#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 0.50 -0.33 2.12 0.74 -0.20 -4.97 119.66 117.52 2i3t s GLN 2 Ca 0.00 0.00 -0.12 0.00 0.05 0.00 0.00 55.36 55.29 2i3t s GLN 2 Cb 0.00 -0.60 -0.02 0.00 1.10 0.00 0.00 33.01 33.49 2i3t s GLN 2 CO 0.00 -0.11 0.22 0.42 -0.55 0.00 0.00 175.29 175.28 2i3t s ILE 3 N 0.94 5.18 -0.13 -2.34 1.01 -1.26 -0.58 121.20 124.02 2i3t s ILE 3 Ca -0.11 -0.21 0.02 0.00 0.00 0.00 0.00 60.65 60.35 2i3t s ILE 3 Cb -0.14 -3.64 0.01 0.00 0.01 0.00 0.00 42.46 38.71 2i3t s ILE 3 CO -0.01 0.03 -0.19 0.54 0.00 0.00 0.00 174.94 175.31 2i3t s VAL 4 N 1.71 1.81 0.26 2.92 0.11 -0.88 -4.98 120.40 121.34 2i3t s VAL 4 Ca 0.06 -0.82 -0.27 0.00 -2.93 0.00 0.00 61.98 58.02 2i3t s VAL 4 Cb -0.17 -1.63 -0.09 0.00 -1.53 0.00 0.00 36.38 32.96 2i3t s VAL 4 CO 0.10 0.50 0.90 -1.58 -3.33 0.00 0.00 175.10 171.69 2i3t s GLN 5 N 1.00 4.66 0.08 1.54 0.74 -1.26 -1.87 119.66 124.55 2i3t s GLN 5 Ca -0.04 1.33 -0.30 0.00 0.05 0.00 0.00 55.36 56.40 2i3t s GLN 5 Cb -0.15 -3.07 -0.05 0.00 1.10 0.00 0.00 33.01 30.84 2i3t s GLN 5 CO -0.04 0.43 0.95 0.42 -0.55 0.00 0.00 175.29 176.50 2i3t s ILE 6 N -1.36 4.61 -0.03 -2.34 1.01 0.32 -4.94 121.20 118.47 2i3t s ILE 6 Ca 0.44 2.03 0.10 0.00 0.00 0.00 0.00 60.65 63.21 2i3t s ILE 6 Cb -0.22 -4.30 -0.23 0.00 0.01 0.00 0.00 42.46 37.71 2i3t s ILE 6 CO 0.27 0.28 0.71 -0.33 0.00 0.00 0.00 174.94 175.87 2i3t h GLU 7 N 5.88 0.03 -3.54 2.79 4.39 -1.91 -3.41 114.58 118.80 2i3t h GLU 7 Ca -0.42 -0.05 -0.79 0.00 0.34 0.00 0.00 59.36 58.44 2i3t h GLU 7 Cb 1.21 0.02 -0.25 0.00 -0.10 0.00 0.00 28.75 29.63 2i3t h GLU 7 CO 0.72 0.61 0.90 1.04 -1.16 0.00 0.00 179.01 181.13 2i3t n GLN 8 N -3.12 3.82 -4.58 2.33 6.02 -1.26 -5.01 117.38 115.58 2i3t n GLN 8 Ca -0.16 -4.28 -0.29 0.00 -0.01 0.00 0.00 57.00 52.26 2i3t n GLN 8 Cb 1.04 -2.66 -0.14 0.00 1.02 0.00 0.00 30.24 29.50 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 -1.10 2.35 0.60 -1.58 0.00 -1.26 -4.94 121.76 115.83 2i3t s ALA 9 Ca 0.34 -1.39 -0.19 0.00 0.00 0.00 0.00 51.96 50.72 2i3t s ALA 9 Cb -0.02 -0.43 -0.04 0.00 0.00 0.00 0.00 23.12 22.63 2i3t s ALA 9 CO 0.00 0.54 1.12 -2.30 0.00 0.00 0.00 175.76 175.12 2i3t n PRO 10 N 1.23 1.08 0.04 0.00 -0.02 -1.26 -4.90 135.00 131.17 2i3t n PRO 10 Ca -0.17 0.41 -0.12 0.00 -2.02 0.00 0.00 63.50 61.60 2i3t n PRO 10 Cb 0.53 -2.33 -0.14 0.00 -0.02 0.00 0.00 33.50 31.54 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 0.65 0.12 -7.34 -0.52 1.79 -1.96 -3.33 116.57 105.98 2i3t h LYS 11 Ca -0.49 -0.21 -0.48 0.00 -2.18 0.00 0.00 60.65 57.29 2i3t h LYS 11 Cb 1.35 0.08 0.15 0.00 -1.58 0.00 0.00 32.23 32.22 2i3t h LYS 11 CO 0.52 0.93 0.24 0.34 -1.08 0.00 0.00 179.45 180.40 2i3t s ASP 12 N -6.69 3.30 0.29 0.86 -1.08 -1.26 -0.86 116.67 111.23 2i3t s ASP 12 Ca -0.06 1.41 -0.28 0.00 -0.52 0.00 0.00 52.55 53.10 2i3t s ASP 12 Cb 0.08 -2.09 -0.14 0.00 -1.46 0.00 0.00 42.92 39.31 2i3t s ASP 12 CO 0.84 -2.74 1.07 0.00 0.52 0.00 0.00 175.17 174.86 2i3t n TYR 13 N -3.94 1.46 -3.82 -5.34 4.19 -1.26 -4.51 117.16 103.94 2i3t n TYR 13 Ca 0.07 0.67 -0.35 0.00 3.31 0.00 0.00 57.90 61.60 2i3t n TYR 13 Cb 0.56 -2.28 -0.08 0.00 0.49 0.00 0.00 39.34 38.02 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 -1.00 5.26 -0.05 2.97 1.01 -1.26 -0.88 121.20 127.24 2i3t s ILE 14 Ca 0.59 0.13 0.18 0.00 0.00 0.00 0.00 60.65 61.55 2i3t s ILE 14 Cb -0.68 -3.38 -0.27 0.00 0.01 0.00 0.00 42.46 38.14 2i3t s ILE 14 CO 0.60 0.46 0.33 -1.54 0.00 0.00 0.00 174.94 174.79 2i3t n SER 15 N 3.36 0.87 -3.48 3.58 3.41 -0.07 -4.83 113.62 116.46 2i3t n SER 15 Ca -0.17 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.30 2i3t n SER 15 Cb 0.52 1.65 -0.04 0.00 -0.26 0.00 0.00 64.21 66.08 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 -4.27 -0.60 -0.05 4.04 -1.08 -1.18 -4.70 116.67 108.82 2i3t s ASP 16 Ca -0.07 0.37 -0.02 0.00 -0.52 0.00 0.00 52.55 52.32 2i3t s ASP 16 Cb 0.10 0.56 0.04 0.00 -1.46 0.00 0.00 42.92 42.15 2i3t s ASP 16 CO 0.74 -0.76 0.09 -0.63 0.52 0.00 0.00 175.17 175.13 2i3t s ILE 17 N -2.37 -0.11 -0.03 4.11 1.01 -1.26 -2.32 121.20 120.22 2i3t s ILE 17 Ca -0.05 0.29 0.02 0.00 0.00 0.00 0.00 60.65 60.92 2i3t s ILE 17 Cb -0.00 -0.18 0.01 0.00 0.01 0.00 0.00 42.46 42.29 2i3t s ILE 17 CO -0.01 0.12 -0.09 -0.54 0.00 0.00 0.00 174.94 174.42 2i3t s LYS 18 N 1.65 1.06 -0.15 2.79 -0.14 -0.46 -4.72 119.74 119.77 2i3t s LYS 18 Ca -0.03 -0.31 -0.05 0.00 -1.36 0.00 0.00 55.97 54.22 2i3t s LYS 18 Cb -0.12 -0.97 -0.04 0.00 -1.68 0.00 0.00 37.83 35.02 2i3t s LYS 18 CO -0.04 0.09 0.04 0.42 -0.76 0.00 0.00 175.35 175.10 2i3t s ILE 19 N 0.30 4.58 -0.83 2.17 1.01 -1.26 -0.16 121.20 127.00 2i3t s ILE 19 Ca -0.05 -0.12 -0.01 0.00 0.00 0.00 0.00 60.65 60.47 2i3t s ILE 19 Cb -0.10 -3.01 0.21 0.00 0.01 0.00 0.00 42.46 39.56 2i3t s ILE 19 CO 0.01 0.52 0.70 -0.63 0.00 0.00 0.00 174.94 175.54 2i3t s ILE 20 N -0.10 4.09 0.25 2.92 1.01 -0.20 -4.96 121.20 124.22 2i3t s ILE 20 Ca 0.06 -3.80 -0.04 0.00 0.00 0.00 0.00 60.65 56.87 2i3t s ILE 20 Cb -0.12 -3.57 0.26 0.00 0.01 0.00 0.00 42.46 39.04 2i3t s ILE 20 CO 0.01 -1.05 1.67 1.55 0.00 0.00 0.00 174.94 177.13 2i3t h PRO 21 N 6.07 0.23 -1.00 2.79 0.13 -1.95 -0.57 132.00 137.70 2i3t h PRO 21 Ca 0.13 -0.01 0.18 0.00 -0.87 0.00 0.00 66.00 65.43 2i3t h PRO 21 Cb 0.82 -0.05 -0.11 0.00 0.13 0.00 0.00 31.00 31.80 2i3t h PRO 21 CO 0.82 0.15 0.61 0.66 -0.23 0.00 0.00 178.00 180.00 2i3t h SER 22 N 0.24 0.79 -0.38 1.44 4.64 -1.96 -1.72 113.55 116.59 2i3t h SER 22 Ca 0.45 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.86 2i3t h SER 22 Cb 0.80 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 2i3t h SER 22 CO -0.56 0.29 0.00 0.29 -0.87 0.00 0.00 176.83 175.97 2i3t n LYS 23 N -4.76 2.44 -3.87 4.77 4.01 -0.84 -4.97 118.16 114.94 2i3t n LYS 23 Ca 0.23 -2.09 -0.30 0.00 -0.51 0.00 0.00 58.31 55.64 2i3t n LYS 23 Cb 0.55 -1.37 0.02 0.00 -0.51 0.00 0.00 35.03 33.72 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 0.94 -4.61 -4.89 4.39 7.64 -0.30 -4.89 113.62 111.89 2i3t n SER 24 Ca 0.15 -0.75 -0.21 0.00 1.01 0.00 0.00 58.87 59.06 2i3t n SER 24 Cb 0.48 -3.70 -0.03 0.00 -1.01 0.00 0.00 64.21 59.94 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 -7.19 4.01 -0.07 -3.43 1.43 -0.71 -1.80 118.68 110.91 2i3t s LEU 25 Ca 0.64 -0.14 -0.01 0.00 -1.03 0.00 0.00 54.13 53.59 2i3t s LEU 25 Cb -0.33 -2.56 0.03 0.00 0.03 0.00 0.00 46.19 43.36 2i3t s LEU 25 CO 0.79 -0.10 0.01 -0.22 0.23 0.00 0.00 176.35 177.06 2i3t s LEU 26 N -3.93 0.56 -0.18 1.79 2.96 -0.70 -1.03 118.68 118.16 2i3t s LEU 26 Ca 0.35 -0.07 -0.08 0.00 -0.22 0.00 0.00 54.13 54.11 2i3t s LEU 26 Cb -0.08 -0.42 -0.04 0.00 0.50 0.00 0.00 46.19 46.15 2i3t s LEU 26 CO 0.27 -0.20 0.07 -0.76 -1.32 0.00 0.00 176.35 174.42 2i3t s LEU 27 N 1.97 3.88 -0.05 -0.68 1.43 0.78 -1.21 118.68 124.81 2i3t s LEU 27 Ca 0.05 0.11 -0.00 0.00 -1.03 0.00 0.00 54.13 53.26 2i3t s LEU 27 Cb -0.12 -1.98 0.03 0.00 0.03 0.00 0.00 46.19 44.14 2i3t s LEU 27 CO -0.05 0.18 -0.01 -0.63 0.23 0.00 0.00 176.35 176.07 2i3t s ILE 28 N 0.33 0.38 -0.10 -0.59 1.01 -0.68 -1.35 121.20 120.19 2i3t s ILE 28 Ca 0.04 0.04 -0.02 0.00 0.00 0.00 0.00 60.65 60.72 2i3t s ILE 28 Cb -0.12 -0.48 -0.03 0.00 0.01 0.00 0.00 42.46 41.84 2i3t s ILE 28 CO -0.00 0.22 -0.02 0.42 0.00 0.00 0.00 174.94 175.56 2i3t s THR 29 N 1.45 4.11 0.41 2.92 -4.23 -0.98 -1.14 115.64 118.18 2i3t s THR 29 Ca -0.03 -0.31 0.07 0.00 -1.18 0.00 0.00 61.69 60.24 2i3t s THR 29 Cb -0.13 -2.74 -0.08 0.00 1.34 0.00 0.00 72.50 70.89 2i3t s THR 29 CO -0.03 0.57 0.02 -0.55 -0.54 0.00 0.00 174.62 174.10 2i3t s SER 30 N -0.56 3.92 0.00 3.99 0.15 -0.64 -0.89 113.70 119.67 2i3t s SER 30 Ca 0.09 -1.36 0.29 0.00 0.70 0.00 0.00 55.95 55.68 2i3t s SER 30 Cb -0.12 -0.39 1.34 0.00 -1.71 0.00 0.00 66.02 65.14 2i3t s SER 30 CO 0.02 -0.46 1.93 0.79 1.20 0.00 0.00 173.24 176.71 2i3t n TRP 31 N -0.99 0.00 1.66 3.44 7.02 -0.06 -2.18 117.44 126.32 2i3t n TRP 31 Ca -0.05 0.00 0.10 0.00 -1.02 0.00 0.00 57.50 56.53 2i3t n TRP 31 Cb 0.67 -0.18 0.48 0.00 -2.42 0.00 0.00 31.31 29.85 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 -1.00 0.75 0.00 -0.99 3.85 -1.26 -4.29 116.55 113.60 2i3t n ASP 32 Ca 0.15 -1.54 0.00 0.00 -0.71 0.00 0.00 54.79 52.69 2i3t n ASP 32 Cb 0.26 -0.05 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 0.95 0.72 3.92 6.12 0.00 -1.16 -4.75 105.19 110.98 2i3t n GLY 33 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.21 6.39 -0.27 1.61 1.04 -1.26 0.77 113.70 119.78 2i3t s SER 34 Ca 0.00 0.36 0.01 0.00 0.48 0.00 0.00 55.95 56.80 2i3t s SER 34 Cb 0.00 -1.99 0.07 0.00 0.10 0.00 0.00 66.02 64.20 2i3t s SER 34 CO 0.00 0.09 -0.02 -0.22 0.98 0.00 0.00 173.24 174.07 2i3t s LEU 35 N -2.76 3.07 -0.13 2.42 2.96 0.98 -1.62 118.68 123.60 2i3t s LEU 35 Ca 0.37 -1.45 -0.03 0.00 -0.22 0.00 0.00 54.13 52.81 2i3t s LEU 35 Cb -0.12 -1.28 -0.03 0.00 0.50 0.00 0.00 46.19 45.26 2i3t s LEU 35 CO 0.27 -0.28 -0.04 0.28 -1.32 0.00 0.00 176.35 175.27 2i3t s THR 36 N 1.29 3.93 -0.21 3.68 -1.32 -0.29 -0.79 115.64 121.93 2i3t s THR 36 Ca -0.01 -0.36 -0.06 0.00 -1.21 0.00 0.00 61.69 60.05 2i3t s THR 36 Cb -0.19 -2.69 -0.03 0.00 -1.51 0.00 0.00 72.50 68.08 2i3t s THR 36 CO -0.09 0.53 0.03 -0.69 -2.21 0.00 0.00 174.62 172.20 2i3t s VAL 37 N -0.06 4.25 0.38 5.08 1.01 -0.72 -1.69 120.40 128.64 2i3t s VAL 37 Ca 0.02 -0.21 0.08 0.00 0.00 0.00 0.00 61.98 61.87 2i3t s VAL 37 Cb -0.13 -2.94 -0.05 0.00 0.00 0.00 0.00 36.38 33.26 2i3t s VAL 37 CO 0.03 0.41 0.17 -0.31 0.00 0.00 0.00 175.10 175.39 2i3t s TYR 38 N 1.02 2.65 -0.06 5.22 1.51 -0.35 -1.00 117.35 126.34 2i3t s TYR 38 Ca 0.03 -0.49 0.01 0.00 -1.01 0.00 0.00 57.07 55.62 2i3t s TYR 38 Cb -0.14 -1.81 0.02 0.00 -0.11 0.00 0.00 41.96 39.91 2i3t s TYR 38 CO 0.02 0.24 -0.08 0.21 -1.11 0.00 0.00 175.55 174.84 2i3t s LYS 39 N -3.88 1.31 0.26 -0.62 2.36 -0.52 -1.72 119.74 116.93 2i3t s LYS 39 Ca 0.40 -0.26 0.12 0.00 -2.55 0.00 0.00 55.97 53.68 2i3t s LYS 39 Cb 0.00 -1.20 -0.05 0.00 -1.05 0.00 0.00 37.83 35.54 2i3t s LYS 39 CO 0.23 -0.06 -0.21 -0.59 1.55 0.00 0.00 175.35 176.27 2i3t s PHE 40 N 0.93 2.27 -0.20 4.03 -0.12 -0.74 -0.34 117.98 123.81 2i3t s PHE 40 Ca -0.10 -0.34 -0.01 0.00 -0.05 0.00 0.00 56.93 56.42 2i3t s PHE 40 Cb -0.15 -1.01 0.06 0.00 -0.63 0.00 0.00 43.02 41.29 2i3t s PHE 40 CO 0.01 0.67 -0.00 0.34 -0.05 0.00 0.00 175.22 176.18 2i3t s ASP 41 N -3.36 3.18 0.34 1.98 3.68 0.07 -4.84 116.67 117.72 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 -0.05 -0.82 0.64 0.00 -1.45 0.00 0.00 42.92 41.23 2i3t s ASP 41 CO 0.14 -0.27 1.97 0.16 0.13 0.00 0.00 175.17 177.30 2i3t h ILE 42 N 6.55 1.09 0.48 4.11 -2.65 -1.97 0.73 117.51 125.85 2i3t h ILE 42 Ca -0.18 -0.30 -0.02 0.00 1.03 0.00 0.00 64.86 65.39 2i3t h ILE 42 Cb 1.10 0.14 0.00 0.00 -2.05 0.00 0.00 36.82 36.02 2i3t h ILE 42 CO 0.37 0.16 -0.23 1.56 0.03 0.00 0.00 178.15 180.04 2i3t h GLN 43 N 0.88 -0.62 0.00 0.16 1.08 -1.97 -3.27 115.11 111.37 2i3t h GLN 43 Ca 0.30 0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.53 2i3t h GLN 43 Cb 0.10 0.14 -0.00 0.00 -0.05 0.00 0.00 27.48 27.67 2i3t h GLN 43 CO -0.09 -0.33 -0.06 0.00 -0.95 0.00 0.00 178.83 177.40 2i3t h ALA 44 N -0.88 1.00 -4.25 3.87 0.00 -1.96 -3.47 119.26 113.56 2i3t h ALA 44 Ca -0.07 -0.06 -0.30 0.00 0.00 0.00 0.00 54.91 54.49 2i3t h ALA 44 Cb 0.57 -0.01 0.09 0.00 0.00 0.00 0.00 17.79 18.44 2i3t h ALA 44 CO 0.11 0.08 -0.49 1.63 0.00 0.00 0.00 179.25 180.57 2i3t n LYS 45 N -3.16 -5.24 -4.28 0.00 4.01 0.25 -5.02 118.16 104.71 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 29.76 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 1.81 -0.02 4.39 4.22 -1.16 -4.93 114.94 116.17 2i3t s ASN 46 Ca 0.37 -1.09 0.00 0.00 -2.14 0.00 0.00 52.86 50.00 2i3t s ASN 46 Cb -0.16 -0.00 0.02 0.00 1.28 0.00 0.00 41.25 42.39 2i3t s ASN 46 CO 0.46 -0.40 0.01 0.54 -2.04 0.00 0.00 177.10 175.68 2i3t s VAL 47 N -3.36 0.03 -0.05 3.54 0.11 -1.26 -0.75 120.40 118.65 2i3t s VAL 47 Ca 0.21 0.13 0.06 0.00 -2.93 0.00 0.00 61.98 59.46 2i3t s VAL 47 Cb 0.04 -0.12 -0.01 0.00 -1.53 0.00 0.00 36.38 34.75 2i3t s VAL 47 CO 0.04 0.09 -0.25 -1.81 -3.33 0.00 0.00 175.10 169.83 2i3t s ASP 48 N 0.82 3.04 0.15 3.54 1.01 0.54 -4.92 116.67 120.86 2i3t s ASP 48 Ca -0.07 -0.50 -0.31 0.00 0.71 0.00 0.00 52.55 52.37 2i3t s ASP 48 Cb -0.10 -0.79 -0.09 0.00 1.01 0.00 0.00 42.92 42.95 2i3t s ASP 48 CO -0.02 0.25 1.44 -0.22 0.21 0.00 0.00 175.17 176.83 2i3t s LEU 49 N -0.20 4.38 -0.23 1.23 0.20 -1.26 -1.44 118.68 121.34 2i3t s LEU 49 Ca -0.02 2.44 -0.02 0.00 0.69 0.00 0.00 54.13 57.22 2i3t s LEU 49 Cb -0.13 -3.59 -0.14 0.00 -0.43 0.00 0.00 46.19 41.90 2i3t s LEU 49 CO 0.03 -0.69 -0.24 -0.11 -0.29 0.00 0.00 176.35 175.05 2i3t n LEU 50 N 3.69 2.60 -3.83 -0.68 7.94 -0.17 -4.91 117.00 121.65 2i3t n LEU 50 Ca 0.11 0.00 -0.07 0.00 -1.11 0.00 0.00 56.01 54.95 2i3t n LEU 50 Cb 0.41 -0.78 0.00 0.00 0.53 0.00 0.00 43.42 43.59 2i3t n LEU 50 CO 0.59 0.77 0.59 -1.58 -1.11 0.00 0.00 177.39 176.66 2i3t s GLN 51 N -2.45 1.80 -0.29 1.96 0.74 -1.00 -5.02 119.66 115.40 2i3t s GLN 51 Ca -0.32 -1.09 -0.16 0.00 0.05 0.00 0.00 55.36 53.84 2i3t s GLN 51 Cb 0.09 0.55 0.11 0.00 1.10 0.00 0.00 33.01 34.86 2i3t s GLN 51 CO 0.50 -0.83 0.81 0.45 -0.55 0.00 0.00 175.29 175.67 2i3t s SER 52 N -3.06 -0.77 -0.07 6.67 0.15 -1.26 -1.76 113.70 113.60 2i3t s SER 52 Ca 0.15 1.21 0.05 0.00 0.70 0.00 0.00 55.95 58.06 2i3t s SER 52 Cb -0.04 1.37 -0.01 0.00 -1.71 0.00 0.00 66.02 65.63 2i3t s SER 52 CO 0.08 -0.19 -0.23 -0.76 1.20 0.00 0.00 173.24 173.34 2i3t s LEU 53 N 1.61 2.19 -0.10 3.45 1.43 0.03 -4.95 118.68 122.34 2i3t s LEU 53 Ca -0.09 -0.47 0.02 0.00 -1.03 0.00 0.00 54.13 52.56 2i3t s LEU 53 Cb -0.05 -1.41 -0.02 0.00 0.03 0.00 0.00 46.19 44.74 2i3t s LEU 53 CO -0.18 0.24 -0.16 -0.60 0.23 0.00 0.00 176.35 175.88 2i3t s ARG 54 N -0.13 3.01 0.29 1.70 3.52 -1.26 -0.01 118.95 126.07 2i3t s ARG 54 Ca -0.04 -0.73 0.09 0.00 -0.13 0.00 0.00 55.73 54.92 2i3t s ARG 54 Cb -0.14 -2.47 -0.04 0.00 -1.56 0.00 0.00 34.95 30.73 2i3t s ARG 54 CO 0.04 0.34 0.04 -0.47 -0.81 0.00 0.00 175.30 174.45 2i3t s TYR 55 N -0.00 2.71 0.46 5.12 5.04 0.23 -4.95 117.35 125.96 2i3t s TYR 55 Ca -0.05 -0.27 0.15 0.00 -2.44 0.00 0.00 57.07 54.46 2i3t s TYR 55 Cb -0.14 -1.33 1.06 0.00 0.35 0.00 0.00 41.96 41.89 2i3t s TYR 55 CO 0.04 0.54 2.02 1.57 -1.34 0.00 0.00 175.55 178.38 2i3t h LYS 56 N 1.78 0.00 -6.35 4.97 2.10 -1.93 -3.41 116.57 113.72 2i3t h LYS 56 Ca -0.44 0.00 -0.60 0.00 -2.00 0.00 0.00 60.65 57.61 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 0.61 0.15 -0.67 -1.01 -2.00 0.00 0.00 179.45 176.53 2i3t s HIS 57 N -4.71 2.76 0.34 0.07 3.76 -1.26 -4.96 115.29 111.30 2i3t s HIS 57 Ca -0.04 -0.17 -0.29 0.00 -0.15 0.00 0.00 55.06 54.41 2i3t s HIS 57 Cb 0.16 -1.32 -0.11 0.00 1.11 0.00 0.00 32.58 32.42 2i3t s HIS 57 CO 0.69 0.53 1.49 -2.14 -0.85 0.00 0.00 174.74 174.46 2i3t s PRO 58 N -3.02 4.15 -0.14 8.40 0.02 -1.26 -4.13 135.00 139.01 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 -0.05 0.00 0.02 0.00 0.00 34.50 31.39 2i3t s PRO 58 CO 0.18 -0.51 0.35 -0.51 -0.33 0.00 0.00 177.00 176.17 2i3t s LEU 59 N -1.56 4.26 -0.02 -5.54 1.43 -0.93 -1.82 118.68 114.51 2i3t s LEU 59 Ca 0.55 0.61 0.21 0.00 -1.03 0.00 0.00 54.13 54.47 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 0.57 0.08 0.65 0.18 0.23 0.00 0.00 176.35 178.06 2i3t n LEU 60 N 3.54 0.45 -3.74 1.79 4.77 0.19 -4.25 117.00 119.75 2i3t n LEU 60 Ca -0.11 -0.24 -0.01 0.00 -0.03 0.00 0.00 56.01 55.63 2i3t n LEU 60 Cb 0.52 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.61 2i3t n LEU 60 CO 0.41 0.11 0.91 0.00 -1.33 0.00 0.00 177.39 177.49 2i3t s ASN 63 N -2.76 -0.07 0.10 0.00 3.84 -0.81 -4.72 114.94 110.52 2i3t s ASN 63 Ca 0.07 -0.52 -0.08 0.00 0.21 0.00 0.00 52.86 52.54 2i3t s ASN 63 Cb -0.02 0.46 -0.00 0.00 -0.55 0.00 0.00 41.25 41.14 2i3t s ASN 63 CO -0.04 -0.89 0.19 0.72 -2.79 0.00 0.00 177.10 174.29 2i3t s PHE 64 N -2.63 0.22 -0.13 0.43 -0.12 -1.26 -1.49 117.98 113.00 2i3t s PHE 64 Ca 0.17 -0.64 0.02 0.00 -0.05 0.00 0.00 56.93 56.44 2i3t s PHE 64 Cb -0.01 -0.08 0.01 0.00 -0.63 0.00 0.00 43.02 42.31 2i3t s PHE 64 CO 0.03 -0.56 -0.20 0.42 -0.05 0.00 0.00 175.22 174.86 2i3t s ILE 65 N -3.88 1.91 -0.39 -4.49 1.01 -0.80 -5.00 121.20 109.56 2i3t s ILE 65 Ca 0.07 -0.89 0.11 0.00 0.00 0.00 0.00 60.65 59.94 2i3t s ILE 65 Cb 0.05 -1.70 0.44 0.00 0.01 0.00 0.00 42.46 41.26 2i3t s ILE 65 CO -0.09 0.52 1.04 -0.67 0.00 0.00 0.00 174.94 175.74 2i3t n ASP 66 N 4.11 3.27 0.15 3.58 2.03 -1.26 -1.68 116.55 126.76 2i3t n ASP 66 Ca -0.20 -3.27 0.03 0.00 0.52 0.00 0.00 54.79 51.87 2i3t n ASP 66 Cb 0.51 -0.49 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 2.76 0.00 0.00 1.67 7.08 -1.97 -3.45 115.58 121.67 2i3t h ASN 67 Ca 0.12 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.34 2i3t h ASN 67 Cb 1.04 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.28 2i3t h ASN 67 CO 0.70 0.50 0.00 0.35 -2.08 0.00 0.00 177.43 176.90 2i3t n THR 68 N -3.36 0.00 -3.72 6.14 -2.24 -1.26 -5.09 114.28 104.76 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 68.80 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 -1.72 6.07 -0.01 3.42 1.11 -1.26 -5.05 116.67 119.22 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 -2.08 -0.06 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 0.00 175.17 177.71 2i3t s LEU 70 N 0.81 4.31 -0.08 1.23 2.96 -1.26 -4.55 118.68 122.11 2i3t s LEU 70 Ca 0.07 2.16 -0.00 0.00 -0.22 0.00 0.00 54.13 56.13 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 0.02 -0.79 -0.04 0.00 -1.32 0.00 0.00 176.35 174.22 2i3t s GLN 71 N 2.83 1.03 0.01 1.98 -2.07 -0.67 -5.01 119.66 117.76 2i3t s GLN 71 Ca 0.66 -0.09 -0.00 0.00 -1.82 0.00 0.00 55.36 54.11 2i3t s GLN 71 Cb -0.32 -1.18 -0.04 0.00 -1.09 0.00 0.00 33.01 30.38 2i3t s GLN 71 CO 0.27 -0.23 0.11 0.42 -1.32 0.00 0.00 175.29 174.54 2i3t s ILE 72 N 1.59 4.90 0.05 3.63 1.01 -1.26 -1.91 121.20 129.21 2i3t s ILE 72 Ca 0.01 -0.39 0.03 0.00 0.00 0.00 0.00 60.65 60.29 2i3t s ILE 72 Cb -0.13 -3.28 -0.02 0.00 0.01 0.00 0.00 42.46 39.04 2i3t s ILE 72 CO -0.05 0.31 -0.09 -0.31 0.00 0.00 0.00 174.94 174.80 2i3t s TYR 73 N -1.26 0.77 0.11 3.97 1.51 -0.56 -0.48 117.35 121.41 2i3t s TYR 73 Ca 0.25 -0.48 0.01 0.00 -1.01 0.00 0.00 57.07 55.84 2i3t s TYR 73 Cb -0.12 -0.46 -0.04 0.00 -0.11 0.00 0.00 41.96 41.23 2i3t s TYR 73 CO 0.17 -0.05 -0.03 0.14 -1.11 0.00 0.00 175.55 174.66 2i3t s VAL 74 N -1.31 0.52 -0.02 0.71 -7.23 -0.75 -1.93 120.40 110.38 2i3t s VAL 74 Ca -0.08 -1.91 0.08 0.00 -1.81 0.00 0.00 61.98 58.25 2i3t s VAL 74 Cb -0.10 -1.77 -0.02 0.00 0.56 0.00 0.00 36.38 35.05 2i3t s VAL 74 CO 0.01 -0.78 -0.26 -0.83 -0.31 0.00 0.00 175.10 172.93 2i3t s GLY 75 N -3.04 1.26 0.28 2.32 0.00 -0.64 -1.31 107.32 106.19 2i3t s GLY 75 Ca 0.15 -1.10 0.07 0.00 0.00 0.00 0.00 44.72 43.84 2i3t s GLY 75 CO -0.03 -0.88 0.20 -0.51 0.00 0.00 0.00 173.10 171.87 2i3t s THR 76 N -0.55 4.04 0.38 0.90 -4.23 -0.51 0.57 115.64 116.23 2i3t s THR 76 Ca 0.08 -1.45 0.27 0.00 -1.18 0.00 0.00 61.69 59.41 2i3t s THR 76 Cb -0.10 -3.27 0.29 0.00 1.34 0.00 0.00 72.50 70.76 2i3t s THR 76 CO -0.00 -0.30 2.05 0.58 -0.54 0.00 0.00 174.62 176.41 2i3t h VAL 77 N 1.46 0.54 0.00 2.29 2.07 -1.69 -1.48 116.25 119.43 2i3t h VAL 77 Ca -0.47 -0.59 0.00 0.00 0.82 0.00 0.00 66.70 66.46 2i3t h VAL 77 Cb 1.24 1.39 0.00 0.00 -1.52 0.00 0.00 31.29 32.41 2i3t h VAL 77 CO 0.60 0.12 0.00 0.00 0.02 0.00 0.00 177.57 178.32 2i3t n GLN 78 N -3.58 0.10 -0.10 1.57 1.13 -1.26 -2.00 117.38 113.24 2i3t n GLN 78 Ca -0.02 0.06 0.00 0.00 -1.94 0.00 0.00 57.00 55.10 2i3t n GLN 78 Cb 0.26 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.11 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 1.08 0.94 3.93 1.08 0.00 -0.60 -4.66 105.19 106.95 2i3t n GLY 79 Ca 0.08 -0.08 -0.28 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.35 3.42 -0.25 1.61 2.02 -1.26 -4.69 118.70 119.21 2i3t s GLU 80 Ca 0.00 -0.53 0.02 0.00 0.02 0.00 0.00 54.97 54.48 2i3t s GLU 80 Cb 0.00 -2.99 0.05 0.00 0.10 0.00 0.00 34.13 31.29 2i3t s GLU 80 CO 0.00 0.56 -0.12 0.42 0.02 0.00 0.00 175.26 176.15 2i3t s ILE 81 N -1.63 2.25 -0.07 -1.63 1.01 -1.26 -1.42 121.20 118.44 2i3t s ILE 81 Ca 0.35 -1.46 -0.02 0.00 0.00 0.00 0.00 60.65 59.51 2i3t s ILE 81 Cb -0.12 -2.24 -0.04 0.00 0.01 0.00 0.00 42.46 40.07 