU 205 N 0.00 0.00 0.00 1.64 4.71 -1.26 -1.79 120.64 123.94 2i3t n GLU 205 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 2i3t n GLU 205 Cb 0.00 -1.35 0.00 0.00 -1.01 0.00 0.00 31.44 29.08 2i3t n GLU 205 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 2i3t n GLN 206 N -0.65 0.65 -2.46 3.49 3.00 -1.24 -5.12 117.38 115.06 2i3t n GLN 206 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 57.00 56.97 2i3t n GLN 206 Cb 0.00 -0.99 -0.02 0.00 0.00 0.00 0.00 30.24 29.23 2i3t n GLN 206 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 2i3t n GLU 207 N -1.55 -4.49 -0.71 -1.09 -0.58 -0.74 -4.00 120.64 107.47 2i3t n GLU 207 Ca 0.00 3.31 0.00 0.00 -0.42 0.00 0.00 57.16 60.05 2i3t n GLU 207 Cb 0.07 -4.41 0.00 0.00 -0.57 0.00 0.00 31.44 26.53 2i3t n GLU 207 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2i3t n GLY 208 N 1.86 0.28 3.78 0.62 0.00 -1.26 -1.60 105.19 108.86 2i3t n GLY 208 Ca -0.16 -1.38 -0.01 0.00 0.00 0.00 0.00 46.02 44.47 2i3t n GLY 208 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2i3t s TYR 209 N -3.58 -0.03 0.05 1.61 -0.85 -0.52 -2.94 117.35 111.10 2i3t s TYR 209 Ca 0.00 -0.23 0.04 0.00 -0.52 0.00 0.00 57.07 56.37 2i3t s TYR 209 Cb 0.00 0.62 -0.02 0.00 0.38 0.00 0.00 41.96 42.94 2i3t s TYR 209 CO 0.00 -0.64 -0.13 0.00 -1.52 0.00 0.00 175.55 173.26 2i3t s ALA 210 N -2.58 1.05 -0.01 9.51 0.00 0.10 -0.50 121.76 129.33 2i3t s ALA 210 Ca 0.18 -0.86 -0.15 0.00 0.00 0.00 0.00 51.96 51.13 2i3t s ALA 210 Cb 0.00 -0.11 0.02 0.00 0.00 0.00 0.00 23.12 23.03 2i3t s ALA 210 CO 0.01 0.16 0.31 0.00 0.00 0.00 0.00 175.76 176.24 2i3t s SER 212 N -1.35 3.68 0.55 0.00 1.04 0.02 -0.99 113.70 116.66 2i3t s SER 212 Ca -0.13 -0.65 0.04 0.00 0.48 0.00 0.00 55.95 55.69 2i3t s SER 212 Cb -0.05 -0.42 0.03 0.00 0.10 0.00 0.00 66.02 65.68 2i3t s SER 212 CO 0.04 0.17 0.31 -0.94 0.98 0.00 0.00 173.24 173.80 2i3t s SER 213 N -2.20 4.49 0.28 7.02 1.04 -0.91 0.45 113.70 123.88 2i3t s SER 213 Ca 0.17 -1.39 0.26 0.00 0.48 0.00 0.00 55.95 55.47 2i3t s SER 213 Cb -0.10 0.54 0.84 0.00 0.10 0.00 0.00 66.02 67.40 2i3t s SER 213 CO 0.09 -1.08 1.75 0.16 0.98 0.00 0.00 173.24 175.14 2i3t h ILE 214 N 0.87 0.00 -3.02 -1.02 -0.00 -1.66 -1.18 117.51 111.50 2i3t h ILE 214 Ca -0.38 -0.49 -0.65 0.00 -0.00 0.00 0.00 64.86 63.34 2i3t h ILE 214 Cb 1.31 1.41 -0.40 0.00 -0.00 0.00 0.00 36.82 39.15 2i3t h ILE 214 CO 0.61 0.00 -0.40 -0.90 -0.00 0.00 0.00 178.15 177.47 2i3t n ASP 215 N -2.44 3.58 -3.69 2.16 5.75 -1.26 -2.08 116.55 118.57 2i3t n ASP 215 Ca 0.04 -3.23 -0.21 0.00 -0.01 0.00 0.00 54.79 51.37 2i3t n ASP 215 Cb 0.38 -0.85 -0.04 0.00 -1.03 0.00 0.00 41.12 39.59 2i3t n ASP 215 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2i3t n GLY 216 N 1.87 -0.20 3.06 6.12 0.00 0.11 -4.86 105.19 111.29 2i3t n GLY 216 Ca 0.22 0.13 -0.12 0.00 0.00 0.00 0.00 46.02 46.26 2i3t n GLY 216 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2i3t s ARG 217 N -5.86 0.31 -0.08 1.61 3.52 -1.26 -1.46 118.95 115.72 2i3t s ARG 217 Ca 0.09 -0.05 0.02 0.00 -0.13 0.00 0.00 55.73 55.66 2i3t s ARG 217 Cb -0.05 0.14 0.01 0.00 -1.56 0.00 0.00 34.95 33.49 2i3t s ARG 217 CO 0.58 -0.06 -0.13 0.08 -0.81 0.00 0.00 175.30 174.96 2i3t s VAL 218 N -0.55 1.27 -0.04 7.11 1.01 -0.56 -2.14 120.40 126.50 2i3t s VAL 218 Ca -0.06 -0.53 0.03 0.00 0.00 0.00 0.00 61.98 61.41 2i3t s VAL 218 Cb -0.04 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 35.14 2i3t s VAL 218 CO 0.01 0.39 -0.09 0.00 0.00 0.00 0.00 175.10 175.40 2i3t s ALA 219 N 0.86 2.89 0.07 5.51 0.00 -0.16 -1.93 121.76 129.00 2i3t s ALA 219 Ca -0.10 -0.97 0.07 0.00 0.00 0.00 0.00 51.96 50.95 2i3t s ALA 219 Cb -0.15 -1.10 -0.03 0.00 0.00 0.00 0.00 23.12 21.84 2i3t s ALA 219 CO 0.01 0.58 -0.18 0.08 0.00 0.00 0.00 175.76 176.25 2i3t s VAL 220 N -0.85 1.44 -0.03 0.00 1.01 0.34 -1.02 120.40 121.29 2i3t s VAL 220 Ca 0.14 -1.27 -0.01 0.00 0.00 0.00 0.00 61.98 60.84 2i3t s VAL 220 Cb -0.11 -1.30 0.03 0.00 0.00 0.00 0.00 36.38 35.00 2i3t s VAL 220 CO 0.03 -0.00 0.03 -0.70 0.00 0.00 0.00 175.10 174.46 2i3t s GLU 221 N -1.49 0.04 -0.06 2.72 2.12 0.35 -1.24 118.70 121.14 2i3t s GLU 221 Ca 0.04 0.23 0.03 0.00 0.36 0.00 0.00 54.97 55.63 2i3t s GLU 221 Cb -0.09 -0.42 -0.03 0.00 0.26 0.00 0.00 34.13 33.86 2i3t s GLU 221 CO 0.02 -0.22 -0.12 -0.06 -0.54 