#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i3s s GLN 2 N 0.00 1.17 -0.22 2.12 -1.52 -0.66 -4.96 119.66 115.58 2i3s s GLN 2 Ca 0.00 -0.22 -0.08 0.00 -1.95 0.00 0.00 55.36 53.10 2i3s s GLN 2 Cb 0.00 -1.07 -0.04 0.00 -0.22 0.00 0.00 33.01 31.68 2i3s s GLN 2 CO 0.00 -0.04 0.10 0.42 -0.25 0.00 0.00 175.29 175.51 2i3s s ILE 3 N 0.84 4.85 -0.09 1.08 1.01 -1.26 0.41 121.20 128.05 2i3s s ILE 3 Ca -0.12 0.00 0.03 0.00 0.00 0.00 0.00 60.65 60.56 2i3s s ILE 3 Cb -0.15 -3.24 0.00 0.00 0.01 0.00 0.00 42.46 39.09 2i3s s ILE 3 CO 0.01 0.39 -0.20 -0.69 0.00 0.00 0.00 174.94 174.45 2i3s s VAL 4 N 0.94 1.74 -0.05 2.92 1.01 -0.29 -4.97 120.40 121.71 2i3s s VAL 4 Ca 0.05 -0.83 -0.14 0.00 0.00 0.00 0.00 61.98 61.06 2i3s s VAL 4 Cb -0.14 -1.52 -0.05 0.00 0.00 0.00 0.00 36.38 34.67 2i3s s VAL 4 CO 0.03 0.49 0.35 -1.58 0.00 0.00 0.00 175.10 174.39 2i3s s GLN 5 N 0.46 3.93 0.09 2.72 0.74 -1.26 -0.18 119.66 126.16 2i3s s GLN 5 Ca -0.17 0.28 -0.30 0.00 0.05 0.00 0.00 55.36 55.21 2i3s s GLN 5 Cb -0.17 -3.26 -0.06 0.00 1.10 0.00 0.00 33.01 30.61 2i3s s GLN 5 CO 0.07 0.60 1.19 0.42 -0.55 0.00 0.00 175.29 177.02 2i3s s ILE 6 N -0.71 3.92 0.09 -2.34 1.09 0.57 -4.94 121.20 118.89 2i3s s ILE 6 Ca 0.21 1.44 -0.15 0.00 -1.10 0.00 0.00 60.65 61.06 2i3s s ILE 6 Cb -0.15 -3.92 -0.11 0.00 -1.06 0.00 0.00 42.46 37.22 2i3s s ILE 6 CO 0.10 0.15 1.37 -0.33 -0.10 0.00 0.00 174.94 176.13 2i3s h GLU 7 N 6.37 0.71 -4.01 2.79 5.08 -1.94 -3.41 114.58 120.18 2i3s h GLU 7 Ca -0.42 -0.45 -0.69 0.00 -1.00 0.00 0.00 59.36 56.80 2i3s h GLU 7 Cb 1.21 0.05 -0.36 0.00 0.50 0.00 0.00 28.75 30.15 2i3s h GLU 7 CO 0.79 1.07 -0.49 -0.65 -1.00 0.00 0.00 179.01 178.73 2i3s s GLN 8 N -4.12 2.19 0.09 2.33 -1.52 -1.26 -5.08 119.66 112.29 2i3s s GLN 8 Ca -0.12 -2.21 0.10 0.00 -1.95 0.00 0.00 55.36 51.18 2i3s s GLN 8 Cb 0.08 -3.59 -0.04 0.00 -0.22 0.00 0.00 33.01 29.25 2i3s s GLN 8 CO 0.85 -1.11 -0.25 0.00 -0.25 0.00 0.00 175.29 174.53 2i3s s ALA 9 N 0.47 2.40 0.59 6.09 0.00 -1.26 -5.04 121.76 125.00 2i3s s ALA 9 Ca 0.13 -1.35 -0.18 0.00 0.00 0.00 0.00 51.96 50.55 2i3s s ALA 9 Cb -0.22 -0.49 -0.06 0.00 0.00 0.00 0.00 23.12 22.36 2i3s s ALA 9 CO -0.04 0.55 0.86 -2.30 0.00 0.00 0.00 175.76 174.83 2i3s n PRO 10 N 1.28 0.81 0.02 0.00 -0.02 -1.26 -4.92 135.00 130.91 2i3s n PRO 10 Ca -0.17 0.31 -0.19 0.00 -2.02 0.00 0.00 63.50 61.43 2i3s n PRO 10 Cb 0.52 -2.05 -0.14 0.00 -0.02 0.00 0.00 33.50 31.81 2i3s n PRO 