2i3t s ILE 81 CO 0.28 0.08 0.05 -0.76 0.00 0.00 0.00 174.94 174.59 2i3t s LEU 82 N 1.16 3.82 -0.06 2.97 1.43 -0.42 -0.95 118.68 126.62 2i3t s LEU 82 Ca -0.06 0.21 -0.21 0.00 -1.03 0.00 0.00 54.13 53.04 2i3t s LEU 82 Cb -0.19 -1.98 -0.04 0.00 0.03 0.00 0.00 46.19 44.01 2i3t s LEU 82 CO -0.06 0.36 0.60 -0.75 0.23 0.00 0.00 176.35 176.72 2i3t s LYS 83 N -1.13 4.37 -0.16 1.70 2.20 0.54 -1.82 119.74 125.44 2i3t s LYS 83 Ca 0.16 0.70 -0.08 0.00 -0.36 0.00 0.00 55.97 56.40 2i3t s LYS 83 Cb -0.12 -3.41 -0.04 0.00 -1.51 0.00 0.00 37.83 32.75 2i3t s LYS 83 CO 0.06 0.20 0.10 0.08 -0.36 0.00 0.00 175.35 175.42 2i3t s VAL 84 N 0.40 5.16 -0.27 4.02 1.01 0.37 -1.96 120.40 129.13 2i3t s VAL 84 Ca 0.32 0.09 -0.01 0.00 0.00 0.00 0.00 61.98 62.38 2i3t s VAL 84 Cb -0.17 -3.30 0.04 0.00 0.00 0.00 0.00 36.38 32.96 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 -0.17 4.53 0.21 3.32 -1.08 0.22 -4.28 116.67 119.42 2i3t s ASP 85 Ca 0.09 -1.15 0.08 0.00 -0.52 0.00 0.00 52.55 51.06 2i3t s ASP 85 Cb -0.12 -1.65 0.12 0.00 -1.46 0.00 0.00 42.92 39.82 2i3t s ASP 85 CO 0.01 -0.19 1.47 -0.07 0.52 0.00 0.00 175.17 176.91 2i3t h LEU 86 N 7.95 0.03 0.00 -1.34 3.38 -1.92 -3.41 115.31 120.00 2i3t h LEU 86 Ca -0.25 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 2i3t h LEU 86 Cb 1.07 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.81 2i3t h LEU 86 CO 0.53 0.79 -0.99 2.30 0.09 0.00 0.00 178.44 181.17 2i3t n ILE 87 N -3.64 1.49 -0.95 1.22 -5.35 -1.26 -5.06 119.36 105.82 2i3t n ILE 87 Ca -0.01 0.14 0.00 0.00 -0.27 0.00 0.00 62.75 62.60 2i3t n ILE 87 Cb 0.74 -2.34 0.00 0.00 -1.74 0.00 0.00 39.64 36.30 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 -1.20 3.18 3.28 0.00 -1.26 -5.07 105.19 105.58 2i3t n GLY 88 Ca -0.14 -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 -1.03 1.93 0.90 1.61 0.15 -1.26 -4.20 113.70 111.79 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 64.31 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 -1.21 1.25 0.07 5.44 0.02 -1.26 -5.09 135.00 134.23 2i3t s PRO 90 Ca 0.03 0.96 -0.07 0.00 0.02 0.00 0.00 61.00 61.94 2i3t s PRO 90 Cb -0.08 -1.80 -0.28 0.00 0.02 0.00 0.00 34.50 32.36 2i3t s PRO 90 CO 0.02 -2.28 1.13 0.77 -0.33 0.00 0.00 177.00 176.30 2i3t h SER 91 N -1.58 0.52 -4.14 2.53 0.02 -1.80 -3.40 113.55 105.69 2i3t h SER 91 Ca -0.49 -0.55 -0.63 0.00 -0.84 0.00 0.00 61.79 59.28 2i3t h SER 91 Cb 1.28 -0.17 -0.24 0.00 0.14 0.00 0.00 62.40 63.41 2i3t h SER 91 CO 0.52 1.42 -0.86 -0.36 -1.14 0.00 0.00 176.83 176.42 2i3t s PHE 92 N -2.69 2.08 -0.19 3.45 0.40 -1.26 -0.61 117.98 119.15 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 -1.17 0.09 0.00 0.51 0.00 0.00 43.02 42.51 2i3t s PHE 92 CO 0.90 0.21 0.30 -1.14 0.70 0.00 0.00 175.22 176.18 2i3t s GLN 93 N -1.67 0.23 0.19 0.44 0.74 -0.83 -4.92 119.66 113.84 2i3t s GLN 93 Ca 0.10 0.57 -0.31 0.00 0.05 0.00 0.00 55.36 55.78 2i3t s GLN 93 Cb -0.10 -0.43 -0.10 0.00 1.10 0.00 0.00 33.01 33.48 2i3t s GLN 93 CO 0.04 -0.47 1.50 0.00 -0.55 0.00 0.00 175.29 175.80 2i3t s ALA 94 N 2.45 3.70 0.53 1.58 0.00 -1.26 -0.34 121.76 128.42 2i3t s ALA 94 Ca 0.05 1.33 -0.17 0.00 0.00 0.00 0.00 51.96 53.17 2i3t s ALA 94 Cb -0.14 -3.59 -0.07 0.00 0.00 0.00 0.00 23.12 19.32 2i3t s ALA 94 CO -0.12 -0.75 1.01 -0.51 0.00 0.00 0.00 175.76 175.40 2i3t s LEU 95 N 0.55 3.64 0.61 0.00 1.43 -0.12 -4.91 118.68 119.87 2i3t s LEU 95 Ca 0.65 1.71 0.01 0.00 -1.03 0.00 0.00 54.13 55.47 2i3t s LEU 95 Cb -0.42 -4.53 0.07 0.00 0.03 0.00 0.00 46.19 41.34 2i3t s LEU 95 CO 0.36 -0.78 0.85 0.42 0.23 0.00 0.00 176.35 177.42 2i3t s THR 96 N -2.45 2.45 -1.28 5.49 -4.23 0.14 -4.43 115.64 111.33 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 -2.77 0.00 0.00 1.34 0.00 0.00 72.50 70.94 2i3t s THR 96 CO 0.30 0.00 0.00 0.59 -0.54 0.00 0.00 174.62 174.97 2i3t n ASN 97 N -2.49 -4.69 -4.59 3.99 3.02 -1.26 -0.63 115.26 108.61 2i3t n ASN 97 Ca 0.11 0.30 -0.43 0.00 -0.03 0.00 0.00 54.58 54.53 2i3t n ASN 97 Cb 0.60 -3.25 -0.04 0.00 -0.61 0.00 0.00 39.78 36.48 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 -2.75 6.61 0.00 6.41 2.47 -1.26 -4.62 114.94 121.80 2i3t s ASN 98 Ca 0.00 0.41 0.26 0.00 0.42 0.00 0.00 52.86 53.94 2i3t s ASN 98 Cb 0.00 -2.47 0.63 0.00 -1.45 0.00 0.00 41.25 37.96 2i3t s ASN 98 CO 0.00 -0.96 1.49 -0.62 -3.72 0.00 0.00 177.10 173.29 2i3t n GLU 99 N 7.01 0.19 -1.84 0.43 1.02 -1.26 -4.94 120.64 121.24 2i3t n GLU 99 Ca 0.07 -0.10 -0.41 0.00 -0.02 0.00 0.00 57.16 56.70 2i3t n GLU 99 Cb 0.48 -1.50 -0.00 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 -2.88 3.57 -0.10 0.62 0.00 -1.26 -4.93 121.76 116.78 2i3t s ALA 100 Ca 0.14 1.54 0.06 0.00 0.00 0.00 0.00 51.96 53.70 2i3t s ALA 100 Cb 0.18 -3.60 -0.10 0.00 0.00 0.00 0.00 23.12 19.60 2i3t s ALA 100 CO 0.65 -1.00 -0.00 0.09 0.00 0.00 0.00 175.76 175.49 2i3t n ASN 101 N 0.59 2.85 -4.96 0.00 3.02 -1.26 -4.86 115.26 110.64 2i3t n ASN 101 Ca 0.01 -0.01 -0.19 0.00 -0.03 0.00 0.00 54.58 54.36 2i3t n ASN 101 Cb 0.39 0.51 -0.01 0.00 -0.61 0.00 0.00 39.78 40.07 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 -4.90 3.69 0.53 3.41 1.43 -1.26 -4.61 118.68 116.96 2i3t s LEU 102 Ca -0.07 -0.43 -0.19 0.00 -1.03 0.00 0.00 54.13 52.41 2i3t s LEU 102 Cb 0.03 -2.52 -0.10 0.00 0.03 0.00 0.00 46.19 43.62 2i3t s LEU 102 CO 0.35 -0.61 0.44 0.61 0.23 0.00 0.00 176.35 177.37 2i3t n GLY 103 N -1.68 -1.74 3.48 -3.19 0.00 -0.85 -4.06 105.19 97.15 2i3t n GLY 103 Ca 0.04 -0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.71 4.44 -0.29 -0.61 -1.09 -0.93 -0.80 121.20 120.22 2i3t s ILE 104 Ca 0.66 -0.14 0.19 0.00 -2.23 0.00 0.00 60.65 59.13 2i3t s ILE 104 Cb -0.48 -4.57 0.17 0.00 -1.58 0.00 0.00 42.46 35.99 2i3t s ILE 104 CO 0.57 -1.22 1.44 0.00 -1.23 0.00 0.00 174.94 174.49 2i3t s ARG 106 N -3.11 0.73 -0.20 0.00 6.06 -1.17 -4.70 118.95 116.58 2i3t s ARG 106 Ca 0.04 0.67 -0.00 0.00 -2.50 0.00 0.00 55.73 53.94 2i3t s ARG 106 Cb 0.07 0.35 0.05 0.00 0.06 0.00 0.00 34.95 35.48 2i3t s ARG 106 CO 0.72 -0.12 -0.04 0.42 -2.50 0.00 0.00 175.30 173.78 2i3t s ILE 107 N -0.02 1.18 0.30 4.11 1.01 -1.26 -0.56 121.20 125.97 2i3t s ILE 107 Ca -0.03 -0.85 0.08 0.00 0.00 0.00 0.00 60.65 59.85 2i3t s ILE 107 Cb -0.04 -1.45 -0.04 0.00 0.01 0.00 0.00 42.46 40.95 2i3t s ILE 107 CO 0.02 -0.02 0.17 0.00 0.00 0.00 0.00 174.94 175.12 2i3t s LYS 109 N -3.85 4.35 -0.59 0.00 2.47 -1.26 -0.52 119.74 120.34 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 -0.05 -3.22 0.19 0.00 -1.46 0.00 0.00 37.83 33.29 2i3t s LYS 109 CO 0.24 -0.34 0.49 0.98 0.16 0.00 0.00 175.35 176.88 2i3t n TYR 110 N 3.22 1.85 -3.04 4.03 -0.00 -0.71 -4.72 117.16 117.78 2i3t n TYR 110 Ca 0.09 -3.95 0.00 0.00 -0.00 0.00 0.00 57.90 54.04 2i3t n TYR 110 Cb 0.42 -0.34 0.00 0.00 -0.00 0.00 0.00 39.34 39.42 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 2.00 -0.66 0.24 2.98 0.00 -1.26 -3.06 105.19 105.42 2i3t n GLY 111 Ca 0.24 -1.34 0.03 0.00 0.00 0.00 0.00 46.02 44.95 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 0.56 1.79 0.00 1.61 5.68 -1.26 -4.58 116.55 120.35 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 0.17 0.77 -4.10 -1.12 5.75 -1.26 -4.44 116.55 112.32 2i3t n ASP 113 Ca 0.04 -0.96 -0.17 0.00 -0.01 0.00 0.00 54.79 53.69 2i3t n ASP 113 Cb 0.20 0.06 -0.10 0.00 -1.03 0.00 0.00 41.12 40.25 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 -0.06 1.46 0.05 0.11 1.02 -1.17 -4.51 119.74 116.64 2i3t s LYS 114 Ca 0.00 -1.81 -0.02 0.00 0.02 0.00 0.00 55.97 54.16 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 -0.40 0.00 -0.51 -0.92 0.00 0.00 175.35 173.52 2i3t s LEU 115 N -3.31 2.33 -0.03 3.17 1.43 -0.74 -1.75 118.68 119.79 2i3t s LEU 115 Ca 0.37 -0.94 -0.00 0.00 -1.03 0.00 0.00 54.13 52.53 2i3t s LEU 115 Cb 0.06 0.32 0.03 0.00 0.03 0.00 0.00 46.19 46.63 2i3t s LEU 115 CO 0.16 -0.61 0.04 -0.51 0.23 0.00 0.00 176.35 175.65 2i3t s ILE 116 N -3.85 -0.06 0.13 -0.59 2.07 0.32 0.34 121.20 119.56 2i3t s ILE 116 Ca 0.06 0.26 0.06 0.00 -1.41 0.00 0.00 60.65 59.62 2i3t s ILE 116 Cb 0.07 -0.11 -0.04 0.00 0.13 0.00 0.00 42.46 42.52 2i3t s ILE 116 CO -0.10 0.11 0.02 0.00 -1.91 0.00 0.00 174.94 173.06 2i3t s ALA 117 N 1.34 3.30 0.04 1.50 0.00 0.17 -0.13 121.76 127.99 2i3t s ALA 117 Ca -0.06 -1.20 0.05 0.00 0.00 0.00 0.00 51.96 50.75 2i3t s ALA 117 Cb -0.13 -1.15 -0.02 0.00 0.00 0.00 0.00 23.12 21.82 2i3t s ALA 117 CO -0.03 0.61 -0.15 0.00 0.00 0.00 0.00 175.76 176.19 2i3t s ALA 118 N -1.49 1.29 0.24 0.00 0.00 0.28 -0.45 121.76 121.62 2i3t s ALA 118 Ca 0.27 -0.88 0.11 0.00 0.00 0.00 0.00 51.96 51.46 2i3t s ALA 118 Cb -0.11 -0.21 -0.05 0.00 0.00 0.00 0.00 23.12 22.75 2i3t s ALA 118 CO 0.19 0.25 -0.19 -1.54 0.00 0.00 0.00 175.76 174.48 2i3t s SER 119 N -1.16 3.69 0.52 0.00 1.04 -0.49 -1.32 113.70 115.98 2i3t s SER 119 Ca 0.03 -0.89 0.19 0.00 0.48 0.00 0.00 55.95 55.76 2i3t s SER 119 Cb -0.08 -0.38 1.30 0.00 0.10 0.00 0.00 66.02 66.96 2i3t s SER 119 CO 0.01 0.07 2.09 -0.50 0.98 0.00 0.00 173.24 175.90 2i3t h TRP 120 N 2.65 0.02 -0.09 5.02 6.55 -1.11 -1.52 115.95 127.47 2i3t h TRP 120 Ca -0.43 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.41 2i3t h TRP 120 Cb 1.23 -0.01 0.00 0.00 -0.86 0.00 0.00 29.16 29.53 2i3t h TRP 120 CO 0.74 0.01 0.00 -0.40 -1.05 0.00 0.00 178.44 177.74 2i3t n ASP 121 N -4.48 1.34 0.00 -3.49 3.85 -1.26 -2.60 116.55 109.90 2i3t n ASP 121 Ca 0.02 -2.09 0.00 0.00 -0.71 0.00 0.00 54.79 52.01 2i3t n ASP 121 Cb 0.27 -0.40 0.00 0.00 -1.35 0.00 0.00 41.12 39.65 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 0.25 0.71 3.78 6.12 0.00 -0.57 -4.75 105.19 110.73 2i3t n GLY 122 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.36 118.68 122.72 2i3t s LEU 123 Ca 0.00 1.21 0.02 0.00 -1.03 0.00 0.00 54.13 54.34 2i3t s LEU 123 Cb 0.00 -2.91 0.05 0.00 0.03 0.00 0.00 46.19 43.36 2i3t s LEU 123 CO 0.00 0.18 -0.12 -0.63 0.23 0.00 0.00 176.35 176.01 2i3t s ILE 124 N -0.63 2.07 0.02 -0.59 1.01 -0.44 -1.40 121.20 121.24 2i3t s ILE 124 Ca 0.30 -1.43 0.08 0.00 0.00 0.00 0.00 60.65 59.59 2i3t s ILE 124 Cb -0.19 -2.13 -0.03 0.00 0.01 0.00 0.00 42.46 40.13 2i3t s ILE 124 CO 0.18 0.09 -0.22 -1.61 0.00 0.00 0.00 174.94 173.38 2i3t