0.00 0.00 175.26 174.34 2i3t s PHE 222 N 1.48 2.77 0.16 5.30 0.08 0.68 -1.44 117.98 127.01 2i3t s PHE 222 Ca -0.04 -0.14 0.06 0.00 0.12 0.00 0.00 56.93 56.93 2i3t s PHE 222 Cb -0.13 -1.66 -0.04 0.00 -0.57 0.00 0.00 43.02 40.62 2i3t s PHE 222 CO -0.03 0.20 0.04 -0.06 -0.10 0.00 0.00 175.22 175.27 2i3t s PHE 223 N -0.68 2.97 -0.01 0.36 2.99 -0.63 -0.09 117.98 122.88 2i3t s PHE 223 Ca 0.10 -0.08 0.02 0.00 0.00 0.00 0.00 56.93 56.98 2i3t s PHE 223 Cb -0.11 -1.45 0.03 0.00 0.00 0.00 0.00 43.02 41.49 2i3t s PHE 223 CO 0.01 0.51 0.87 -0.25 -0.00 0.00 0.00 175.22 176.36 2i3t n ASP 224 N -0.08 0.38 -3.93 1.36 8.00 -1.26 -4.82 116.55 116.20 2i3t n ASP 224 Ca -0.09 -1.82 -0.34 0.00 0.71 0.00 0.00 54.79 53.25 2i3t n ASP 224 Cb 0.54 -0.15 -0.06 0.00 -0.02 0.00 0.00 41.12 41.43 2i3t n ASP 224 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 2i3t n ASP 225 N -0.19 -1.47 0.00 -2.24 5.68 -1.26 -5.01 116.55 112.07 2i3t n ASP 225 Ca 0.02 -0.98 0.00 0.00 -0.50 0.00 0.00 54.79 53.32 2i3t n ASP 225 Cb 0.61 -1.28 0.00 0.00 -1.14 0.00 0.00 41.12 39.30 2i3t n ASP 225 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 2i3t n SER 232 N -1.83 2.89 -3.31 -1.12 2.88 -1.26 -5.32 113.62 106.54 2i3t n SER 232 Ca 0.10 0.00 0.02 0.00 -1.33 0.00 0.00 58.87 57.66 2i3t n SER 232 Cb 0.36 0.52 -0.04 0.00 -0.75 0.00 0.00 64.21 64.31 2i3t n SER 232 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2i3t s SER 233 N -1.34 -0.32 0.05 -3.46 1.04 -1.26 -4.62 113.70 103.78 2i3t s SER 233 Ca 0.00 0.45 -0.01 0.00 0.48 0.00 0.00 55.95 56.87 2i3t s SER 233 Cb 0.00 1.36 -0.04 0.00 0.10 0.00 0.00 66.02 67.44 2i3t s SER 233 CO 0.00 -0.06 0.21 -0.54 0.98 0.00 0.00 173.24 173.83 2i3t s LYS 234 N 2.19 3.45 0.00 4.02 1.02 0.87 -4.92 119.74 126.38 2i3t s LYS 234 Ca -0.01 -0.39 -0.01 0.00 0.02 0.00 0.00 55.97 55.58 2i3t s LYS 234 Cb -0.03 -3.04 -0.01 0.00 -0.52 0.00 0.00 37.83 34.23 2i3t s LYS 234 CO -0.17 0.62 0.00 0.50 -0.92 0.00 0.00 175.35 175.38 2i3t s ARG 235 N -2.38 0.15 0.04 1.68 3.52 -1.26 -0.23 118.95 120.48 2i3t s ARG 235 Ca 0.34 -0.25 -0.27 0.00 -0.13 0.00 0.00 55.73 55.41 2i3t s ARG 235 Cb -0.13 0.06 0.07 0.00 -1.56 0.00 0.00 34.95 33.39 2i3t s ARG 235 CO 0.26 -0.03 0.66 -0.59 -0.81 0.00 0.00 175.30 174.79 2i3t s PHE 236 N -0.64 -0.59 0.06 5.12 -0.12 -0.37 -5.00 117.98 116.44 2i3t s PHE 236 Ca -0.07 0.73 -0.01 0.00 -0.05 0.00 0.00 56.93 57.53 2i3t s PHE 236 Cb -0.04 0.48 -0.04 0.00 -0.63 0.00 0.00 43.02 42.79 2i3t s PHE 236 CO -0.00 -0.71 -0.02 0.00 -0.05 0.00 0.00 175.22 174.44 2i3t s ALA 237 N -2.40 0.57 0.01 1.99 0.00 -1.26 -0.50 121.76 120.17 2i3t s ALA 237 Ca -0.05 -1.25 -0.16 0.00 0.00 0.00 0.00 51.96 50.50 2i3t s ALA 237 Cb -0.00 0.37 0.03 0.00 0.00 0.00 0.00 23.12 23.51 2i3t s ALA 237 CO -0.01 -0.39 0.34 -0.59 0.00 0.00 0.00 175.76 175.11 2i3t s PHE 238 N -3.94 -0.19 0.26 0.00 -0.71 -0.81 -5.00 117.98 107.59 2i3t s PHE 238 Ca 0.10 0.22 -0.15 0.00 -1.04 0.00 0.00 56.93 56.05 2i3t s PHE 238 Cb 0.08 0.13 -0.08 0.00 -1.21 0.00 0.00 43.02 41.93 2i3t s PHE 238 CO -0.08 -0.46 0.68 1.03 -1.34 0.00 0.00 175.22 175.05 2i3t s ARG 239 N -1.83 4.02 0.00 1.99 0.52 -1.26 -1.50 118.95 120.88 2i3t s ARG 239 Ca -0.10 0.62 0.00 0.00 -0.52 0.00 0.00 55.73 55.73 2i3t s ARG 239 Cb -0.03 -2.62 0.00 0.00 0.52 0.00 0.00 34.95 32.82 2i3t s ARG 239 CO 0.01 0.27 0.00 0.00 0.02 0.00 0.00 175.30 175.61 2i3t n HIS 241 N -1.07 3.53 -3.13 0.00 8.25 -1.26 -5.00 115.22 116.55 2i3t n HIS 241 Ca 0.00 -3.46 -0.19 0.00 -0.26 0.00 0.00 57.72 53.81 2i3t n HIS 241 Cb 0.00 -0.77 0.02 0.00 1.12 0.00 0.00 29.99 30.37 2i3t n HIS 241 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2i3t s ARG 242 N -3.69 2.60 -0.24 -0.41 3.00 -1.26 -0.76 118.95 118.19 2i3t s ARG 242 Ca 0.44 -1.45 -0.03 0.00 0.00 0.00 0.00 55.73 54.70 2i3t s ARG 242 Cb 0.23 -2.64 0.13 0.00 0.00 0.00 0.00 34.95 32.67 2i3t s ARG 242 CO -0.12 -0.47 0.36 -1.17 0.00 0.00 0.00 175.30 173.90 2i3t s LEU 243 N -4.42 -0.58 -0.60 2.53 2.96 0.35 -4.93 118.68 114.00 2i3t s LEU 243 Ca 0.55 0.17 -0.28 0.00 -0.22 0.00 0.00 54.13 54.36 2i3t s LEU 243 Cb -0.07 1.03 0.02 0.00 0.50 0.00 0.00 46.19 47.67 2i3t s LEU 243 CO 0.34 -0.30 1.38 0.20 -1.32 0.00 0.00 176.35 176.65 2i3t s ASN 244 N 2.52 6.13 0.00 3.68 0.01 -1.26 -2.06 114.94 123.96 2i3t s ASN 244 Ca 0.12 