s GLU 125 N 1.18 2.04 -0.07 2.79 2.02 0.40 -1.61 118.70 125.44 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 -0.18 -2.10 -0.04 0.00 0.10 0.00 0.00 34.13 31.90 2i3t s GLU 125 CO -0.07 0.55 0.19 0.08 0.02 0.00 0.00 175.26 176.02 2i3t s VAL 126 N -0.79 5.43 -0.37 2.63 1.01 -0.59 0.45 120.40 128.17 2i3t s VAL 126 Ca 0.12 0.20 -0.03 0.00 0.00 0.00 0.00 61.98 62.27 2i3t s VAL 126 Cb -0.10 -3.47 0.08 0.00 0.00 0.00 0.00 36.38 32.89 2i3t s VAL 126 CO 0.02 0.54 0.13 -0.63 0.00 0.00 0.00 175.10 175.16 2i3t s ILE 127 N -1.12 3.25 -0.39 2.22 1.01 0.15 -1.87 121.20 124.46 2i3t s ILE 127 Ca 0.19 -1.74 0.04 0.00 0.00 0.00 0.00 60.65 59.14 2i3t s ILE 127 Cb -0.13 -3.08 0.11 0.00 0.01 0.00 0.00 42.46 39.37 2i3t s ILE 127 CO 0.09 -0.45 0.12 -0.62 0.00 0.00 0.00 174.94 174.07 2i3t s ASP 128 N 1.60 4.59 0.02 3.58 -1.08 -1.26 -1.78 116.67 122.33 2i3t s ASP 128 Ca 0.03 -2.39 -0.25 0.00 -0.52 0.00 0.00 52.55 49.42 2i3t s ASP 128 Cb -0.21 -1.59 -0.18 0.00 -1.46 0.00 0.00 42.92 39.48 2i3t s ASP 128 CO -0.02 -0.34 1.42 -0.65 0.52 0.00 0.00 175.17 176.10 2i3t h PRO 129 N 7.29 -0.09 -0.24 4.34 0.11 -1.79 -0.94 132.00 140.67 2i3t h PRO 129 Ca -0.05 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 0.20 0.00 2.89 -0.21 0.00 0.00 178.00 181.45 2i3t n ARG 130 N -5.00 0.49 0.00 1.05 1.85 -1.26 -0.10 116.66 113.69 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 -1.12 0.00 0.00 -1.05 0.00 0.00 32.46 30.47 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 -0.12 0.00 0.00 2.89 3.02 -1.20 -4.93 115.26 114.92 2i3t n ASN 131 Ca 0.00 -0.99 0.00 0.00 -0.03 0.00 0.00 54.58 53.56 2i3t n ASN 131 Cb 0.06 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.23 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 -5.05 117.16 118.85 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 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.28 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 3.67 2.33 2.72 0.00 0.85 -2.58 105.19 112.18 2i3t n GLY 133 Ca 0.00 0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 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 9.36 7.07 -3.80 1.61 10.43 -1.26 -4.32 116.55 135.64 2i3t n ASP 134 Ca 0.00 -3.79 -0.28 0.00 2.57 0.00 0.00 54.79 53.30 2i3t n ASP 134 Cb 0.00 -0.85 -0.16 0.00 1.84 0.00 0.00 41.12 41.95 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 -2.15 0.83 0.61 0.44 0.00 -1.07 0.29 107.32 106.27 2i3t s GLY 135 Ca 0.60 -0.78 -0.16 0.00 0.00 0.00 0.00 44.72 44.39 2i3t s GLY 135 CO -0.05 1.22 1.08 -1.34 0.00 0.00 0.00 173.10 174.02 2i3t s VAL 136 N 1.75 3.55 -0.22 1.40 -7.23 0.20 -4.73 120.40 115.11 2i3t s VAL 136 Ca -0.01 0.76 0.01 0.00 -1.81 0.00 0.00 61.98 60.93 2i3t s VAL 136 Cb -0.17 -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 0.00 175.10 173.72 2i3t s ILE 137 N -2.33 1.65 1.05 -0.62 1.10 -0.78 -4.56 121.20 116.72 2i3t s ILE 137 Ca 0.66 -1.17 -0.16 0.00 -0.51 0.00 0.00 60.65 59.47 2i3t s ILE 137 Cb -0.18 -1.81 0.09 0.00 0.15 0.00 0.00 42.46 40.70 2i3t s ILE 137 CO 0.37 0.03 0.25 0.00 -2.11 0.00 0.00 174.94 173.48 2i3t n ALA 138 N 4.65 -3.38 0.00 1.50 0.00 -1.26 -1.54 120.51 120.48 2i3t n ALA 138 Ca -0.13 -0.99 0.00 0.00 0.00 0.00 0.00 53.44 52.32 2i3t n ALA 138 Cb 0.45 -1.68 0.00 0.00 0.00 0.00 0.00 19.45 18.22 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 -4.12 0.00 -4.10 0.00 0.31 -0.63 -4.73 118.33 105.06 2i3t n VAL 139 Ca 0.03 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.22 2i3t n VAL 139 Cb 0.58 -0.14 -0.12 0.00 -0.91 0.00 0.00 33.84 33.25 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 -1.53 0.57 -0.30 5.55 -0.14 -1.11 -5.03 119.74 117.74 2i3t s LYS 140 Ca 0.00 -0.71 -0.03 0.00 -1.36 0.00 0.00 55.97 53.87 2i3t s LYS 140 Cb 0.00 -0.40 0.11 0.00 -1.68 0.00 0.00 37.83 35.86 2i3t s LYS 140 CO 0.00 0.08 0.16 1.21 -0.76 0.00 0.00 175.35 176.04 2i3t s ASN 141 N -1.40 3.29 0.00 2.83 3.84 -1.26 -1.33 114.94 120.91 2i3t s ASN 141 Ca -0.07 -1.47 0.00 0.00 0.21 0.00 0.00 52.86 51.54 2i3t s ASN 141 Cb -0.09 -0.30 0.02 0.00 -0.55 0.00 0.00 41.25 40.33 2i3t s ASN 141 CO 0.01 -0.41 0.46 0.18 -2.79 0.00 0.00 177.10 174.55 2i3t n LEU 142 N 4.97 0.00 -2.41 3.21 4.77 -0.47 -1.81 117.00 125.27 2i3t n LEU 142 Ca -0.02 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.81 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 0.09 0.59 -1.33 0.00 0.00 177.39 176.80 2i3t n ASN 143 N -0.94 3.47 -0.70 -1.43 3.02 -1.26 -4.66 115.26 112.77 2i3t n ASN 143 Ca 0.00 -3.08 0.05 0.00 -0.03 0.00 0.00 54.58 51.53 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 2.02 -2.24 6.41 3.41 -0.75 -3.85 113.62 118.03 2i3t n SER 144 Ca 0.28 -2.04 -0.07 0.00 -0.26 0.00 0.00 58.87 56.78 2i3t n SER 144 Cb 0.86 -0.27 0.05 0.00 -0.26 0.00 0.00 64.21 64.59 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 0.51 2.58 0.00 4.04 3.02 -1.26 -5.09 115.26 119.05 2i3t n ASN 145 Ca 0.12 -2.72 0.00 0.00 -0.03 0.00 0.00 54.58 51.95 2i3t n ASN 145 Cb 0.34 -0.42 0.00 0.00 -0.61 0.00 0.00 39.78 39.09 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 -0.54 0.00 -0.01 6.41 6.94 -1.25 -5.05 115.26 121.75 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 0.89 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 0.16 0.00 -4.33 5.53 -2.24 -1.26 -5.02 114.28 107.12 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 -0.05 0.00 -2.10 0.00 0.00 70.33 69.19 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 -0.03 2.22 0.19 -0.78 2.36 -1.26 -5.03 119.74 117.41 2i3t s LYS 148 Ca 0.00 -2.18 -0.12 0.00 -2.55 0.00 0.00 55.97 51.12 2i3t s LYS 148 Cb 0.00 -1.81 0.12 0.00 -1.05 0.00 0.00 37.83 35.09 2i3t s LYS 148 CO 0.00 -0.44 1.85 -0.39 1.55 0.00 0.00 175.35 177.92 2i3t h VAL 149 N 1.12 1.18 0.00 4.02 -1.51 -1.96 -3.44 116.25 115.66 2i3t h VAL 149 Ca -0.41 -0.37 0.00 0.00 -1.23 0.00 0.00 66.70 64.69 2i3t h VAL 149 Cb 1.30 0.23 0.00 0.00 -2.13 0.00 0.00 31.29 30.69 2i3t h VAL 149 CO 0.67 0.18 0.00 0.29 -1.23 0.00 0.00 177.57 177.48 2i3t n LYS 150 N -4.59 0.00 -3.32 5.19 4.76 -1.26 -4.45 118.16 114.49 2i3t n LYS 150 Ca 0.05 0.00 -0.38 0.00 -2.87 0.00 0.00 58.31 55.12 2i3t n LYS 150 Cb 0.04 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 33.17 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 6.70 0.36 4.39 0.02 -1.26 -4.97 114.94 116.18 2i3t s ASN 151 Ca 0.00 0.84 0.09 0.00 -1.02 0.00 0.00 52.86 52.76 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 0.03 -0.02 -0.54 0.02 0.00 0.00 177.10 176.59 2i3t s LYS 152 N 0.47 1.96 -0.18 -0.60 1.02 -1.26 -4.13 119.74 117.01 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 35.40 2i3t s LYS 152 CO 0.11 0.09 -0.16 0.42 -0.92 0.00 0.00 175.35 174.88 2i3t s ILE 153 N -2.60 1.88 -0.20 2.17 1.01 -1.07 -3.37 121.20 119.03 2i3t s ILE 153 Ca 0.34 -0.94 0.17 0.00 0.00 0.00 0.00 60.65 60.22 2i3t s ILE 153 Cb 0.03 -1.78 -0.24 0.00 0.01 0.00 0.00 42.46 40.48 2i3t s ILE 153 CO 0.18 0.41 0.06 0.49 0.00 0.00 0.00 174.94 176.08 2i3t n PHE 154 N 4.65 0.00 -3.89 3.97 0.99 0.47 -4.05 117.46 119.59 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 -0.98 -0.05 0.00 -1.00 0.00 0.00 39.48 37.94 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 -2.48 0.02 0.03 4.37 -1.32 -1.04 -4.93 115.64 110.29 2i3t s THR 155 Ca -0.11 -1.17 -0.28 0.00 -1.21 0.00 0.00 61.69 58.92 2i3t s THR 155 Cb 0.06 -1.89 0.08 0.00 -1.51 0.00 0.00 72.50 69.23 2i3t s THR 155 CO 0.80 -0.11 0.68 -0.32 -2.21 0.00 0.00 174.62 173.46 2i3t s MET 156 N -3.95 1.10 0.07 7.08 1.75 -1.26 -0.28 119.30 123.80 2i3t s MET 156 Ca 0.16 -0.07 -0.14 0.00 -1.25 0.00 0.00 55.69 54.39 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 0.03 -0.41 0.31 0.34 -0.65 0.00 0.00 175.02 174.63 2i3t s ASP 157 N -1.89 -0.11 0.16 1.11 2.15 -0.57 -4.90 116.67 112.61 2i3t s ASP 157 Ca -0.05 -0.28 -0.05 0.00 0.43 0.00 0.00 52.55 52.61 2i3t s ASP 157 Cb -0.00 0.38 -0.02 0.00 -0.30 0.00 0.00 42.92 42.97 2i3t s ASP 157 CO -0.01 -0.68 0.18 0.42 -0.17 0.00 0.00 175.17 174.91 2i3t s THR 158 N -2.99 0.07 0.34 1.71 -4.23 -1.26 -1.52 115.64 107.76 2i3t s THR 158 Ca -0.02 -1.67 -0.10 0.00 -1.18 0.00 0.00 61.69 58.73 2i3t s THR 158 Cb 0.01 -2.00 0.04 0.00 1.34 0.00 0.00 72.50 71.89 2i3t s THR 158 CO -0.06 -0.33 0.63 -0.46 -0.54 0.00 0.00 174.62 173.85 2i3t n ASN 159 N -0.17 -1.82 -0.32 3.99 0.23 -0.54 -4.94 115.26 111.69 2i3t n ASN 159 Ca -0.06 -2.51 0.27 0.00 -0.53 0.00 0.00 54.58 51.76 2i3t n ASN 159 Cb 0.63 3.10 0.52 0.00 -2.08 0.00 0.00 39.78 41.95 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 1.77 0.23 0.00 0.53 4.64 -1.96 -2.97 113.55 115.79 2i3t h SER 160 Ca -0.28 0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 2i3t h SER 160 Cb 1.09 0.28 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 2i3t h SER 160 CO 0.37 -0.36 0.00 -1.54 -0.87 0.00 0.00 176.83 174.43 2i3t n SER 161 N -5.25 1.27 -3.73 4.97 3.41 -1.26 -4.64 113.62 108.39 2i3t n SER 161 Ca 0.34 -1.55 -0.14 0.00 -0.26 0.00 0.00 58.87 57.27 2i3t n SER 161 Cb 1.14 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 65.00 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 -0.55 0.71 -0.03 4.33 3.52 -1.13 -1.50 118.95 124.31 2i3t s ARG 162 Ca 0.00 -0.11 0.04 0.00 -0.13 0.00 0.00 55.73 55.53 2i3t s ARG 162 Cb 0.00 0.32 -0.01 0.00 -1.56 0.00 0.00 34.95 33.70 2i3t s ARG 162 CO 0.00 -0.20 -0.16 -1.17 -0.81 0.00 0.00 175.30 172.97 2i3t s LEU 163 N -1.26 1.95 -0.01 -0.88 0.20 -0.69 -1.46 118.68 116.53 2i3t s LEU 163 Ca -0.13 -0.30 0.00 0.00 0.69 0.00 0.00 54.13 54.39 2i3t s LEU 163 Cb -0.04 -0.85 0.01 0.00 -0.43 0.00 0.00 46.19 44.87 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 -0.12 0.10 0.04 6.68 2.07 -0.58 -0.72 121.20 128.67 2i3t s ILE 164 Ca 0.01 -0.00 0.09 0.00 -1.41 0.00 0.00 60.65 59.33 2i3t s ILE 164 Cb -0.09 -0.13 -0.03 0.00 0.13 0.00 0.00 42.46 42.35 2i3t s ILE 164 CO 0.01 0.06 -0.24 0.68 -1.91 0.00 0.00 174.94 173.53 2i3t s VAL 165 N 0.28 2.33 -0.19 4.00 -7.23 0.10 -1.51 120.40 118.18 2i3t s VAL 165 Ca -0.02 -1.31 -0.12 0.00 -1.81 0.00 0.00 61.98 58.71 2i3t s VAL 165 Cb -0.04 -1.92 -0.05 0.00 0.56 0.00 0.00 36.38 34.93 2i3t s VAL 165 CO -0.01 0.37 0.23 -0.83 -0.31 0.00 0.00 175.10 174.55 2i3t s GLY 166 N -1.26 2.11 0.09 2.32 0.00 0.62 -1.85 107.32 109.36 2i3t s GLY 166 Ca 0.12 -0.60 0.00 0.00 0.00 0.00 0.00 44.72 44.25 2i3t s GLY 166 CO 0.03 0.36 0.00 1.03 0.00 0.00 0.00 173.10 174.52 2i3t n MET 167 N 3.73 1.76 -1.71 2.90 2.81 -0.39 -0.40 117.12 125.82 2i3t n MET 167 Ca -0.13 -0.68 -0.30 0.00 -1.81 0.00 0.00 57.70 54.77 2i3t n MET 167 Cb 0.52 0.18 0.07 0.00 -0.71 0.00 0.00 33.22 33.28 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 -1.51 4.99 -0.61 7.83 4.22 -1.22 -3.67 114.94 124.97 2i3t s ASN 168 Ca 0.00 1.24 0.00 0.00 -2.14 0.00 0.00 52.86 51.96 2i3t s ASN 168 Cb 0.00 -2.02 0.00 0.00 1.28 0.00 0.00 41.25 40.51 2i3t s ASN 168 CO 0.00 -1.65 0.00 0.59 -2.04 0.00 0.00 177.10 174.00 2i3t n ASN 169 N -3.22 -4.06 -3.65 3.54 3.02 -1.26 -3.67 115.26 105.96 2i3t n ASN 169 Ca 0.07 0.14 -0.27 0.00 -0.03 0.00 0.00 54.58 54.49 2i3t n ASN 169 Cb 0.56 -2.06 0.04 0.00 -0.61 0.00 0.00 39.78 37.71 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 0.33 -5.31 -4.24 6.41 2.88 -1.24 -4.95 113.62 107.49 2i3t n SER 170 Ca -0.06 -0.61 -0.16 0.00 -1.33 0.00 0.00 58.87 56.71 2i3t n SER 170 Cb 0.25 -4.24 -0.11 0.00 -0.75 0.00 0.00 64.21 59.36 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 -6.35 1.03 0.32 -1.46 -2.07 -1.24 -2.55 119.66 107.33 2i3t s GLN 171 Ca 0.57 -1.31 0.09 0.00 -1.82 0.00 0.00 55.36 52.89 2i3t s GLN 171 Cb -0.28 -0.78 -0.05 0.00 -1.09 0.00 0.00 33.01 30.82 2i3t s GLN 171 CO 0.70 0.13 0.04 0.14 -1.32 0.00 0.00 175.29 174.99 2i3t s VAL 172 N -2.59 3.00 -0.09 3.63 -7.23 -0.34 -1.26 120.40 115.50 2i3t s VAL 172 Ca 0.12 -1.88 -0.04 0.00 -1.81 0.00 0.00 61.98 58.37 2i3t s VAL 172 Cb -0.02 -2.86 0.04 0.00 0.56 0.00 0.00 36.38 34.11 2i3t s VAL 172 CO 0.02 -0.25 0.22 -1.58 -0.31 0.00 0.00 175.10 173.20 2i3t s GLN 173 N -3.74 0.17 0.10 4.82 0.74 -0.77 -1.36 119.66 119.61 2i3t s GLN 173 Ca 0.35 0.50 0.08 0.00 0.05 0.00 0.00 55.36 56.33 2i3t s GLN 173 Cb -0.03 -0.14 -0.03 0.00 1.10 0.00 0.00 33.01 33.91 2i3t s GLN 173 CO 0.20 -0.17 -0.21 1.67 -0.55 0.00 0.00 175.29 176.23 2i3t s TRP 174 N 1.31 1.78 0.34 1.67 1.48 -1.18 -0.72 118.94 123.61 2i3t s TRP 174 Ca -0.09 -0.42 0.06 0.00 -1.06 0.00 0.00 56.10 54.60 2i3t s TRP 174 Cb -0.11 -0.98 -0.07 0.00 -1.16 0.00 0.00 33.47 31.16 2i3t s TRP 174 CO -0.08 0.19 -0.00 -0.06 -4.06 0.00 0.00 176.95 172.94 2i3t s PHE 175 N -1.14 2.16 0.17 1.66 0.40 0.10 -3.33 117.98 118.01 2i3t s PHE 175 Ca 0.06 -0.76 -0.06 0.00 -0.60 0.00 0.00 56.93 55.57 2i3t s PHE 175 Cb -0.10 -1.38 -0.06 0.00 0.51 0.00 0.00 43.02 41.99 2i3t s PHE 175 CO 0.04 0.26 0.43 1.03 0.70 0.00 0.00 175.22 177.68 2i3t s ARG 176 N -3.77 3.66 -0.06 0.44 0.52 -1.26 -1.71 118.95 116.77 2i3t s ARG 176 Ca 0.34 -0.01 0.04 0.00 -0.52 0.00 0.00 55.73 55.58 2i3t s ARG 176 Cb 0.07 -2.79 -0.00 0.00 0.52 0.00 0.00 34.95 32.75 2i3t s ARG 176 CO 0.15 0.42 -0.19 -0.51 0.02 0.00 0.00 175.30 175.19 2i3t s LEU 177 N -2.76 1.92 0.49 2.53 1.43 -0.56 -2.74 118.68 118.99 2i3t s LEU 177 Ca 0.43 -0.41 -0.22 0.00 -1.03 0.00 0.00 54.13 52.91 2i3t s LEU 177 Cb -0.12 -1.09 -0.07 0.00 0.03 0.00 0.00 46.19 44.95 2i3t s LEU 177 CO 0.24 0.15 1.15 -2.16 0.23 0.00 0.00 176.35 175.96 2i3t s PRO 178 N 0.18 3.60 0.60 1.29 0.04 -1.26 -4.39 135.00 135.06 2i3t s PRO 178 Ca -0.08 1.70 -0.18 0.00 0.04 0.00 0.00 61.00 62.48 2i3t s PRO 178 Cb -0.14 -2.24 -0.07 0.00 0.04 0.00 0.00 34.50 32.09 2i3t s PRO 178 CO 0.04 -0.67 0.60 1.28 0.04 0.00 0.00 177.00 178.29 2i3t n LEU 179 N -0.81 1.27 -4.13 -3.56 4.77 -1.11 -5.03 117.00 108.40 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 0.49 -1.22 -0.17 0.00 -2.33 0.00 0.00 43.42 40.20 2i3t n LEU 179 CO 0.45 -2.88 -0.52 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 -3.40 114.58 119.01 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 0.00 179.01 177.83 2i3t n ASP 182 N -4.13 0.00 0.00 1.42 9.92 -1.26 -4.67 116.55 117.83 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 0.10 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.58 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 -3.98 1.67 6.94 -1.26 -4.65 115.26 113.98 2i3t n ASN 184 Ca 0.00 0.00 -0.30 0.00 -0.02 0.00 0.00 54.58 54.26 2i3t n ASN 184 Cb 0.00 0.00 0.25 0.00 -2.36 0.00 0.00 39.78 37.67 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 1.52 -0.43 4.83 0.00 -1.26 -4.79 107.32 107.18 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 0.20 0.67 -1.08 0.00 0.00 0.00 173.10 172.89 2i3t s THR 186 N -2.66 -0.97 0.66 0.90 -1.32 -1.21 -5.00 115.64 106.04 2i3t s THR 186 Ca 0.69 -0.25 -0.14 0.00 -1.21 0.00 0.00 61.69 60.78 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 1.08 -0.63 -2.21 0.00 0.00 174.62 173.45 2i3t s ILE 187 N 1.60 3.60 0.01 5.08 1.01 -1.26 -3.13 121.20 128.10 2i3t s ILE 187 Ca 0.20 0.67 -0.28 0.00 0.00 0.00 0.00 60.65 61.23 2i3t s ILE 187 Cb -0.03 -3.23 0.10 0.00 0.01 0.00 0.00 42.46 39.32 2i3t s ILE 187 CO -0.07 -0.54 0.86 -0.70 0.00 0.00 0.00 174.94 174.50 2i3t s GLU 188 N -4.39 0.86 0.06 2.79 2.12 -0.47 -4.98 118.70 114.69 2i3t s GLU 188 Ca 0.63 -0.30 -0.31 0.00 0.36 0.00 0.00 54.97 55.35 2i3t s GLU 188 Cb -0.17 0.40 -0.06 0.00 0.26 0.00 0.00 34.13 34.56 2i3t s GLU 188 CO 0.45 -0.37 1.27 -1.21 -0.54 0.00 0.00 175.26 174.85 2i3t s GLU 189 N -3.11 4.38 0.51 4.30 0.41 -1.26 -1.20 118.70 122.72 2i3t s GLU 189 Ca 0.04 1.86 0.29 0.00 -0.41 0.00 0.00 54.97 56.75 2i3t s GLU 189 Cb -0.01 -3.36 1.30 0.00 -1.78 0.00 0.00 34.13 30.28 2i3t s GLU 189 CO -0.09 -0.35 1.98 0.66 -0.49 0.00 0.00 175.26 176.97 2i3t h SER 190 N 6.95 0.00 0.00 -0.19 4.64 -1.82 -3.45 113.55 119.68 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 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2i3t h SER 190 CO 0.84 0.13 0.00 0.61 -0.87 0.00 0.00 176.83 177.54 2i3t n GLY 191 N -0.24 0.74 3.94 -0.77 0.00 -1.26 -4.82 105.19 102.77 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 3.68 -0.17 0.99 1.43 -1.26 -4.90 118.68 118.45 2i3t s LEU 192 Ca 0.00 0.49 -0.23 0.00 -1.03 0.00 0.00 54.13 53.36 2i3t s LEU 192 Cb 0.00 -3.38 -0.23 0.00 0.03 0.00 0.00 46.19 42.62 2i3t s LEU 192 CO 0.00 -0.62 0.46 0.50 0.23 0.00 0.00 176.35 176.92 2i3t h LYS 193 N 0.38 0.04 0.00 1.70 3.11 -1.96 -3.50 116.57 116.35 2i3t h LYS 193 Ca -0.47 -0.07 0.00 0.00 -2.81 0.00 0.00 60.65 57.30 2i3t h LYS 193 Cb 1.24 0.03 0.00 0.00 -1.00 0.00 0.00 32.23 32.49 2i3t h LYS 193 CO 0.59 1.03 0.00 0.66 -2.81 0.00 0.00 179.45 178.93 2i3t n TYR 194 N -4.41 0.00 -1.64 1.91 4.02 -1.26 -4.99 117.16 110.79 2i3t n TYR 194 Ca -0.23 0.00 -0.45 0.00 -0.01 0.00 0.00 57.90 57.21 2i3t n TYR 194 Cb 0.65 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.95 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 1.76 -2.86 -0.72 7.27 -1.26 -4.54 117.38 117.03 2i3t n GLN 195 Ca 0.00 0.62 -0.40 0.00 0.07 0.00 0.00 57.00 57.30 2i3t n GLN 195 Cb 0.00 -2.18 -0.06 0.00 2.41 0.00 0.00 30.24 30.41 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 -0.45 4.24 -0.09 1.69 1.01 -1.26 -1.87 121.20 124.46 2i3t s ILE 196 Ca 0.65 1.90 0.05 0.00 0.00 0.00 0.00 60.65 63.25 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 0.00 174.94 176.51 2i3t n ARG 197 N 1.62 1.80 -3.56 2.79 1.74 0.18 -4.89 116.66 116.34 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 -4.38 -0.43 0.01 0.55 2.15 -1.19 -4.75 116.67 108.63 2i3t s ASP 198 Ca -0.08 0.08 0.00 0.00 0.43 0.00 0.00 52.55 52.99 2i3t s ASP 198 Cb 0.03 0.51 -0.01 0.00 -0.30 0.00 0.00 42.92 43.14 2i3t s ASP 198 CO 0.31 -0.78 -0.02 0.54 -0.17 0.00 0.00 175.17 175.05 2i3t s VAL 199 N -2.83 0.08 -0.11 1.11 0.11 -1.26 -0.97 120.40 116.53 2i3t s VAL 199 Ca -0.03 -0.64 -0.05 0.00 -2.93 0.00 0.00 61.98 58.33 2i3t s VAL 199 Cb -0.00 -0.19 0.05 0.00 -1.53 0.00 0.00 36.38 34.71 2i3t s VAL 199 CO -0.05 -0.35 0.25 0.00 -3.33 0.00 0.00 175.10 171.63 2i3t s ALA 200 N -1.02 -0.58 0.38 1.54 0.00 0.75 -4.61 121.76 118.22 2i3t s ALA 200 Ca -0.11 1.02 -0.26 0.00 0.00 0.00 0.00 51.96 52.61 2i3t s ALA 200 Cb -0.07 -0.66 -0.09 0.00 0.00 0.00 0.00 23.12 22.30 2i3t s ALA 200 CO -0.01 -0.22 1.18 -0.51 0.00 0.00 0.00 175.76 176.20 2i3t s LEU 201 N 1.32 4.25 0.71 0.00 1.43 -1.26 -0.69 118.68 124.44 2i3t s LEU 201 Ca -0.09 2.38 -0.14 0.00 -1.03 0.00 0.00 54.13 55.26 2i3t s LEU 201 Cb -0.10 -3.94 0.03 0.00 0.03 0.00 0.00 46.19 42.20 2i3t s LEU 201 CO -0.09 -0.62 1.12 -0.76 0.23 0.00 0.00 176.35 176.24 2i3t s LEU 202 N -2.32 3.28 -0.55 1.79 1.43 -1.16 -4.74 118.68 116.40 2i3t s LEU 202 Ca 0.55 2.03 -0.18 0.00 -1.03 0.00 0.00 54.13 55.50 2i3t s LEU 202 Cb -0.32 -4.55 -0.18 0.00 0.03 0.00 0.00 46.19 41.17 2i3t s LEU 202 CO 0.41 -1.90 1.61 -2.65 0.23 0.00 0.00 176.35 174.05 2i3t n PRO 203 N -2.79 0.05 0.00 1.29 -0.02 -1.26 -4.64 135.00 127.63 2i3t n PRO 203 Ca 0.11 -1.00 0.00 0.00 -2.02 0.00 0.00 63.50 60.58 2i3t n PRO 203 Cb 0.52 -2.70 0.00 0.00 -0.02 0.00 0.00 33.50 31.30 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 6.76 0.00 0.00 -0.52 0.00 -1.26 -3.66 118.16 119.48 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 -1.34 0.00 0.00 -1.01 0.00 0.00 31.44 29.09 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 0.50 -2.45 3.49 3.00 -1.24 -5.12 117.38 114.91 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 29.24 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 -1.50 -4.34 -0.73 -1.09 -0.58 -0.74 -3.98 120.64 107.68 2i3t n GLU 207 Ca 0.00 3.20 0.00 0.00 -0.42 0.00 0.00 57.16 59.94 2i3t n GLU 207 Cb 0.04 -4.25 0.00 0.00 -0.57 0.00 0.00 31.44 26.66 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 1.87 0.30 3.79 0.62 0.00 -1.26 -1.46 105.19 109.05 2i3t n GLY 208 Ca -0.14 -1.40 -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 -3.56 -0.02 0.06 1.61 -0.85 -0.54 -2.99 117.35 111.06 2i3t s TYR 209 Ca 0.00 -0.23 0.05 0.00 -0.52 0.00 0.00 57.07 56.37 2i3t s TYR 209 Cb 0.00 0.62 -0.03 0.00 0.38 0.00 0.00 41.96 42.94 2i3t s TYR 209 CO 0.00 -0.63 -0.13 0.00 -1.52 0.00 0.00 175.55 173.27 2i3t s ALA 210 N -2.54 1.09 -0.01 9.51 0.00 0.13 -0.52 121.76 129.43 2i3t s ALA 210 Ca 0.18 -0.90 -0.14 0.00 0.00 0.00 0.00 51.96 51.10 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 