0.13 0.00 0.00 -0.71 0.00 0.00 52.86 52.40 2i3t s ASN 244 Cb -0.15 -2.55 0.00 0.00 0.41 0.00 0.00 41.25 38.96 2i3t s ASN 244 CO -0.15 -1.74 0.00 0.00 -1.51 0.00 0.00 177.10 173.70 2i3t n LEU 245 N 9.55 0.00 0.00 0.60 -0.00 -1.16 -5.04 117.00 120.95 2i3t n LEU 245 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.12 2i3t n LEU 245 Cb 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.91 2i3t n LEU 245 CO 0.71 0.00 0.00 2.29 -0.00 0.00 0.00 177.39 180.39 2i3t n LYS 246 N 0.00 0.00 0.03 1.47 2.85 -1.26 -4.76 118.16 116.49 2i3t n LYS 246 Ca 0.00 0.33 -0.22 0.00 -1.05 0.00 0.00 58.31 57.37 2i3t n LYS 246 Cb 0.00 -0.82 -0.14 0.00 -0.65 0.00 0.00 35.03 33.42 2i3t n LYS 246 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 2i3t h ASP 247 N 0.00 0.46 -0.64 -5.58 3.32 -2.01 -3.49 116.42 108.48 2i3t h ASP 247 Ca 0.00 -0.89 -0.67 0.00 0.02 0.00 0.00 57.03 55.49 2i3t h ASP 247 Cb 0.00 -0.15 -0.13 0.00 0.22 0.00 0.00 39.33 39.27 2i3t h ASP 247 CO 0.00 1.63 -0.51 0.42 -1.72 0.00 0.00 179.24 179.07 2i3t s THR 248 N -2.50 0.99 -0.25 0.35 -4.23 -1.26 -5.12 115.64 103.62 2i3t s THR 248 Ca -0.18 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.35 2i3t s THR 248 Cb 0.04 -2.10 0.05 0.00 1.34 0.00 0.00 72.50 71.83 2i3t s THR 248 CO 0.80 0.00 -0.10 0.20 -0.54 0.00 0.00 174.62 174.98 2i3t s ASN 249 N -3.86 4.29 -0.09 3.99 0.02 -1.26 -2.97 114.94 115.07 2i3t s ASN 249 Ca 0.05 -1.20 -0.24 0.00 -1.02 0.00 0.00 52.86 50.46 2i3t s ASN 249 Cb 0.01 -1.58 -0.03 0.00 0.02 0.00 0.00 41.25 39.67 2i3t s ASN 249 CO 0.03 -0.16 0.74 -0.22 0.02 0.00 0.00 177.10 177.51 2i3t s LEU 250 N 1.18 4.29 -0.15 0.60 2.96 -0.87 -4.91 118.68 121.78 2i3t s LEU 250 Ca -0.05 1.20 -0.03 0.00 -0.22 0.00 0.00 54.13 55.03 2i3t s LEU 250 Cb -0.18 -3.13 -0.02 0.00 0.50 0.00 0.00 46.19 43.35 2i3t s LEU 250 CO -0.06 -0.18 -0.07 0.00 -1.32 0.00 0.00 176.35 174.72 2i3t s ALA 251 N 1.11 2.87 0.21 5.97 0.00 -1.26 -0.49 121.76 130.17 2i3t s ALA 251 Ca 0.38 -0.86 0.05 0.00 0.00 0.00 0.00 51.96 51.53 2i3t s ALA 251 Cb -0.18 -1.45 -0.03 0.00 0.00 0.00 0.00 23.12 21.46 2i3t s ALA 251 CO 0.17 0.19 0.28 0.71 0.00 0.00 0.00 175.76 177.12 2i3t s TYR 252 N 0.42 3.37 0.35 0.00 1.51 0.06 -4.56 117.35 118.49 2i3t s TYR 252 Ca -0.06 0.00 -0.27 0.00 -1.01 0.00 0.00 57.07 55.73 2i3t s TYR 252 Cb -0.15 -1.56 -0.09 0.00 -0.11 0.00 0.00 41.96 40.05 2i3t s TYR 252 CO 0.04 0.48 1.25 -2.14 -1.11 0.00 0.00 175.55 174.07 2i3t s PRO 253 N -3.65 4.25 -0.61 -1.71 0.02 -0.88 0.04 135.00 132.45 2i3t s PRO 253 Ca 0.34 2.07 -0.16 0.00 0.02 0.00 0.00 61.00 63.26 2i3t s PRO 253 Cb -0.09 -2.94 0.15 0.00 0.02 0.00 0.00 34.50 31.64 2i3t s PRO 253 CO 0.27 -0.23 0.59 0.08 -0.33 0.00 0.00 177.00 177.39 2i3t s VAL 254 N -1.23 5.25 0.13 3.83 1.01 -0.45 -0.81 120.40 128.13 2i3t s VAL 254 Ca 0.52 -1.65 -0.05 0.00 0.00 0.00 0.00 61.98 60.80 2i3t s VAL 254 Cb -0.36 -4.39 -0.18 0.00 0.00 0.00 0.00 36.38 31.44 2i3t s VAL 254 CO 0.47 -0.94 1.30 0.78 0.00 0.00 0.00 175.10 176.71 2i3t h ASN 255 N 8.69 0.54 -3.39 3.32 2.35 -1.15 -3.40 115.58 122.55 2i3t h ASN 255 Ca -0.21 -0.43 -0.24 0.00 -0.55 0.00 0.00 56.30 54.87 2i3t h ASN 255 Cb 1.08 -0.17 -0.32 0.00 0.05 0.00 0.00 38.32 38.97 2i3t h ASN 255 CO 0.99 1.23 -0.59 -0.55 -1.65 0.00 0.00 177.43 176.86 2i3t s SER 256 N -7.08 -0.05 0.07 5.81 0.15 -1.12 -4.48 113.70 106.99 2i3t s SER 256 Ca -0.06 0.33 0.06 0.00 0.70 0.00 0.00 55.95 56.99 2i3t s SER 256 Cb 0.09 0.23 -0.03 0.00 -1.71 0.00 0.00 66.02 64.59 2i3t s SER 256 CO 0.87 -0.16 -0.17 0.27 1.20 0.00 0.00 173.24 175.25 2i3t s ILE 257 N 1.29 1.38 -0.05 6.45 -4.36 -1.26 -0.52 121.20 124.13 2i3t s ILE 257 Ca -0.08 -1.28 -0.31 0.00 -0.26 0.00 0.00 60.65 58.72 2i3t s ILE 257 Cb -0.11 -1.26 0.08 0.00 1.25 0.00 0.00 42.46 42.41 2i3t s ILE 257 CO -0.06 -0.05 0.72 -0.70 0.24 0.00 0.00 174.94 175.09 2i3t s GLU 258 N -1.54 1.01 -0.13 0.37 2.12 -0.29 -4.82 118.70 115.42 2i3t s GLU 258 Ca 0.03 0.21 -0.07 0.00 0.36 0.00 0.00 54.97 55.51 2i3t s GLU 258 Cb -0.09 0.48 -0.04 0.00 0.26 0.00 0.00 34.13 34.73 2i3t s GLU 258 CO 0.03 -0.32 0.11 -0.06 -0.54 0.00 0.00 175.26 174.48 2i3t s PHE 259 N -1.30 3.49 0.33 5.30 0.40 -1.26 -0.07 117.98 124.88 2i3t s PHE 259 Ca -0.09 0.43 -0.27 0.00 -0.60 0.00 0.00 56.93 56.40 2i3t s PHE 259 Cb -0.00 -1.95 -0.09 0.00 0.51 0.00 