0.30 0.00 0.00 0.00 0.00 175.76 176.23 2i3t s SER 212 N -1.43 3.74 0.55 0.00 1.04 -0.15 -0.92 113.70 116.54 2i3t s SER 212 Ca -0.13 -0.62 0.04 0.00 0.48 0.00 0.00 55.95 55.72 2i3t s SER 212 Cb -0.05 -0.46 0.04 0.00 0.10 0.00 0.00 66.02 65.65 2i3t s SER 212 CO 0.03 0.17 0.32 -0.94 0.98 0.00 0.00 173.24 173.81 2i3t s SER 213 N -2.18 4.51 0.28 7.02 1.04 -0.88 0.47 113.70 123.95 2i3t s SER 213 Ca 0.17 -1.38 0.26 0.00 0.48 0.00 0.00 55.95 55.48 2i3t s SER 213 Cb -0.10 0.55 0.83 0.00 0.10 0.00 0.00 66.02 67.40 2i3t s SER 213 CO 0.09 -1.10 1.75 0.16 0.98 0.00 0.00 173.24 175.12 2i3t h ILE 214 N 0.84 0.00 -3.00 -1.02 -0.00 -1.68 -1.18 117.51 111.46 2i3t h ILE 214 Ca -0.38 -0.49 -0.65 0.00 -0.00 0.00 0.00 64.86 63.35 2i3t h ILE 214 Cb 1.31 1.42 -0.40 0.00 -0.00 0.00 0.00 36.82 39.16 2i3t h ILE 214 CO 0.60 0.00 -0.39 -0.90 -0.00 0.00 0.00 178.15 177.47 2i3t n ASP 215 N -2.42 3.61 -3.67 2.16 5.75 -1.26 -2.14 116.55 118.58 2i3t n ASP 215 Ca 0.04 -3.24 -0.21 0.00 -0.01 0.00 0.00 54.79 51.38 2i3t n ASP 215 Cb 0.38 -0.85 -0.03 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 1.85 -0.20 3.06 6.12 0.00 0.11 -4.86 105.19 111.26 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 -5.81 0.30 -0.09 1.61 3.52 -1.26 -1.37 118.95 115.85 2i3t s ARG 217 Ca 0.09 -0.04 0.02 0.00 -0.13 0.00 0.00 55.73 55.67 2i3t s ARG 217 Cb -0.05 0.13 0.01 0.00 -1.56 0.00 0.00 34.95 33.48 2i3t s ARG 217 CO 0.57 -0.06 -0.14 0.08 -0.81 0.00 0.00 175.30 174.94 2i3t s VAL 218 N -0.51 1.34 -0.01 7.11 1.01 -0.54 -2.08 120.40 126.71 2i3t s VAL 218 Ca -0.06 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.38 2i3t s VAL 218 Cb -0.04 -1.22 -0.03 0.00 0.00 0.00 0.00 36.38 35.09 2i3t s VAL 218 CO 0.01 0.40 -0.10 0.00 0.00 0.00 0.00 175.10 175.41 2i3t s ALA 219 N 0.80 2.87 0.06 5.51 0.00 -0.10 -2.00 121.76 128.90 2i3t s ALA 219 Ca -0.11 -1.01 0.06 0.00 0.00 0.00 0.00 51.96 50.89 2i3t s ALA 219 Cb -0.16 -1.05 -0.03 0.00 0.00 0.00 0.00 23.12 21.89 2i3t s ALA 219 CO 0.02 0.59 -0.17 0.08 0.00 0.00 0.00 175.76 176.28 2i3t s VAL 220 N -0.90 1.36 -0.03 0.00 1.01 0.28 -0.97 120.40 121.16 2i3t s VAL 220 Ca 0.15 -1.25 -0.01 0.00 0.00 0.00 0.00 61.98 60.87 2i3t s VAL 220 Cb -0.11 -1.24 0.03 0.00 0.00 0.00 0.00 36.38 35.06 2i3t s VAL 220 CO 0.05 -0.04 0.04 -0.70 0.00 0.00 0.00 175.10 174.45 2i3t s GLU 221 N -1.50 -0.05 -0.05 2.72 2.12 0.33 -1.32 118.70 120.94 2i3t s GLU 221 Ca 0.03 0.24 0.04 0.00 0.36 0.00 0.00 54.97 55.63 2i3t s GLU 221 Cb -0.09 -0.32 -0.03 0.00 0.26 0.00 0.00 34.13 33.96 2i3t s GLU 221 CO 0.02 -0.21 -0.14 -0.06 -0.54 0.00 0.00 175.26 174.33 2i3t s PHE 222 N 1.36 2.70 0.15 5.30 0.08 0.55 -1.47 117.98 126.65 2i3t s PHE 222 Ca -0.05 -0.18 0.06 0.00 0.12 0.00 0.00 56.93 56.88 2i3t s PHE 222 Cb -0.13 -1.63 -0.04 0.00 -0.57 0.00 0.00 43.02 40.65 2i3t s PHE 222 CO -0.03 0.17 0.04 -0.06 -0.10 0.00 0.00 175.22 175.23 2i3t s PHE 223 N -0.69 2.96 -0.02 0.36 2.99 -0.53 -0.27 117.98 122.78 2i3t s PHE 223 Ca 0.11 -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 0.04 0.00 0.00 0.00 0.00 43.02 41.50 2i3t s PHE 223 CO 0.01 0.51 0.86 -0.25 -0.00 0.00 0.00 175.22 176.35 2i3t n ASP 224 N -0.02 0.44 -3.98 1.36 8.00 -1.26 -4.82 116.55 116.27 2i3t n ASP 224 Ca -0.10 -1.82 -0.35 0.00 0.71 0.00 0.00 54.79 53.23 2i3t n ASP 224 Cb 0.54 -0.15 -0.07 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 -0.21 -1.46 0.00 -2.24 5.68 -1.26 -5.01 116.55 112.05 2i3t n ASP 225 Ca 0.02 -1.02 0.00 0.00 -0.50 0.00 0.00 54.79 53.29 2i3t n ASP 225 Cb 0.60 -1.30 0.00 0.00 -1.14 0.00 0.00 41.12 39.28 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 -1.86 2.75 -3.36 -1.12 2.88 -1.26 -5.32 113.62 106.32 2i3t n SER 232 Ca 0.09 0.00 0.02 0.00 -1.33 0.00 0.00 58.87 57.65 2i3t n SER 232 Cb 0.37 0.50 -0.04 0.00 -0.75 0.00 0.00 64.21 64.28 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 -1.28 -0.38 0.03 -3.46 1.04 -1.26 -4.63 113.70 103.75 2i3t s SER 233 Ca 0.00 0.54 -0.02 0.00 0.48 0.00 0.00 55.95 56.95 2i3t s SER 233 Cb 0.00 1.41 -0.04 0.00 0.10 0.00 0.00 66.02 67.48 2i3t s SER 233 CO 0.00 -0.08 0.22 -0.54 0.98 0.00 0.00 173.24 173.82 2i3t s LYS 234 N 2.17 3.47 0.01 4.02 1.02 0.62 -4.93 119.74 126.12 2i3t s LYS 234 Ca -0.02 -0.33 0.00 0.00 0.02 0.00 0.00 55.97 55.64 2i3t s LYS 234 Cb -0.04 -3.05 -0.01 0.00 -0.52 0.00 0.00 37.83 34.21 2i3t s LYS 234 CO -0.16 0.63 -0.01 0.50 -0.92 0.00 0.00 175.35 175.38 2i3t s ARG 235 N -2.21 0.15 0.02 1.68 3.52 -1.26 -0.33 118.95 120.53 2i3t s ARG 235 Ca 0.31 -0.30 -0.28 0.00 -0.13 0.00 0.00 55.73 55.33 2i3t s ARG 235 Cb -0.13 0.05 0.08 0.00 -1.56 0.00 0.00 34.95 33.39 2i3t s ARG 235 CO 0.23 -0.02 0.69 -0.59 -0.81 0.00 0.00 175.30 174.79 2i3t s PHE 236 N -0.72 -0.57 0.06 5.12 -0.12 -0.43 -5.01 117.98 116.31 2i3t s PHE 236 Ca -0.08 0.73 -0.01 0.00 -0.05 0.00 0.00 56.93 57.52 2i3t s PHE 236 Cb -0.05 0.48 -0.04 0.00 -0.63 0.00 0.00 43.02 42.78 2i3t s PHE 236 CO -0.00 -0.67 -0.02 0.00 -0.05 0.00 0.00 175.22 174.47 2i3t s ALA 237 N -2.28 0.57 0.00 1.99 0.00 -1.26 -0.56 121.76 120.23 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 0.35 0.03 0.00 0.00 0.00 0.00 23.12 23.49 2i3t s ALA 237 CO -0.01 -0.38 0.34 -0.59 0.00 0.00 0.00 175.76 175.12 2i3t s PHE 238 N -3.93 -0.20 0.26 0.00 -0.71 -0.85 -5.00 117.98 107.55 2i3t s PHE 238 Ca 0.10 0.26 -0.16 0.00 -1.04 0.00 0.00 56.93 56.08 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 -0.44 0.71 1.03 -1.34 0.00 0.00 175.22 175.09 2i3t s ARG 239 N -1.68 4.08 0.00 1.99 0.52 -1.26 -1.46 118.95 121.15 2i3t s ARG 239 Ca -0.11 0.71 0.00 0.00 -0.52 0.00 0.00 55.73 55.81 2i3t s ARG 239 Cb -0.04 -2.65 0.00 0.00 0.52 0.00 0.00 34.95 32.78 2i3t s ARG 239 CO 0.02 0.28 0.00 0.00 0.02 0.00 0.00 175.30 175.63 2i3t n HIS 241 N -1.03 3.53 -3.16 0.00 8.25 -1.26 -5.00 115.22 116.57 2i3t n HIS 241 Ca 0.00 -3.47 -0.19 0.00 -0.26 0.00 0.00 57.72 53.80 2i3t n HIS 241 Cb 0.00 -0.76 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 -3.68 2.54 -0.25 -0.41 3.00 -1.26 -0.72 118.95 118.17 2i3t s ARG 242 Ca 0.44 -1.50 -0.03 0.00 0.00 0.00 0.00 55.73 54.65 2i3t s ARG 242 Cb 0.23 -2.62 0.14 0.00 0.00 0.00 0.00 34.95 32.70 2i3t s ARG 242 CO -0.12 -0.52 0.38 -1.17 0.00 0.00 0.00 175.30 173.87 2i3t s LEU 243 N -4.44 -0.66 -0.60 2.53 2.96 0.22 -4.93 118.68 113.76 2i3t s LEU 243 Ca 0.55 0.24 -0.28 0.00 -0.22 0.00 0.00 54.13 54.42 2i3t s LEU 243 Cb -0.07 1.15 0.02 0.00 0.50 0.00 0.00 46.19 47.79 2i3t s LEU 243 CO 0.34 -0.30 1.36 0.20 -1.32 0.00 0.00 176.35 176.63 2i3t s ASN 244 N 2.55 6.17 0.00 3.68 0.01 -1.26 -2.13 114.94 123.97 2i3t s ASN 244 Ca 0.13 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 -0.16 -1.70 0.00 0.00 -1.51 0.00 0.00 177.10 173.72 2i3t n LEU 245 N 9.41 0.00 0.00 0.60 -0.00 -1.15 -5.04 117.00 120.81 2i3t n LEU 245 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.11 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 -4.76 118.16 116.50 2i3t n LYS 246 Ca 0.00 0.36 -0.22 0.00 -1.05 0.00 0.00 58.31 57.40 2i3t n LYS 246 Cb 0.00 -0.84 -0.14 0.00 -0.65 0.00 0.00 35.03 33.39 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 0.47 -0.69 -5.58 3.32 -2.01 -3.49 116.42 108.44 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 1.67 -0.51 0.42 -1.72 0.00 0.00 179.24 179.10 2i3t s THR 248 N -2.51 0.99 -0.26 0.35 -4.23 -1.26 -5.12 115.64 103.61 2i3t s THR 248 Ca -0.18 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.34 2i3t s THR 248 Cb 0.05 -2.11 0.05 0.00 1.34 0.00 0.00 72.50 71.82 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 -3.85 4.35 -0.09 3.99 0.02 -1.26 -2.95 114.94 115.14 2i3t s ASN 249 Ca 0.06 -1.24 -0.24 0.00 -1.02 0.00 0.00 52.86 50.42 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 0.04 -0.17 0.76 -0.22 0.02 0.00 0.00 177.10 177.52 2i3t s LEU 250 N 1.17 4.28 -0.15 0.60 2.96 -0.91 -4.91 118.68 121.72 2i3t s LEU 250 Ca -0.06 1.21 -0.03 0.00 -0.22 0.00 0.00 54.13 55.03 2i3t s LEU 250 Cb -0.19 -3.16 -0.02 0.00 0.50 0.00 0.00 46.19 43.32 2i3t s LEU 250 CO -0.05 -0.21 -0.05 0.00 -1.32 0.00 0.00 176.35 174.71 2i3t s ALA 251 N 1.23 2.93 0.21 5.97 0.00 -1.26 -0.61 121.76 130.22 2i3t s ALA 251 Ca 0.39 -0.85 0.05 0.00 0.00 0.00 0.00 51.96 51.55 2i3t s ALA 251 Cb -0.18 -1.51 -0.03 0.00 0.00 0.00 0.00 23.12 21.40 2i3t s ALA 251 CO 0.17 0.19 0.30 0.71 0.00 0.00 0.00 175.76 177.13 2i3t s TYR 252 N 0.41 3.39 0.36 0.00 1.51 0.10 -4.56 117.35 118.56 2i3t s TYR 252 Ca -0.05 0.01 -0.27 0.00 -1.01 0.00 0.00 57.07 55.75 2i3t s TYR 252 Cb -0.14 -1.57 -0.09 0.00 -0.11 0.00 0.00 41.96 40.04 2i3t s TYR 252 CO 0.03 0.48 1.24 -2.14 -1.11 0.00 0.00 175.55 174.05 2i3t s PRO 253 N -3.67 4.23 -0.61 -1.71 0.02 -0.91 0.04 135.00 132.40 2i3t s PRO 253 Ca 0.34 2.05 -0.16 0.00 0.02 0.00 0.00 61.00 63.25 2i3t s PRO 253 Cb -0.10 -2.92 0.15 0.00 0.02 0.00 0.00 34.50 31.66 2i3t s PRO 253 CO 0.28 -0.23 0.57 0.08 -0.33 0.00 0.00 177.00 177.36 2i3t s VAL 254 N -1.24 5.29 0.13 3.83 1.01 -0.45 -0.67 120.40 128.30 2i3t s VAL 254 Ca 0.52 -1.71 -0.06 0.00 0.00 0.00 0.00 61.98 60.73 2i3t s VAL 254 Cb -0.36 -4.37 -0.17 0.00 0.00 0.00 0.00 36.38 31.48 2i3t s VAL 254 CO 0.47 -0.91 1.31 0.78 0.00 0.00 0.00 175.10 176.75 2i3t h ASN 255 N 8.64 0.60 -3.42 3.32 2.35 -1.14 -3.40 115.58 122.53 2i3t h ASN 255 Ca -0.21 -0.46 -0.25 0.00 -0.55 0.00 0.00 56.30 54.84 2i3t h ASN 255 Cb 1.09 -0.18 -0.32 0.00 0.05 0.00 0.00 38.32 38.95 2i3t h ASN 255 CO 0.98 1.25 -0.61 -0.55 -1.65 0.00 0.00 177.43 176.84 2i3t s SER 256 N -7.09 -0.06 0.06 5.81 0.15 -1.10 -4.47 113.70 107.00 2i3t s SER 256 Ca -0.07 0.28 0.06 0.00 0.70 0.00 0.00 55.95 56.92 2i3t s SER 256 Cb 0.09 0.17 -0.03 0.00 -1.71 0.00 0.00 66.02 64.54 2i3t s SER 256 CO 0.87 -0.15 -0.16 0.27 1.20 0.00 0.00 173.24 175.27 2i3t s ILE 257 N 1.21 1.29 -0.07 6.45 -4.36 -1.26 -0.50 121.20 123.96 2i3t s ILE 257 Ca -0.09 -1.21 -0.31 0.00 -0.26 0.00 0.00 60.65 58.78 2i3t s ILE 257 Cb -0.12 -1.18 0.08 0.00 1.25 0.00 0.00 42.46 42.49 2i3t s ILE 257 CO -0.06 -0.05 0.73 -0.70 0.24 0.00 0.00 174.94 175.10 2i3t s GLU 258 N -1.46 0.99 -0.14 0.37 2.12 -0.35 -4.82 118.70 115.41 2i3t s GLU 258 Ca 0.02 0.24 -0.07 0.00 0.36 0.00 0.00 54.97 55.51 2i3t s GLU 