0.00 43.02 41.48 2i3t s PHE 259 CO 0.08 0.61 1.03 -1.54 0.70 0.00 0.00 175.22 176.09 2i3t s SER 260 N -0.75 7.12 0.26 1.36 1.04 -0.78 -4.85 113.70 117.10 2i3t s SER 260 Ca 0.13 2.04 -0.01 0.00 0.48 0.00 0.00 55.95 58.60 2i3t s SER 260 Cb -0.12 -2.60 0.35 0.00 0.10 0.00 0.00 66.02 63.75 2i3t s SER 260 CO 0.03 -0.23 1.73 -0.65 0.98 0.00 0.00 173.24 175.10 2i3t h PRO 261 N 3.18 0.69 0.00 4.02 0.11 -1.88 -2.27 132.00 135.85 2i3t h PRO 261 Ca -0.47 -0.22 0.00 0.00 0.11 0.00 0.00 66.00 65.42 2i3t h PRO 261 Cb 1.21 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2i3t h PRO 261 CO 0.65 0.78 -0.02 0.00 -0.21 0.00 0.00 178.00 179.20 2i3t h ARG 262 N 0.63 0.00 -0.02 1.05 3.08 -1.90 -3.39 114.38 113.83 2i3t h ARG 262 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 2i3t h ARG 262 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.60 2i3t h ARG 262 CO 0.03 0.00 0.00 0.72 -1.07 0.00 0.00 179.97 179.65 2i3t n HIS 263 N -2.45 0.03 -4.36 3.04 8.25 -1.26 -4.91 115.22 113.55 2i3t n HIS 263 Ca -0.00 -0.01 -0.37 0.00 -0.26 0.00 0.00 57.72 57.07 2i3t n HIS 263 Cb 0.01 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.06 2i3t n HIS 263 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2i3t n LYS 264 N -0.62 -1.68 -2.68 -0.41 5.02 -0.85 -4.93 118.16 111.99 2i3t n LYS 264 Ca 0.17 0.22 -0.25 0.00 -2.02 0.00 0.00 58.31 56.43 2i3t n LYS 264 Cb 0.13 -4.61 0.02 0.00 -0.02 0.00 0.00 35.03 30.54 2i3t n LYS 264 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2i3t s PHE 265 N -3.52 3.32 -0.31 2.13 2.99 -1.26 -4.75 117.98 116.58 2i3t s PHE 265 Ca 0.59 0.54 -0.09 0.00 0.00 0.00 0.00 56.93 57.97 2i3t s PHE 265 Cb -0.34 -2.47 -0.00 0.00 0.00 0.00 0.00 43.02 40.21 2i3t s PHE 265 CO 0.98 -0.51 0.13 -1.17 -0.00 0.00 0.00 175.22 174.66 2i3t s LEU 266 N -4.77 4.03 -0.20 -0.37 2.96 0.12 -1.86 118.68 118.60 2i3t s LEU 266 Ca 0.50 -0.55 -0.13 0.00 -0.22 0.00 0.00 54.13 53.73 2i3t s LEU 266 Cb -0.10 -1.97 -0.05 0.00 0.50 0.00 0.00 46.19 44.57 2i3t s LEU 266 CO 0.42 -0.19 0.26 -0.31 -1.32 0.00 0.00 176.35 175.21 2i3t s TYR 267 N 1.59 3.38 -0.05 5.38 1.51 0.90 -0.14 117.35 129.92 2i3t s TYR 267 Ca 0.04 0.45 0.06 0.00 -1.01 0.00 0.00 57.07 56.60 2i3t s TYR 267 Cb -0.17 -2.35 -0.02 0.00 -0.11 0.00 0.00 41.96 39.32 2i3t s TYR 267 CO 0.05 0.12 -0.21 0.95 -1.11 0.00 0.00 175.55 175.35 2i3t s THR 268 N 0.88 2.44 -0.15 -0.71 -4.23 -0.24 -1.14 115.64 112.49 2i3t s THR 268 Ca 0.13 -0.95 0.02 0.00 -1.18 0.00 0.00 61.69 59.71 2i3t s THR 268 Cb -0.13 -1.90 0.01 0.00 1.34 0.00 0.00 72.50 71.81 2i3t s THR 268 CO 0.04 0.58 -0.19 0.00 -0.54 0.00 0.00 174.62 174.51 2i3t s ALA 269 N -0.48 2.34 0.42 3.99 0.00 0.33 -0.76 121.76 127.59 2i3t s ALA 269 Ca 0.06 -1.08 0.07 0.00 0.00 0.00 0.00 51.96 51.01 2i3t s ALA 269 Cb -0.11 -1.08 -0.07 0.00 0.00 0.00 0.00 23.12 21.86 2i3t s ALA 269 CO 0.01 -0.03 0.06 0.20 0.00 0.00 0.00 175.76 176.00 2i3t s GLY 270 N 0.82 2.50 0.00 0.00 0.00 -0.96 -0.64 107.32 109.03 2i3t s GLY 270 Ca -0.06 -2.13 0.04 0.00 0.00 0.00 0.00 44.72 42.58 2i3t s GLY 270 CO -0.01 -2.06 1.08 1.44 0.00 0.00 0.00 173.10 173.55 2i3t n SER 271 N -1.07 0.00 -0.87 1.64 7.64 0.01 -2.12 113.62 118.85 2i3t n SER 271 Ca -0.05 -1.67 0.10 0.00 1.01 0.00 0.00 58.87 58.26 2i3t n SER 271 Cb 0.66 0.00 0.28 0.00 -1.01 0.00 0.00 64.21 64.14 2i3t n SER 271 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2i3t n ASP 272 N -0.58 2.57 0.00 6.43 5.75 -1.26 -4.52 116.55 124.94 2i3t n ASP 272 Ca 0.03 -1.89 0.00 0.00 -0.01 0.00 0.00 54.79 52.92 2i3t n ASP 272 Cb 0.02 -0.22 0.00 0.00 -1.03 0.00 0.00 41.12 39.88 2i3t n ASP 272 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2i3t n GLY 273 N 1.31 0.46 3.52 6.12 0.00 -0.90 -5.00 105.19 110.70 2i3t n GLY 273 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 2i3t n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2i3t s ILE 274 N -2.07 2.99 -0.18 -0.61 1.01 -1.26 -3.23 121.20 117.86 2i3t s ILE 274 Ca 0.00 -1.60 -0.02 0.00 0.00 0.00 0.00 60.65 59.04 2i3t s ILE 274 Cb 0.00 -2.43 -0.01 0.00 0.01 0.00 0.00 42.46 40.04 2i3t s ILE 274 CO 0.00 -0.01 -0.10 -0.63 0.00 0.00 0.00 174.94 174.20 2i3t s ILE 275 N -1.43 3.05 0.17 2.92 1.01 -1.26 -2.28 121.20 123.37 2i3t s ILE 275 Ca 0.21 -0.63 0.05 0.00 0.00 0.00 0.00 60.65 60.29 2i3t s ILE 275 Cb -0.10 -2.33 -0.04 0.00 0.01 0.00 0.00 42.46 40.01 2i3t s ILE 275 CO 0.12 0.48 0.13 -0.44 0.00 0.00 0.00 174.94 175.23 2i3t s SER 276 N 0.98 5.46 -0.13 3.58 0.01 0.06 -1.73 113.70 121.93 2i3t s SER 276 Ca -0.01 -0.15 0.02 0.00 1.31 0.00 0.00 55.95 57.12 2i3t s SER 276 Cb -0.15 -1.41 0.01 0.00 0.21 0.00 0.00 66.02 64.68 2i3t s SER 276 CO -0.01 0.07 -0.20 0.00 0.41 0.00 0.00 173.24 173.51 2i3t s TRP 278 N 0.83 1.55 -0.46 0.00 0.52 0.80 -0.02 118.94 122.15 2i3t s TRP 278 Ca -0.08 -0.38 -0.08 0.00 0.02 0.00 0.00 56.10 55.58 2i3t s TRP 278 Cb -0.16 -0.91 0.12 0.00 -1.15 0.00 0.00 33.47 31.38 2i3t s TRP 278 CO -0.01 0.08 0.33 1.21 0.02 0.00 0.00 176.95 178.59 2i3t s ASN 279 N -1.29 5.66 0.28 2.95 3.84 0.56 0.16 114.94 127.10 2i3t s ASN 279 Ca 0.05 -1.93 0.06 0.00 0.21 0.00 0.00 52.86 51.25 2i3t s ASN 279 Cb -0.09 -1.99 0.41 0.00 -0.55 0.00 0.00 41.25 39.03 2i3t s ASN 279 CO 0.02 -0.68 1.67 -0.07 -2.79 0.00 0.00 177.10 175.25 2i3t h LEU 280 N 8.41 0.26 0.34 3.21 3.38 -1.87 0.26 115.31 129.30 2i3t h LEU 280 Ca -0.20 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.63 2i3t h LEU 280 Cb 1.07 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.75 2i3t h LEU 280 CO 0.84 0.68 -0.16 1.56 0.09 0.00 0.00 178.44 181.45 2i3t h GLN 281 N 0.20 -0.44 0.00 1.13 7.50 -1.93 -2.61 115.11 118.96 2i3t h GLN 281 Ca 0.01 0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.19 2i3t h GLN 281 Cb 0.87 0.10 0.00 0.00 0.05 0.00 0.00 27.48 28.50 2i3t h GLN 281 CO 0.07 -0.19 0.00 -2.37 -1.50 0.00 0.00 178.83 174.84 2i3t n THR 282 N -5.22 0.01 -4.11 -0.54 5.66 -1.20 -4.92 114.28 103.95 2i3t n THR 282 Ca -0.10 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.60 2i3t n THR 282 Cb 0.24 -0.51 -0.03 0.00 -1.55 0.00 0.00 70.33 68.48 2i3t n THR 282 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2i3t n ARG 283 N -1.09 -2.88 -4.09 1.09 1.74 0.81 -4.97 116.66 107.27 2i3t n ARG 283 Ca 0.21 0.34 -0.14 0.00 -0.77 0.00 0.00 57.85 57.49 2i3t n ARG 283 Cb 0.15 -4.61 -0.12 0.00 -1.02 0.00 0.00 32.46 26.86 2i3t n ARG 283 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2i3t s LYS 284 N -6.82 0.59 -0.27 5.56 1.02 -0.64 -5.00 119.74 114.18 2i3t s LYS 284 Ca 0.28 -0.79 -0.24 0.00 0.02 0.00 0.00 55.97 55.25 2i3t s LYS 284 Cb -0.16 -0.41 -0.00 0.00 -0.52 0.00 0.00 37.83 36.74 2i3t s LYS 284 CO 0.92 0.08 0.82 0.21 -0.92 0.00 0.00 175.35 176.47 2i3t s LYS 285 N -1.58 4.09 -0.06 1.68 2.20 -1.26 -0.32 119.74 124.49 2i3t s LYS 285 Ca -0.08 0.80 -0.15 0.00 -0.36 0.00 0.00 55.97 56.18 2i3t s LYS 285 Cb -0.10 -3.68 -0.10 0.00 -1.51 0.00 0.00 37.83 32.44 2i3t s LYS 285 CO 0.01 -0.60 0.61 0.82 -0.36 0.00 0.00 175.35 175.83 2i3t h ILE 286 N 5.52 0.35 -2.47 5.43 5.03 -0.78 -3.48 117.51 127.11 2i3t h ILE 286 Ca -0.23 -0.91 -0.03 0.00 -0.12 0.00 0.00 64.86 63.57 2i3t h ILE 286 Cb 1.09 0.61 -0.00 0.00 -3.03 0.00 0.00 36.82 35.49 2i3t h ILE 286 CO 0.89 0.10 0.09 2.29 -0.68 0.00 0.00 178.15 180.83 2i3t n LYS 287 N -4.99 0.45 -3.74 2.37 2.85 -1.15 -5.00 118.16 108.96 2i3t n LYS 287 Ca -0.06 -0.95 -0.15 0.00 -1.05 0.00 0.00 58.31 56.09 2i3t n LYS 287 Cb 0.21 1.15 -0.16 0.00 -0.65 0.00 0.00 35.03 35.57 2i3t n LYS 287 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 177.40 176.55 2i3t s ASN 288 N -1.86 0.23 0.35 -5.58 0.02 -1.26 -1.29 114.94 105.55 2i3t s ASN 288 Ca 0.07 0.17 -0.16 0.00 -1.02 0.00 0.00 52.86 51.93 2i3t s ASN 288 Cb -0.02 0.05 -0.09 0.00 0.02 0.00 0.00 41.25 41.21 2i3t s ASN 288 CO 0.05 -0.17 0.78 -0.36 0.02 0.00 0.00 177.10 177.43 2i3t s PHE 289 N 1.40 3.37 0.46 2.20 0.40 -0.70 -4.99 117.98 120.11 2i3t s PHE 289 Ca -0.06 1.28 -0.25 0.00 -0.60 0.00 0.00 56.93 57.30 2i3t s PHE 289 Cb -0.12 -2.59 -0.08 0.00 0.51 0.00 0.00 43.02 40.74 2i3t s PHE 289 CO -0.04 0.04 1.39 0.00 0.70 0.00 0.00 175.22 177.31 2i3t n ALA 290 N -0.49 1.84 -1.66 5.36 0.00 -1.26 -4.30 120.51 120.00 2i3t n ALA 290 Ca 0.04 0.24 -0.53 0.00 0.00 0.00 0.00 53.44 53.19 2i3t n ALA 290 Cb 0.53 -2.36 -0.06 0.00 0.00 0.00 0.00 19.45 17.56 2i3t n ALA 290 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2i3t n LYS 291 N -0.25 1.38 -0.02 0.00 4.81 -1.26 -4.86 118.16 117.96 2i3t n LYS 291 Ca 0.06 0.50 -0.16 0.00 -0.87 0.00 0.00 58.31 57.84 2i3t n LYS 291 Cb 0.41 -2.20 -0.09 0.00 0.02 0.00 0.00 35.03 33.18 2i3t n LYS 291 CO 