258 Cb -0.09 0.47 -0.04 0.00 0.26 0.00 0.00 34.13 34.72 2i3t s GLU 258 CO 0.02 -0.31 0.12 -0.06 -0.54 0.00 0.00 175.26 174.50 2i3t s PHE 259 N -1.20 3.51 0.33 5.30 0.40 -1.26 -0.14 117.98 124.93 2i3t s PHE 259 Ca -0.09 0.45 -0.27 0.00 -0.60 0.00 0.00 56.93 56.41 2i3t s PHE 259 Cb -0.00 -1.98 -0.09 0.00 0.51 0.00 0.00 43.02 41.46 2i3t s PHE 259 CO 0.08 0.60 1.04 -1.54 0.70 0.00 0.00 175.22 176.11 2i3t s SER 260 N -0.68 7.09 0.26 1.36 1.04 -0.71 -4.85 113.70 117.22 2i3t s SER 260 Ca 0.13 2.07 -0.01 0.00 0.48 0.00 0.00 55.95 58.62 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 0.02 -0.25 1.76 -0.65 0.98 0.00 0.00 173.24 175.10 2i3t h PRO 261 N 3.18 0.74 0.00 4.02 0.11 -1.88 -2.22 132.00 135.95 2i3t h PRO 261 Ca -0.47 -0.21 0.00 0.00 0.11 0.00 0.00 66.00 65.43 2i3t h PRO 261 Cb 1.21 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2i3t h PRO 261 CO 0.65 0.78 -0.01 0.00 -0.21 0.00 0.00 178.00 179.21 2i3t h ARG 262 N 0.69 0.00 -0.02 1.05 3.08 -1.90 -3.39 114.38 113.89 2i3t h ARG 262 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.18 2i3t h ARG 262 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.53 2i3t h ARG 262 CO 0.02 0.00 0.00 0.72 -1.07 0.00 0.00 179.97 179.64 2i3t n HIS 263 N -2.28 0.03 -4.38 3.04 8.25 -1.26 -4.91 115.22 113.71 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 -0.07 0.00 1.12 0.00 0.00 29.99 31.05 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 -0.65 -1.52 -2.67 -0.41 5.02 -0.84 -4.93 118.16 112.16 2i3t n LYS 264 Ca 0.17 0.20 -0.26 0.00 -2.02 0.00 0.00 58.31 56.41 2i3t n LYS 264 Cb 0.12 -4.53 0.02 0.00 -0.02 0.00 0.00 35.03 30.62 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 -3.58 3.33 -0.31 2.13 2.99 -1.26 -4.76 117.98 116.52 2i3t s PHE 265 Ca 0.56 0.55 -0.09 0.00 0.00 0.00 0.00 56.93 57.95 2i3t s PHE 265 Cb -0.32 -2.47 -0.00 0.00 0.00 0.00 0.00 43.02 40.23 2i3t s PHE 265 CO 0.99 -0.52 0.14 -1.17 -0.00 0.00 0.00 175.22 174.67 2i3t s LEU 266 N -4.77 4.12 -0.20 -0.37 2.96 0.13 -1.73 118.68 118.81 2i3t s LEU 266 Ca 0.50 -0.61 -0.13 0.00 -0.22 0.00 0.00 54.13 53.67 2i3t s LEU 266 Cb -0.10 -1.98 -0.05 0.00 0.50 0.00 0.00 46.19 44.56 2i3t s LEU 266 CO 0.43 -0.21 0.27 -0.31 -1.32 0.00 0.00 176.35 175.21 2i3t s TYR 267 N 1.59 3.38 -0.04 5.38 1.51 0.80 -0.02 117.35 129.94 2i3t s TYR 267 Ca 0.04 0.47 0.06 0.00 -1.01 0.00 0.00 57.07 56.63 2i3t s TYR 267 Cb -0.17 -2.36 -0.02 0.00 -0.11 0.00 0.00 41.96 39.30 2i3t s TYR 267 CO 0.06 0.11 -0.23 0.95 -1.11 0.00 0.00 175.55 175.33 2i3t s THR 268 N 0.91 2.31 -0.15 -0.71 -4.23 -0.29 -1.21 115.64 112.27 2i3t s THR 268 Ca 0.14 -1.00 0.02 0.00 -1.18 0.00 0.00 61.69 59.67 2i3t s THR 268 Cb -0.13 -1.84 0.01 0.00 1.34 0.00 0.00 72.50 71.87 2i3t s THR 268 CO 0.05 0.58 -0.19 0.00 -0.54 0.00 0.00 174.62 174.51 2i3t s ALA 269 N -0.43 2.35 0.42 3.99 0.00 0.34 -0.84 121.76 127.58 2i3t s ALA 269 Ca 0.05 -1.10 0.07 0.00 0.00 0.00 0.00 51.96 50.98 2i3t s ALA 269 Cb -0.12 -1.10 -0.06 0.00 0.00 0.00 0.00 23.12 21.84 2i3t s ALA 269 CO 0.01 -0.08 0.09 0.20 0.00 0.00 0.00 175.76 175.99 2i3t s GLY 270 N 0.89 2.45 0.00 0.00 0.00 -0.96 -0.64 107.32 109.06 2i3t s GLY 270 Ca -0.05 -2.14 0.06 0.00 0.00 0.00 0.00 44.72 42.58 2i3t s GLY 270 CO -0.03 -2.02 1.10 1.44 0.00 0.00 0.00 173.10 173.60 2i3t n SER 271 N -1.11 0.00 -0.84 1.64 7.64 0.15 -2.17 113.62 118.94 2i3t n SER 271 Ca -0.04 -1.59 0.10 0.00 1.01 0.00 0.00 58.87 58.35 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 -0.60 2.48 0.00 6.43 5.75 -1.26 -4.51 116.55 124.84 2i3t n ASP 272 Ca 0.04 -1.89 0.00 0.00 -0.01 0.00 0.00 54.79 52.94 2i3t n ASP 272 Cb 0.02 -0.22 0.00 0.00 -1.03 0.00 0.00 41.12 39.89 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 1.28 0.44 3.51 6.12 0.00 -0.92 -5.00 105.19 110.62 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 -1.98 2.90 -0.17 -0.61 1.01 -1.26 -3.23 121.20 117.86 2i3t s ILE 274 Ca 0.00 -1.66 -0.01 0.00 0.00 0.00 0.00 60.65 58.97 2i3t s ILE 274 Cb 0.00 -2.39 -0.00 0.00 0.01 0.00 0.00 42.46 40.08 2i3t s ILE 274 CO 0.00 -0.03 -0.12 -0.63 0.00 0.00 0.00 174.94 174.17 2i3t s ILE 275 N -1.47 2.94 0.19 2.92 1.01 -1.26 -2.26 121.20 123.26 2i3t s ILE 275 Ca 0.21 -0.67 0.06 0.00 0.00 0.00 0.00 60.65 60.25 2i3t s ILE 275 Cb -0.09 -2.27 -0.04 0.00 0.01 0.00 0.00 42.46 40.07 2i3t s ILE 275 CO 0.12 0.49 0.14 -0.44 0.00 0.00 0.00 174.94 175.25 2i3t s SER 276 N 0.95 5.45 -0.12 3.58 0.01 -0.02 -1.74 113.70 121.82 2i3t s SER 276 Ca -0.02 -0.19 0.02 0.00 1.31 0.00 0.00 55.95 57.07 2i3t s SER 276 Cb -0.15 -1.39 0.01 0.00 0.21 0.00 0.00 66.02 64.70 2i3t s SER 276 CO -0.01 0.04 -0.19 0.00 0.41 0.00 0.00 173.24 173.49 2i3t s TRP 278 N 0.82 1.55 -0.46 0.00 0.52 0.97 -0.15 118.94 122.19 2i3t s TRP 278 Ca -0.09 -0.38 -0.09 0.00 0.02 0.00 0.00 56.10 55.56 2i3t s TRP 278 Cb -0.16 -0.90 0.12 0.00 -1.15 0.00 0.00 33.47 31.38 2i3t s TRP 278 CO -0.00 0.09 0.33 1.21 0.02 0.00 0.00 176.95 178.60 2i3t s ASN 279 N -1.34 5.66 0.27 2.95 3.84 0.54 0.17 114.94 127.04 2i3t s ASN 279 Ca 0.04 -1.90 0.05 0.00 0.21 0.00 0.00 52.86 51.26 2i3t s ASN 279 Cb -0.09 -1.99 0.38 0.00 -0.55 0.00 0.00 41.25 39.00 2i3t s ASN 279 CO 0.02 -0.67 1.66 -0.07 -2.79 0.00 0.00 177.10 175.24 2i3t h LEU 280 N 8.42 0.31 0.33 3.21 3.38 -1.87 0.24 115.31 129.33 2i3t h LEU 280 Ca -0.21 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.61 2i3t h LEU 280 Cb 1.07 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.74 2i3t h LEU 280 CO 0.84 0.72 -0.16 1.56 0.09 0.00 0.00 178.44 181.49 2i3t h GLN 281 N 0.24 -0.43 -0.00 1.13 7.50 -1.93 -2.60 115.11 119.01 2i3t h GLN 281 Ca 0.02 0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.20 2i3t h GLN 281 Cb 0.88 0.10 0.00 0.00 0.05 0.00 0.00 27.48 28.51 2i3t h GLN 281 CO 0.07 -0.20 -0.00 -2.37 -1.50 0.00 0.00 178.83 174.84 2i3t n THR 282 N -5.22 0.00 -4.12 -0.54 5.66 -1.21 -4.92 114.28 103.93 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 -0.49 -0.04 0.00 -1.55 0.00 0.00 70.33 68.49 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 -1.05 -2.72 -4.07 1.09 1.74 0.75 -4.97 116.66 107.42 2i3t n ARG 283 Ca 0.22 0.33 -0.13 0.00 -0.77 0.00 0.00 57.85 57.49 2i3t n ARG 283 Cb 0.14 -4.51 -0.11 0.00 -1.02 0.00 0.00 32.46 26.96 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 -6.84 0.54 -0.27 5.56 1.02 -0.60 -5.00 119.74 114.15 2i3t s LYS 284 Ca 0.23 -0.76 -0.24 0.00 0.02 0.00 0.00 55.97 55.22 2i3t s LYS 284 Cb -0.13 -0.31 -0.00 0.00 -0.52 0.00 0.00 37.83 36.87 2i3t s LYS 284 CO 0.93 0.05 0.82 0.21 -0.92 0.00 0.00 175.35 176.44 2i3t s LYS 285 N -1.57 4.09 -0.05 1.68 2.20 -1.26 -0.34 119.74 124.49 2i3t s LYS 285 Ca -0.10 0.81 -0.16 0.00 -0.36 0.00 0.00 55.97 56.16 2i3t s LYS 285 Cb -0.10 -3.68 -0.11 0.00 -1.51 0.00 0.00 37.83 32.43 2i3t s LYS 285 CO 0.00 -0.60 0.66 0.82 -0.36 0.00 0.00 175.35 175.88 2i3t h ILE 286 N 5.51 0.41 -2.47 5.43 5.03 -0.88 -3.48 117.51 127.06 2i3t h ILE 286 Ca -0.23 -0.91 -0.02 0.00 -0.12 0.00 0.00 64.86 63.57 2i3t h ILE 286 Cb 1.09 0.69 0.00 0.00 -3.03 0.00 0.00 36.82 35.58 2i3t h ILE 286 CO 0.88 0.11 0.11 2.29 -0.68 0.00 0.00 178.15 180.86 2i3t n LYS 287 N -4.99 0.48 -3.74 2.37 2.85 -1.16 -5.00 118.16 108.97 2i3t n LYS 287 Ca -0.06 -0.99 -0.15 0.00 -1.05 0.00 0.00 58.31 56.05 2i3t n LYS 287 Cb 0.22 1.21 -0.16 0.00 -0.65 0.00 0.00 35.03 35.65 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 -1.90 0.22 0.34 -5.58 0.02 -1.26 -1.33 114.94 105.45 2i3t s ASN 288 Ca 0.07 0.18 -0.16 0.00 -1.02 0.00 0.00 52.86 51.93 2i3t s ASN 288 Cb -0.02 0.06 -0.09 0.00 0.02 0.00 0.00 41.25 41.21 2i3t s ASN 288 CO 0.05 -0.17 0.77 -0.36 0.02 0.00 0.00 177.10 177.42 2i3t s PHE 289 N 1.40 3.37 0.44 2.20 0.40 -0.71 -4.99 117.98 120.09 2i3t s PHE 289 Ca -0.06 1.29 -0.25 0.00 -0.60 0.00 0.00 56.93 57.31 2i3t s PHE 289 Cb -0.12 -2.59 -0.09 0.00 0.51 0.00 0.00 43.02 40.73 2i3t s PHE 289 CO -0.04 0.06 1.38 0.00 0.70 0.00 0.00 175.22 177.32 2i3t n ALA 290 N -0.38 1.79 -1.65 5.36 0.00 -1.26 -4.30 120.51 120.07 2i3t n ALA 290 Ca 0.04 0.25 -0.53 0.00 0.00 0.00 0.00 53.44 53.20 2i3t n ALA 290 Cb 0.53 -2.35 -0.06 0.00 0.00 0.00 0.00 19.45 17.57 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 -0.11 1.31 -0.01 0.00 4.81 -1.26 -4.86 118.16 118.03 2i3t n LYS 291 Ca 0.06 0.48 -0.17 0.00 -0.87 0.00 0.00 58.31 57.80 2i3t n LYS 291 Cb 0.41 -2.16 -0.09 0.00 0.02 0.00 0.00 35.03 33.21 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 6.06 0.80 -0.85 5.64 -1.00 -1.88 -3.49 116.94 122.22 2i3t h PHE 292 Ca -0.47 -0.38 0.00 0.00 2.81 0.00 0.00 57.97 59.93 2i3t h PHE 292 Cb 1.32 -0.11 0.00 0.00 3.61 0.00 0.00 35.95 40.76 2i3t h PHE 292 CO 0.69 1.18 0.00 0.27 -1.61 0.00 0.00 178.31 178.84 2i3t n ASN 293 N -4.13 0.00 -0.16 2.17 0.23 -1.26 -5.02 115.26 107.08 2i3t n ASN 293 Ca -0.09 -0.17 0.15 0.00 -0.53 0.00 0.00 54.58 53.94 2i3t n ASN 293 Cb 0.68 0.00 0.79 0.00 -2.08 0.00 0.00 39.78 39.17 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 1.19 -3.57 -3.83 -0.58 -1.26 -4.88 120.64 107.71 2i3t n GLU 294 Ca 0.00 -0.33 -0.20 0.00 -0.42 0.00 0.00 57.16 56.21 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 -2.04 5.17 0.39 1.62 1.11 -1.26 -4.99 116.67 116.67 2i3t s ASP 295 Ca 0.43 -0.65 -0.24 0.00 0.18 0.00 0.00 52.55 52.27 2i3t s ASP 295 Cb 0.22 -0.68 -0.09 0.00 1.07 0.00 0.00 42.92 43.44 2i3t s ASP 295 CO 0.37 -0.59 1.02 -0.44 1.18 0.00 0.00 175.17 176.70 2i3t s SER 296 N -4.12 6.89 -0.49 0.27 0.01 -1.08 -4.07 113.70 111.10 2i3t s SER 296 Ca 0.47 1.97 -0.24 0.00 1.31 0.00 0.00 55.95 59.46 2i3t s SER 296 Cb -0.04 -2.58 0.03 0.00 0.21 0.00 0.00 66.02 63.64 2i3t s SER 296 CO 0.28 -0.40 0.86 -0.69 0.41 0.00 0.00 173.24 173.70 2i3t s VAL 297 N -1.69 4.53 -0.18 3.43 1.01 -0.94 -1.28 120.40 125.27 2i3t s VAL 297 Ca 0.57 0.37 0.22 0.00 0.00 0.00 0.00 61.98 63.14 2i3t s VAL 297 Cb -0.20 -4.43 -0.15 0.00 0.00 0.00 0.00 36.38 31.60 2i3t s VAL 297 CO 0.26 -0.90 0.80 0.52 0.00 0.00 0.00 175.10 175.78 2i3t n VAL 298 N 6.18 0.32 -3.72 2.92 0.31 -0.43 -4.04 118.33 119.87 2i3t n VAL 298 Ca 0.02 -0.50 -0.14 0.00 -0.01 0.00 0.00 64.34 63.72 2i3t n VAL 298 Cb 0.48 -0.14 -0.09 0.00 -0.91 0.00 0.00 33.84 33.17 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 -3.41 0.57 0.01 5.55 2.36 -1.18 -4.42 119.74 119.21 2i3t s LYS 299 Ca -0.03 0.47 -0.02 0.00 -2.55 0.00 0.00 55.97 53.83 2i3t s LYS 299 Cb 0.12 0.27 -0.01 0.00 -1.05 0.00 0.00 37.83 37.16 2i3t s LYS 299 CO 0.84 -0.10 0.03 0.96 1.55 0.00 0.00 175.35 178.63 2i3t s ILE 300 N -0.10 0.08 -0.01 5.43 -4.36 -1.26 -1.17 121.20 119.80 2i3t s ILE 300 Ca -0.03 -0.62 0.01 0.00 -0.26 0.00 0.00 60.65 59.75 2i3t s ILE 300 Cb -0.03 -0.25 0.00 0.00 1.25 0.00 0.00 42.46 43.43 2i3t s ILE 300 CO 0.02 -0.34 -0.04 0.00 0.24 0.00 0.00 174.94 174.81 2i3t s ALA 301 N -1.05 0.41 -0.07 2.27 0.00 -0.07 -4.91 121.76 118.34 2i3t s ALA 301 Ca -0.12 -0.15 0.04 0.00 0.00 0.00 0.00 51.96 51.74 2i3t s ALA 301 Cb -0.07 -0.15 -0.02 0.00 0.00 0.00 0.00 23.12 22.88 2i3t s ALA 301 CO -0.00 0.07 -0.19 0.00 0.00 0.00 0.00 175.76 175.64 2i3t n SER 303 N 2.80 2.15 0.10 0.00 2.88 0.00 -4.83 113.62 116.72 2i3t n SER 303 Ca -0.17 -2.19 -0.04 0.00 -1.33 0.00 0.00 58.87 55.14 2i3t n SER 303 Cb 0.52 0.33 0.14 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 0.74 0.22 0.00 -3.46 3.32 -1.99 -3.37 116.42 111.87 2i3t h ASP 304 Ca -0.21 -0.12 -0.06 0.00 0.02 0.00 0.00 57.03 56.66 2i3t h ASP 304 Cb 0.68 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 2i3t h ASP 304 CO 0.34 0.75 -1.41 0.59 -1.72 0.00 0.00 179.24 177.79 2i3t n ASN 305 N -3.88 3.26 -4.34 6.45 4.13 -1.26 -4.89 115.26 114.73 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 0.60 1.03 -0.10 0.00 -1.54 0.00 0.00 39.78 39.77 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 1.54 -0.17 2.41 -4.36 -1.26 -0.75 121.20 116.26 2i3t s ILE 306 Ca -0.03 -2.15 -0.00 0.00 -0.26 0.00 0.00 60.65 58.20 2i3t s ILE 306 Cb 0.04 -2.10 0.04 0.00 1.25 0.00 0.00 42.46 41.69 2i3t s ILE 306 CO 0.30 -0.55 -0.06 -0.22 0.24 0.00 0.00 174.94 174.65 2i3t s LEU 307 N -3.31 1.68 -0.19 0.37 0.20 -0.88 -0.82 118.68 115.73 2i3t s LEU 307 Ca 0.23 -0.67 -0.08 0.00 0.69 0.00 0.00 54.13 54.30 2i3t s LEU 307 Cb 0.01 -0.95 -0.04 0.00 -0.43 0.00 0.00 46.19 44.78 2i3t s LEU 307 CO 0.07 -0.17 0.08 0.00 -0.29 0.00 0.00 176.35 176.03 2i3t s LEU 309 N 0.43 2.46 -0.01 0.00 2.34 -0.30 -0.89 118.68 122.72 2i3t s LEU 309 Ca 0.04 -0.90 0.04 0.00 0.06 0.00 0.00 54.13 53.37 2i3t s LEU 309 Cb -0.12 -0.46 -0.01 0.00 -0.56 0.00 0.00 46.19 45.04 2i3t s LEU 309 CO 0.00 -0.23 -0.14 0.00 -1.06 0.00 0.00 176.35 174.93 2i3t s ALA 310 N -2.66 1.14 -0.07 1.48 0.00 -0.32 -0.82 121.76 120.51 2i3t s ALA 310 Ca 0.12 -0.59 0.03 0.00 0.00 0.00 0.00 51.96 51.52 2i3t s ALA 310 Cb -0.02 -0.29 -0.02 0.00 0.00 0.00 0.00 23.12 22.79 2i3t s ALA 310 CO 0.02 0.28 -0.16 0.95 0.00 0.00 0.00 175.76 176.86 2i3t s THR 311 N -0.32 2.91 0.06 0.00 -4.23 -0.02 -1.32 115.64 112.73 2i3t s THR 311 Ca 0.05 -0.76 -0.04 0.00 -1.18 0.00 0.00 61.69 59.77 2i3t s THR 311 Cb -0.05 -2.15 -0.03 0.00 1.34 0.00 0.00 72.50 71.61 2i3t s THR 311 CO -0.01 0.57 0.05 -0.44 -0.54 0.00 0.00 174.62 174.25 2i3t s SER 312 N -0.38 0.35 -0.45 3.99 0.01 -0.40 -1.44 113.70 115.37 2i3t s SER 312 Ca 0.04 -0.86 -0.25 0.00 1.31 0.00 0.00 55.95 56.19 2i3t s SER 312 Cb -0.12 0.25 0.03 0.00 0.21 0.00 0.00 66.02 66.38 2i3t s SER 312 CO 0.02 -0.63 0.91 -0.62 0.41 0.00 0.00 173.24 173.32 2i3t s ASP 313 N -2.85 6.51 -0.22 2.44 -1.08 -1.26 -2.62 116.67 117.59 2i3t s ASP 313 Ca 0.05 0.14 0.13 0.00 -0.52 0.00 0.00 52.55 52.35 2i3t s ASP 313 Cb 0.06 -2.44 0.45 0.00 -1.46 0.00 0.00 42.92 39.53 2i3t s ASP 313 CO -0.10 -1.01 1.34 -0.90 0.52 0.00 0.00 175.17 175.02 2i3t n ASP 314 N 7.07 2.53 0.13 -0.34 3.85 -1.26 -4.65 116.55 123.87 2i3t n ASP 314 Ca 0.06 -3.54 0.10 0.00 -0.71 0.00 0.00 54.79 50.70 2i3t n ASP 314 Cb 0.48 -0.56 0.49 0.00 -1.35 0.00 0.00 41.12 40.19 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 -1.07 1.01 0.32 2.12 -2.24 -1.26 -1.71 114.28 111.45 2i3t n THR 315 Ca 0.25 0.46 0.21 0.00 -2.27 0.00 0.00 64.05 62.70 2i3t n THR 315 Cb 0.86 -1.42 1.10 0.00 -2.10 0.00 0.00 70.33 68.77 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 -0.59 116.94 119.14 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 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.13 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 -3.21 0.10 -0.01 6.09 2.85 -0.70 -1.97 118.16 121.33 2i3t n LYS 317 Ca -0.03 0.22 0.08 0.00 -1.05 0.00 0.00 58.31 57.54 2i3t n LYS 317 Cb 0.11 -1.50 -0.12 0.00 -0.65 0.00 0.00 35.03 32.87 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 -1.38 0.00 -1.29 0.58 -1.04 -0.23 -5.03 114.28 105.90 2i3t n THR 318 Ca 0.05 -0.31 -0.38 0.00 -2.04 0.00 0.00 64.05 61.37 2i3t n THR 318 Cb 0.12 0.36 0.04 0.00 -1.82 0.00 0.00 70.33 69.03 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 -1.89 -2.44 -0.03 8.00 4.13 -0.83 -4.92 115.26 117.27 2i3t n ASN 319 Ca -0.01 0.61 -0.15 0.00 1.68 0.00 0.00 54.58 56.70 2i3t n ASN 319 Cb 0.39 -1.04 -0.09 0.00 -1.54 0.00 0.00 39.78 37.51 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 -0.15 0.19 -3.52 5.41 0.00 -1.95 -3.46 119.26 115.78 2i3t h ALA 320 Ca -0.44 -0.47 -0.37 0.00 0.00 0.00 0.00 54.91 53.62 2i3t h ALA 320 Cb 1.39 -0.01 -0.23 0.00 0.00 0.00 0.00 17.79 18.93 2i3t h ALA 320 CO 0.42 0.31 -0.77 0.00 0.00 0.00 0.00 179.25 179.21 2i3t s ALA 321 N -3.72 0.92 0.24 0.00 0.00 -1.26 -5.06 121.76 112.88 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 -0.09 0.40 0.00 0.00 0.00 0.00 23.12 23.49 2i3t s ALA 321 CO 0.81 0.12 1.78 0.97 0.00 0.00 0.00 175.76 179.44 2i3t h ILE 322 N 4.50 0.82 0.00 0.00 -0.00 -1.96 -1.81 117.51 119.07 2i3t h ILE 322 Ca -0.37 -0.22 0.00 0.00 -0.00 0.00 0.00 64.86 64.27 2i3t h ILE 322 Cb 1.19 0.12 0.00 0.00 -0.00 0.00 0.00 36.82 38.13 2i3t h ILE 322 CO 0.43 0.12 0.00 -0.90 -0.00 0.00 0.00 178.15 177.79 2i3t n ASP 323 N -4.84 0.00 -4.76 2.19 5.75 -1.26 -4.87 116.55 108.76 2i3t n ASP 323 Ca 0.13 -1.24 -0.36 0.00 -0.01 0.00 0.00 54.79 53.31 2i3t n ASP 323 Cb 0.32 0.00 0.03 0.00 -1.03 0.00 0.00 41.12 40.44 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 3.11 1.18 0.11 0.74 -0.68 -5.00 119.66 117.13 2i3t s GLN 324 Ca 0.06 1.85 -0.16 0.00 0.05 0.00 0.00 55.36 57.17 2i3t s GLN 324 Cb 0.03 -2.03 0.23 0.00 1.10 0.00 0.00 33.01 32.34 2i3t s GLN 324 CO 0.05 -1.10 0.60 2.41 -0.55 0.00 0.00 175.29 176.70 2i3t n THR 325 N -1.37 0.00 -3.63 -0.34 -1.04 -1.26 -5.04 114.28 101.60 2i3t n THR 325 Ca 0.12 -0.41 -0.15 0.00 -2.04 0.00 0.00 64.05 61.57 2i3t n THR 325 Cb 0.49 -0.84 -0.14 0.00 -1.82 0.00 0.00 70.33 68.02 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 -0.36 -0.72 12.58 1.01 -1.26 -5.07 121.20 125.07 2i3t s ILE 326 Ca 0.64 0.24 0.04 0.00 0.00 0.00 0.00 60.65 61.57 2i3t s ILE 326 Cb -0.20 -0.44 0.20 0.00 0.01 0.00 0.00 42.46 42.03 2i3t s ILE 326 CO 0.66 0.07 0.63 1.21 0.00 0.00 0.00 174.94 177.51 2i3t n GLU 327 N 5.34 2.20 -3.26 2.79 4.07 -1.26 -5.09 120.64 125.43 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 -1.82 4.35 0.93 4.31 1.02 -1.26 -5.08 118.68 121.14 2i3t s LEU 328 Ca 0.30 1.00 -0.11 0.00 0.02 0.00 0.00 54.13 55.34 2i3t s LEU 328 Cb 0.02 -2.81 0.15 0.00 0.02 0.00 0.00 46.19 43.56 2i3t s LEU 328 CO -0.11 0.06 1.09 0.20 0.02 0.00 0.00 176.35 177.61 2i3t s ASN 329 N 0.17 3.07 0.43 2.29 0.01 -1.26 -4.99 114.94 114.66 2i3t s ASN 329 Ca 0.29 1.71 -0.22 0.00 -0.71 0.00 0.00 52.86 53.92 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 -2.93 1.02 0.00 -1.51 0.00 0.00 177.10 173.83 2i3t s ALA 330 N -2.78 3.00 0.83 0.60 0.00 -1.26 -4.35 121.76 117.79 2i3t s ALA 330 Ca 0.65 0.61 -0.12 0.00 0.00 0.00 0.00 51.96 53.10 2i3t s ALA 330 Cb -0.20 -3.24 0.09 0.00 0.00 0.00 0.00 23.12 19.77 2i3t s ALA 330 CO 0.58 -0.18 1.11 -1.12 0.00 0.00 0.00 175.76 176.16 2i3t s SER 331 N -1.83 4.26 0.03 0.00 0.01 -0.04 -4.79 113.70 111.35 2i3t s SER 331 Ca 0.62 1.17 -0.00 0.00 1.31 0.00 0.00 55.95 59.04 2i3t s SER 331 Cb -0.17 -1.85 -0.03 0.00 0.21 0.00 0.00 66.02 64.18 2i3t s SER 331 CO 0.22 -2.10 -0.03 -0.44 0.41 0.00 0.00 173.24 171.30 2i3t s SER 332 N -4.00 0.37 -0.01 2.44 0.01 -0.52 -4.78 113.70 107.21 2i3t s SER 332 Ca 0.62 -0.74 0.01 0.00 1.31 0.00 0.00 55.95 57.15 2i3t s SER 332 Cb -0.14 0.15 -0.00 0.00 0.21 0.00 0.00 66.02 66.23 2i3t s SER 332 CO 0.54 -0.44 -0.04 -0.63 0.41 0.00 0.00 173.24 173.07 2i3t s ILE 333 N -2.62 0.34 0.07 1.44 1.01 -1.26 -0.84 121.20 119.33 2i3t s ILE 333 Ca -0.05 -0.17 0.01 0.00 0.00 0.00 0.00 60.65 60.44 2i3t s ILE 333 Cb -0.01 -0.30 -0.04 0.00 0.01 0.00 0.00 42.46 42.12 2i3t s ILE 333 CO -0.05 0.10 -0.05 -0.31 0.00 0.00 0.00 174.94 174.63 2i3t s TYR 334 N -0.02 0.68 -0.10 3.97 1.51 -0.00 -0.52 117.35 122.87 2i3t s TYR 334 Ca 0.01 -0.86 0.03 0.00 -1.01 0.00 0.00 57.07 55.24 2i3t s TYR 334 Cb -0.03 -0.43 0.01 0.00 -0.11 0.00 0.00 41.96 41.41 2i3t s TYR 334 CO -0.00 -0.21 -0.18 0.42 -1.11 0.00 0.00 175.55 174.46 2i3t s ILE 335 N -3.15 1.66 -0.50 2.71 1.01 -0.78 -1.15 121.20 121.00 2i3t s ILE 335 Ca 0.04 -0.77 -0.17 0.00 0.00 0.00 0.00 60.65 59.75 2i3t s ILE 335 Cb 0.02 -1.47 0.08 0.00 0.01 0.00 0.00 42.46 41.10 2i3t s ILE 335 CO -0.05 0.47 0.49 -0.63 0.00 0.00 0.00 174.94 175.22 2i3t s ILE 336 N 0.63 5.11 -0.04 2.92 -1.09 0.85 -2.08 121.20 127.50 2i3t s ILE 336 Ca -0.14 -0.97 -0.30 0.00 -2.23 0.00 0.00 60.65 57.02 2i3t s ILE 336 Cb -0.16 -4.22 -0.02 0.00 -1.58 0.00 0.00 42.46 36.47 2i3t s ILE 336 CO 0.04 -0.71 0.99 -0.36 -1.23 0.00 0.00 174.94 173.67 2i3t s PHE 337 N 1.96 3.60 -1.07 3.97 0.08 0.26 -2.08 117.98 124.71 2i3t s PHE 337 Ca 0.07 1.66 -0.04 0.00 0.12 0.00 0.00 56.93 58.74 2i3t s PHE 337 Cb -0.24 -3.14 -0.04 0.00 -0.57 0.00 0.00 43.02 39.03 2i3t s PHE 337 CO 0.07 -0.09 0.92 -0.25 -0.10 0.00 0.00 175.22 175.77 2i3t n ASP 338 N 4.32 -4.81 0.07 1.36 10.43 0.07 -1.04 116.55 126.96 2i3t n ASP 338 Ca 0.07 -0.65 0.11 0.00 2.57 0.00 0.00 54.79 56.89 2i3t n ASP 338 Cb 0.50 -5.02 0.45 0.00 1.84 0.00 0.00 41.12 38.90 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 -3.49 0.54 -1.63 1.24 0.18 -1.25 -3.46 117.16 109.29 2i3t n TYR 339 Ca -0.15 0.19 0.00 0.00 1.88 0.00 0.00 57.90 59.82 2i3t n TYR 339 Cb 0.63 -0.80 0.00 0.00 -0.38 0.00 0.00 39.34 38.79 2i3t n TYR 339 CO 0.00 0.00 0.00 -0.85 -2.08 0.00 0.00 176.86 173.93