0.00 0.00 0.00 0.74 1.17 0.00 0.00 177.40 179.31 2i3t h PHE 292 N 6.26 0.74 -0.85 5.64 -1.00 -1.88 -3.49 116.94 122.36 2i3t h PHE 292 Ca -0.47 -0.34 0.00 0.00 2.81 0.00 0.00 57.97 59.97 2i3t h PHE 292 Cb 1.31 -0.11 0.00 0.00 3.61 0.00 0.00 35.95 40.76 2i3t h PHE 292 CO 0.70 1.13 0.00 0.27 -1.61 0.00 0.00 178.31 178.80 2i3t n ASN 293 N -4.19 0.00 -0.17 2.17 0.23 -1.26 -5.03 115.26 107.01 2i3t n ASN 293 Ca -0.08 -0.13 0.15 0.00 -0.53 0.00 0.00 54.58 53.99 2i3t n ASN 293 Cb 0.64 0.00 0.79 0.00 -2.08 0.00 0.00 39.78 39.13 2i3t n ASN 293 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2i3t n GLU 294 N 0.00 1.24 -3.60 -3.83 -0.58 -1.26 -4.88 120.64 107.73 2i3t n GLU 294 Ca 0.00 -0.35 -0.21 0.00 -0.42 0.00 0.00 57.16 56.18 2i3t n GLU 294 Cb 0.00 -1.49 -0.03 0.00 -0.57 0.00 0.00 31.44 29.35 2i3t n GLU 294 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2i3t s ASP 295 N -1.99 5.16 0.38 1.62 1.11 -1.26 -4.99 116.67 116.69 2i3t s ASP 295 Ca 0.44 -0.65 -0.24 0.00 0.18 0.00 0.00 52.55 52.28 2i3t s ASP 295 Cb 0.22 -0.69 -0.09 0.00 1.07 0.00 0.00 42.92 43.42 2i3t s ASP 295 CO 0.36 -0.57 1.02 -0.44 1.18 0.00 0.00 175.17 176.71 2i3t s SER 296 N -4.10 6.92 -0.52 0.27 0.01 -1.06 -4.06 113.70 111.15 2i3t s SER 296 Ca 0.46 1.96 -0.24 0.00 1.31 0.00 0.00 55.95 59.45 2i3t s SER 296 Cb -0.04 -2.58 0.04 0.00 0.21 0.00 0.00 66.02 63.64 2i3t s SER 296 CO 0.28 -0.38 0.90 -0.69 0.41 0.00 0.00 173.24 173.76 2i3t s VAL 297 N -1.69 4.47 -0.24 3.43 1.01 -0.92 -1.33 120.40 125.14 2i3t s VAL 297 Ca 0.56 0.34 0.22 0.00 0.00 0.00 0.00 61.98 63.11 2i3t s VAL 297 Cb -0.20 -4.47 -0.11 0.00 0.00 0.00 0.00 36.38 31.59 2i3t s VAL 297 CO 0.25 -0.98 0.88 0.52 0.00 0.00 0.00 175.10 175.77 2i3t n VAL 298 N 6.20 0.37 -3.71 2.92 0.31 -0.45 -4.03 118.33 119.94 2i3t n VAL 298 Ca 0.02 -0.49 -0.14 0.00 -0.01 0.00 0.00 64.34 63.73 2i3t n VAL 298 Cb 0.48 -0.16 -0.09 0.00 -0.91 0.00 0.00 33.84 33.16 2i3t n VAL 298 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2i3t s LYS 299 N -3.38 0.61 0.01 5.55 2.36 -1.18 -4.43 119.74 119.27 2i3t s LYS 299 Ca -0.02 0.47 -0.02 0.00 -2.55 0.00 0.00 55.97 53.85 2i3t s LYS 299 Cb 0.12 0.29 -0.01 0.00 -1.05 0.00 0.00 37.83 37.18 2i3t s LYS 299 CO 0.83 -0.11 0.02 0.96 1.55 0.00 0.00 175.35 178.60 2i3t s ILE 300 N -0.14 0.08 -0.01 5.43 -4.36 -1.26 -1.09 121.20 119.85 2i3t s ILE 300 Ca -0.03 -0.68 0.01 0.00 -0.26 0.00 0.00 60.65 59.69 2i3t s ILE 300 Cb -0.03 -0.26 0.00 0.00 1.25 0.00 0.00 42.46 43.42 2i3t s ILE 300 CO 0.02 -0.37 -0.04 0.00 0.24 0.00 0.00 174.94 174.78 2i3t s ALA 301 N -1.15 0.42 -0.06 2.27 0.00 0.10 -4.91 121.76 118.43 2i3t s ALA 301 Ca -0.13 -0.15 0.04 0.00 0.00 0.00 0.00 51.96 51.73 2i3t s ALA 301 Cb -0.08 -0.16 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 2i3t s ALA 301 CO -0.00 0.07 -0.18 0.00 0.00 0.00 0.00 175.76 175.64 2i3t n SER 303 N 2.72 1.97 0.10 0.00 2.88 -0.13 -4.83 113.62 116.33 2i3t n SER 303 Ca -0.17 -2.17 -0.04 0.00 -1.33 0.00 0.00 58.87 55.15 2i3t n SER 303 Cb 0.52 0.36 0.11 0.00 -0.75 0.00 0.00 64.21 64.45 2i3t n SER 303 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 2i3t h ASP 304 N 0.75 0.17 0.00 -3.46 3.32 -1.99 -3.37 116.42 111.83 2i3t h ASP 304 Ca -0.20 -0.10 -0.06 0.00 0.02 0.00 0.00 57.03 56.69 2i3t h ASP 304 Cb 0.66 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 2i3t h ASP 304 CO 0.32 0.78 -1.41 0.59 -1.72 0.00 0.00 179.24 177.80 2i3t n ASN 305 N -3.80 3.27 -4.35 6.45 4.13 -1.26 -4.89 115.26 114.81 2i3t n ASN 305 Ca -0.02 0.00 -0.18 0.00 1.68 0.00 0.00 54.58 56.06 2i3t n ASN 305 Cb 0.66 1.02 -0.10 0.00 -1.54 0.00 0.00 39.78 39.82 2i3t n ASN 305 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 2i3t s ILE 306 N -2.36 1.55 -0.16 2.41 -4.36 -1.26 -0.81 121.20 116.21 2i3t s ILE 306 Ca -0.03 -2.15 -0.00 0.00 -0.26 0.00 0.00 60.65 58.21 2i3t s ILE 306 Cb 0.04 -2.15 0.04 0.00 1.25 0.00 0.00 42.46 41.63 2i3t s ILE 306 CO 0.30 -0.51 -0.06 -0.22 0.24 0.00 0.00 174.94 174.69 2i3t s LEU 307 N -3.32 1.60 -0.18 0.37 0.20 -0.90 -0.95 118.68 115.49 2i3t s LEU 307 Ca 0.24 -0.62 -0.07 0.00 0.69 0.00 0.00 54.13 54.36 2i3t s LEU 307 Cb 0.02 -0.93 -0.04 0.00 -0.43 0.00 0.00 46.19 44.81 2i3t s LEU 307 CO 0.07 -0.17 0.07 0.00 -0.29 0.00 0.00 176.35 176.03 2i3t s LEU 309 N 0.29 2.49 -0.01 0.00 2.34 -0.31 -0.72 118.68 122.76 2i3t s LEU 309 Ca 0.04 -0.94 0.03 0.00 0.06 0.00 0.00 54.13 53.32 2i3t s LEU 309 Cb -0.12 -0.39 -0.01 0.00 -0.56 0.00 0.00 46.19 45.11 2i3t s LEU 309 CO 0.00 -0.28 -0.11 0.00 -1.06 0.00 0.00 176.35 174.90 2i3t s ALA 310 N -2.94 0.94 -0.07 1.48 0.00 -0.25 -1.00 121.76 119.91 2i3t s ALA 310 Ca 0.14 -0.50 0.03 0.00 0.00 0.00 0.00 51.96 51.63 2i3t s ALA 310 Cb 0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 2i3t s ALA 310 CO 0.01 0.22 -0.16 0.95 0.00 0.00 0.00 175.76 176.79 2i3t s THR 311 N -0.31 2.86 0.08 0.00 -4.23 0.11 -1.34 115.64 112.81 2i3t s THR 311 Ca 0.04 -0.78 -0.04 0.00 -1.18 0.00 0.00 61.69 59.73 2i3t s THR 311 Cb -0.05 -2.13 -0.03 0.00 1.34 0.00 0.00 72.50 71.64 2i3t s THR 311 CO -0.00 0.57 0.07 -0.44 -0.54 0.00 0.00 174.62 174.27 2i3t s SER 312 N -0.37 0.33 -0.44 3.99 0.01 -0.44 -1.41 113.70 115.37 2i3t s SER 312 Ca 0.04 -0.92 -0.25 0.00 1.31 0.00 0.00 55.95 56.13 2i3t s SER 312 Cb -0.12 0.27 0.02 0.00 0.21 0.00 0.00 66.02 66.40 2i3t s SER 312 CO 0.02 -0.67 0.87 -0.62 0.41 0.00 0.00 173.24 173.25 2i3t s ASP 313 N -2.92 6.50 -0.21 2.44 -1.08 -1.26 -2.56 116.67 117.58 2i3t s ASP 313 Ca 0.09 0.14 0.14 0.00 -0.52 0.00 0.00 52.55 52.40 2i3t s ASP 313 Cb 0.07 -2.43 0.44 0.00 -1.46 0.00 0.00 42.92 39.53 2i3t s ASP 313 CO -0.08 -0.96 1.32 -0.90 0.52 0.00 0.00 175.17 175.07 2i3t n ASP 314 N 6.92 2.56 0.16 -0.34 3.85 -1.26 -4.67 116.55 123.78 2i3t n ASP 314 Ca 0.05 -3.47 0.12 0.00 -0.71 0.00 0.00 54.79 50.77 2i3t n ASP 314 Cb 0.48 -0.54 0.57 0.00 -1.35 0.00 0.00 41.12 40.29 2i3t n ASP 314 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 2i3t n THR 315 N -1.08 0.94 0.32 2.12 -2.24 -1.26 -1.65 114.28 111.43 2i3t n THR 315 Ca 0.23 0.57 0.20 0.00 -2.27 0.00 0.00 64.05 62.78 2i3t n THR 315 Cb 0.82 -1.55 1.09 0.00 -2.10 0.00 0.00 70.33 68.60 2i3t n THR 315 CO 0.00 0.00 0.00 2.19 -0.57 0.00 0.00 175.07 176.69 2i3t h PHE 316 N 0.00 0.00 0.00 4.78 -0.00 -1.99 -0.10 116.94 119.62 2i3t h PHE 316 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 2i3t h PHE 316 Cb 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.08 2i3t h PHE 316 CO 0.00 0.01 0.00 0.36 -0.00 0.00 0.00 178.31 178.68 2i3t n LYS 317 N -3.29 0.11 -0.01 6.09 2.85 -0.66 -1.92 118.16 121.33 2i3t n LYS 317 Ca -0.03 0.22 0.08 0.00 -1.05 0.00 0.00 58.31 57.53 2i3t n LYS 317 Cb 0.10 -1.50 -0.12 0.00 -0.65 0.00 0.00 35.03 32.86 2i3t n LYS 317 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 2i3t n THR 318 N -1.37 0.00 -1.30 0.58 -1.04 -0.05 -5.02 114.28 106.07 2i3t n THR 318 Ca 0.05 -0.29 -0.38 0.00 -2.04 0.00 0.00 64.05 61.39 2i3t n THR 318 Cb 0.11 0.42 0.04 0.00 -1.82 0.00 0.00 70.33 69.08 2i3t n THR 318 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2i3t n ASN 319 N -1.85 -2.20 -0.03 8.00 4.13 -0.81 -4.92 115.26 117.58 2i3t n ASN 319 Ca -0.01 0.62 -0.16 0.00 1.68 0.00 0.00 54.58 56.72 2i3t n ASN 319 Cb 0.38 -1.07 -0.09 0.00 -1.54 0.00 0.00 39.78 37.47 2i3t n ASN 319 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2i3t h ALA 320 N -0.12 0.18 -3.48 5.41 0.00 -1.95 -3.46 119.26 115.84 2i3t h ALA 320 Ca -0.44 -0.50 -0.37 0.00 0.00 0.00 0.00 54.91 53.61 2i3t h ALA 320 Cb 1.39 -0.01 -0.23 0.00 0.00 0.00 0.00 17.79 18.94 2i3t h ALA 320 CO 0.42 0.35 -0.77 0.00 0.00 0.00 0.00 179.25 179.25 2i3t s ALA 321 N -3.66 0.90 0.24 0.00 0.00 -1.26 -5.06 121.76 112.92 2i3t s ALA 321 Ca -0.13 -0.79 -0.05 0.00 0.00 0.00 0.00 51.96 50.99 2i3t s ALA 321 Cb 0.05 -0.08 0.39 0.00 0.00 0.00 0.00 23.12 23.48 2i3t s ALA 321 CO 0.82 0.11 1.79 0.97 0.00 0.00 0.00 175.76 179.45 2i3t h ILE 322 N 4.50 0.85 0.00 0.00 -0.00 -1.96 -1.91 117.51 118.99 2i3t h ILE 322 Ca -0.37 -0.23 0.00 0.00 -0.00 0.00 0.00 64.86 64.26 2i3t h ILE 322 Cb 1.19 0.11 0.00 0.00 -0.00 0.00 0.00 36.82 38.13 2i3t h ILE 322 CO 0.42 0.12 0.00 -0.90 -0.00 0.00 0.00 178.15 177.80 2i3t n ASP 323 N -4.82 0.00 -4.76 2.19 5.75 -1.26 -4.87 116.55 108.79 2i3t n ASP 323 Ca 0.13 -1.31 -0.36 0.00 -0.01 0.00 0.00 54.79 53.23 2i3t n ASP 323 Cb 0.30 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.41 2i3t n ASP 323 CO 0.00 0.00 0.00 -1.58 -0.11 0.00 0.00 177.20 175.51 2i3t s GLN 324 N -2.00 3.15 1.18 0.11 0.74 -0.72 -5.00 119.66 117.12 2i3t s GLN 324 Ca 0.05 1.85 -0.16 0.00 0.05 0.00 0.00 55.36 57.15 2i3t s GLN 324 Cb 0.02 -2.05 0.23 0.00 1.10 0.00 0.00 33.01 32.32 2i3t s GLN 324 CO 0.04 -1.07 0.59 2.41 -0.55 0.00 0.00 175.29 176.71 2i3t n THR 325 N -1.33 0.00 -3.63 -0.34 -1.04 -1.26 -5.04 114.28 101.65 2i3t n THR 325 Ca 0.12 -0.40 -0.15 0.00 -2.04 0.00 0.00 64.05 61.58 2i3t n THR 325 Cb 0.49 -0.83 -0.14 0.00 -1.82 0.00 0.00 70.33 68.03 2i3t n THR 325 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2i3t s ILE 326 N -2.31 -0.37 -0.72 12.58 1.01 -1.26 -5.07 121.20 125.07 2i3t s ILE 326 Ca 0.63 0.22 0.04 0.00 0.00 0.00 0.00 60.65 61.55 2i3t s ILE 326 Cb -0.19 -0.46 0.20 0.00 0.01 0.00 0.00 42.46 42.02 2i3t s ILE 326 CO 0.65 0.06 0.62 1.21 0.00 0.00 0.00 174.94 177.48 2i3t n GLU 327 N 5.34 2.17 -3.27 2.79 4.07 -1.26 -5.09 120.64 125.39 2i3t n GLU 327 Ca -0.06 -4.55 -0.38 0.00 -0.06 0.00 0.00 57.16 52.11 2i3t n GLU 327 Cb 0.50 -2.30 -0.06 0.00 -0.06 0.00 0.00 31.44 29.52 2i3t n GLU 327 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 2i3t s LEU 328 N -1.78 4.35 0.93 4.31 1.02 -1.26 -5.08 118.68 121.17 2i3t s LEU 328 Ca 0.30 0.98 -0.11 0.00 0.02 0.00 0.00 54.13 55.31 2i3t s LEU 328 Cb 0.01 -2.80 0.15 0.00 0.02 0.00 0.00 46.19 43.58 2i3t s LEU 328 CO -0.12 0.06 1.09 0.20 0.02 0.00 0.00 176.35 177.60 2i3t s ASN 329 N 0.19 3.00 0.42 2.29 0.01 -1.26 -4.99 114.94 114.61 2i3t s ASN 329 Ca 0.28 1.71 -0.23 0.00 -0.71 0.00 0.00 52.86 53.91 2i3t s ASN 329 Cb -0.17 -2.34 -0.09 0.00 0.41 0.00 0.00 41.25 39.07 2i3t s ASN 329 CO 0.14 -2.97 1.03 0.00 -1.51 0.00 0.00 177.10 173.79 2i3t s ALA 330 N -2.77 3.03 0.85 0.60 0.00 -1.26 -4.35 121.76 117.86 2i3t s ALA 330 Ca 0.65 0.63 -0.12 0.00 0.00 0.00 0.00 51.96 53.12 2i3t s ALA 330 Cb -0.20 -3.25 0.10 0.00 0.00 0.00 0.00 23.12 19.77 2i3t s ALA 330 CO 0.58 -0.17 1.12 -1.12 0.00 0.00 0.00 175.76 176.17 2i3t s SER 331 N -1.76 4.02 0.03 0.00 0.01 0.10 -4.79 113.70 111.30 2i3t s SER 331 Ca 0.60 1.15 -0.01 0.00 1.31 0.00 0.00 55.95 59.00 2i3t s SER 331 Cb -0.19 -1.81 -0.02 0.00 0.21 0.00 0.00 66.02 64.21 2i3t s SER 331 CO 0.23 -2.25 -0.01 -0.44 0.41 0.00 0.00 173.24 171.19 2i3t s SER 332 N -3.95 0.31 -0.01 2.44 0.01 -0.50 -4.78 113.70 107.22 2i3t s SER 332 Ca 0.62 -0.66 0.02 0.00 1.31 0.00 0.00 55.95 57.24 2i3t s SER 332 Cb -0.15 0.15 -0.00 0.00 0.21 0.00 0.00 66.02 66.24 2i3t s SER 332 CO 0.54 -0.43 -0.05 -0.63 0.41 0.00 0.00 173.24 173.08 2i3t s ILE 333 N -2.42 0.41 0.07 1.44 1.01 -1.26 -0.71 121.20 119.73 2i3t s ILE 333 Ca -0.07 -0.21 0.01 0.00 0.00 0.00 0.00 60.65 60.38 2i3t s ILE 333 Cb -0.03 -0.36 -0.04 0.00 0.01 0.00 0.00 42.46 42.05 2i3t s ILE 333 CO -0.04 0.12 -0.05 -0.31 0.00 0.00 0.00 174.94 174.65 2i3t s TYR 334 N -0.04 0.69 -0.10 3.97 1.51 -0.17 -0.60 117.35 122.61 2i3t s TYR 334 Ca 0.01 -0.84 0.03 0.00 -1.01 0.00 0.00 57.07 55.26 2i3t s TYR 334 Cb -0.03 -0.43 0.01 0.00 -0.11 0.00 0.00 41.96 41.40 2i3t s TYR 334 CO -0.00 -0.20 -0.19 0.42 -1.11 0.00 0.00 175.55 174.47 2i3t s ILE 335 N -3.06 1.70 -0.49 2.71 1.01 -0.77 -1.16 121.20 121.13 2i3t s ILE 335 Ca 0.04 -0.79 -0.17 0.00 0.00 0.00 0.00 60.65 59.73 2i3t s ILE 335 Cb 0.02 -1.51 0.07 0.00 0.01 0.00 0.00 42.46 41.05 2i3t s ILE 335 CO -0.05 0.48 0.50 -0.63 0.00 0.00 0.00 174.94 175.25 2i3t s ILE 336 N 0.68 5.07 -0.03 2.92 -1.09 0.11 -2.13 121.20 126.73 2i3t s ILE 336 Ca -0.12 -0.86 -0.29 0.00 -2.23 0.00 0.00 60.65 57.14 2i3t s ILE 336 Cb -0.16 -4.22 -0.03 0.00 -1.58 0.00 0.00 42.46 36.47 2i3t s ILE 336 CO 0.03 -0.71 0.96 -0.36 -1.23 0.00 0.00 174.94 173.63 2i3t s PHE 337 N 2.07 3.61 -1.08 3.97 0.08 0.27 -2.12 117.98 124.79 2i3t s PHE 337 Ca 0.09 1.63 -0.04 0.00 0.12 0.00 0.00 56.93 58.73 2i3t s PHE 337 Cb -0.23 -3.11 -0.05 0.00 -0.57 0.00 0.00 43.02 39.07 2i3t s PHE 337 CO 0.08 -0.06 0.93 -0.25 -0.10 0.00 0.00 175.22 175.82 2i3t n ASP 338 N 4.19 -5.08 0.06 1.36 10.43 0.01 -0.97 116.55 126.54 2i3t n ASP 338 Ca 0.06 -0.67 0.11 0.00 2.57 0.00 0.00 54.79 56.87 2i3t n ASP 338 Cb 0.50 -5.10 0.45 0.00 1.84 0.00 0.00 41.12 38.81 2i3t n ASP 338 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2i3t n TYR 339 N -3.48 0.41 -1.67 1.24 0.18 -1.25 -3.43 117.16 109.16 2i3t n TYR 339 Ca -0.14 0.14 0.00 0.00 1.88 0.00 0.00 57.90 59.78 2i3t n TYR 339 Cb 0.63 -0.73 0.00 0.00 -0.38 0.00 0.00 39.34 38.87 2i3t n TYR 339 CO 0.00 0.00 0.00 -0.85 -2.08 0.00 0.00 176.86 173.93