10 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2i3s h LYS 11 N 0.45 0.23 -7.18 -0.52 1.79 -1.97 -3.35 116.57 106.02 2i3s h LYS 11 Ca -0.48 -0.39 -0.45 0.00 -2.18 0.00 0.00 60.65 57.16 2i3s h LYS 11 Cb 1.37 0.14 0.20 0.00 -1.58 0.00 0.00 32.23 32.37 2i3s h LYS 11 CO 0.50 1.19 0.05 0.34 -1.08 0.00 0.00 179.45 180.44 2i3s s ASP 12 N -6.82 1.27 0.17 0.86 -1.08 -1.26 -0.58 116.67 109.23 2i3s s ASP 12 Ca -0.16 1.52 -0.33 0.00 -0.52 0.00 0.00 52.55 53.06 2i3s s ASP 12 Cb 0.00 -2.27 -0.15 0.00 -1.46 0.00 0.00 42.92 39.05 2i3s s ASP 12 CO 0.79 -4.02 1.27 0.00 0.52 0.00 0.00 175.17 173.73 2i3s n TYR 13 N -4.80 1.58 -3.18 -5.34 4.19 -1.26 -4.46 117.16 103.89 2i3s n TYR 13 Ca 0.04 0.59 -0.40 0.00 3.31 0.00 0.00 57.90 61.44 2i3s n TYR 13 Cb 0.54 -2.34 -0.07 0.00 0.49 0.00 0.00 39.34 37.97 2i3s n TYR 13 CO 0.00 0.00 0.00 0.42 0.91 0.00 0.00 176.86 178.19 2i3s s ILE 14 N 0.01 5.05 -0.12 2.97 1.01 -1.26 -1.22 121.20 127.64 2i3s s ILE 14 Ca 0.74 1.03 0.17 0.00 0.00 0.00 0.00 60.65 62.60 2i3s s ILE 14 Cb -0.81 -3.88 -0.20 0.00 0.01 0.00 0.00 42.46 37.57 2i3s s ILE 14 CO 0.50 0.11 0.57 -1.54 0.00 0.00 0.00 174.94 174.58 2i3s n SER 15 N 5.21 0.55 -3.47 3.58 3.41 -0.55 -4.78 113.62 117.56 2i3s n SER 15 Ca -0.03 0.25 -0.14 0.00 -0.26 0.00 0.00 58.87 58.69 2i3s n SER 15 Cb 0.50 0.55 -0.04 0.00 -0.26 0.00 0.00 64.21 64.96 2i3s n SER 15 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2i3s s ASP 16 N -5.60 -0.56 -0.04 4.04 2.15 -1.23 -4.73 116.67 110.70 2i3s s ASP 16 Ca -0.06 0.27 -0.01 0.00 0.43 0.00 0.00 52.55 53.19 2i3s s ASP 16 Cb 0.09 0.54 0.03 0.00 -0.30 0.00 0.00 42.92 43.27 2i3s s ASP 16 CO 0.83 -0.77 0.07 -0.63 -0.17 0.00 0.00 175.17 174.51 2i3s s ILE 17 N -2.63 -0.07 -0.03 4.11 1.01 -1.26 -2.26 121.20 120.08 2i3s s ILE 17 Ca -0.03 0.23 0.02 0.00 0.00 0.00 0.00 60.65 60.87 2i3s s ILE 17 Cb -0.01 -0.14 0.01 0.00 0.01 0.00 0.00 42.46 42.33 2i3s s ILE 17 CO -0.04 0.09 -0.08 -0.54 0.00 0.00 0.00 174.94 174.37 2i3s s LYS 18 N 1.22 0.95 -0.13 2.79 -0.14 -0.14 -4.74 119.74 119.56 2i3s s LYS 18 Ca -0.08 -0.27 -0.05 0.00 -1.36 0.00 0.00 55.97 54.22 2i3s s LYS 18 Cb -0.12 -0.89 -0.04 0.00 -1.68 0.00 0.00 37.83 35.10 2i3s s LYS 18 CO -0.04 0.07 0.04 0.42 -0.76 0.00 0.00 175.35 175.09 2i3s s ILE 19 N 0.33 4.66 -0.76 2.17 1.01 -1.26 -0.54 121.20 126.81 2i3s s ILE 19 Ca -0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 60.65 60.49 2i3s s ILE 19 Cb -0.10 -3.03 0.19 0.00 0.01 0.00 0.00 42.46 39.53 2i3s s ILE 19 CO 0.01 0.55 0.60 -0.63 0.00 0.00 0.00 174.94 175.46 2i3s s ILE 20 N -0.38 3.88 0.15 2.92 1.01 0.06 -4.99 121.20 123.84 2i3s s ILE 20 Ca 0.09 -3.56 -0.31 0.00 0.00 0.00 0.00 60.65 56.87 2i3s s ILE 20 Cb -0.12 -3.47 -0.08 0.00 0.01 0.00 0.00 42.46 38.80 2i3s s ILE 20 CO 0.02 -0.99 1.53 -0.65 0.00 0.00 0.00 174.94 174.85 2i3s h PRO 21 N 6.33 -0.09 -0.11 2.79 0.11 -1.96 -1.11 132.00 137.97 2i3s h PRO 21 Ca 0.08 0.01 0.03 0.00 0.11 0.00 0.00 66.00 66.23 2i3s h PRO 21 Cb 0.86 0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.99 2i3s h PRO 21 CO 0.78 -0.06 0.37 0.66 -0.21 0.00 0.00 178.00 179.54 2i3s h SER 22 N -0.09 0.00 0.00 -2.05 4.64 -1.97 -1.63 113.55 112.45 2i3s h SER 22 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2i3s h SER 22 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 2i3s h SER 22 CO -0.84 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 175.41 2i3s n LYS 23 N -3.11 2.13 -4.03 4.77 5.02 -0.73 -5.00 118.16 117.21 2i3s n LYS 23 Ca 0.01 -1.25 -0.29 0.00 -2.02 0.00 0.00 58.31 54.75 2i3s n LYS 23 Cb 0.45 -0.96 -0.02 0.00 -0.02 0.00 0.00 35.03 34.49 2i3s n LYS 23 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2i3s n SER 24 N -0.38 -1.74 -4.67 4.39 7.64 -0.50 -4.86 113.62 113.51 2i3s n SER 24 Ca 0.00 -0.98 -0.28 0.00 1.01 0.00 0.00 58.87 58.62 2i3s n SER 24 Cb 0.23 -3.07 -0.08 0.00 -1.01 0.00 0.00 64.21 60.28 2i3s n SER 24 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2i3s s LEU 25 N -7.09 3.35 -0.09 -3.43 1.43 -1.00 -1.37 118.68 110.47 2i3s s LEU 25 Ca 0.30 -0.31 0.01 0.00 -1.03 0.00 0.00 54.13 53.10 2i3s s LEU 25 Cb -0.16 -2.04 0.02 0.00 0.03 0.00 0.00 46.19 44.04 2i3s s LEU 25 CO 0.89 0.13 -0.11 -0.22 0.23 0.00 0.00 176.35 177.27 2i3s s LEU 26 N -2.66 1.45 -0.19 1.79 2.96 0.31 -0.76 118.68 121.59 2i3s s LEU 26 Ca 0.26 -0.32 -0.05 0.00 -0.22 0.00 0.00 54.13 53.80 2i3s s LEU 26 Cb -0.10 -0.87 -0.02 0.00 0.50 0.00 0.00 46.19 45.69 2i3s s LEU 26 CO 0.18 -0.04 -0.01 -0.76 -1.32 0.00 0.00 176.35 174.40 2i3s s LEU 27 N 1.20 3.26 -0.07 -0.68 1.43 0.30 -1.13 118.68 122.99 2i3s s LEU 27 Ca -0.04 -0.19 0.03 0.00 -1.03 0.00 0.00 54.13 52.90 2i3s s LEU 27 Cb -0.14 -1.82 0.01 0.00 0.03 0.00 0.00 46.19 44.27 2i3s s LEU 27 CO -0.03 0.08 -0.15 -0.63 0.23 0.00 0.00 176.35 175.86 2i3s s ILE 28 N 0.89 1.30 0.13 -0.59 -1.09 -0.17 -0.96 121.20 120.70 2i3s s ILE 28 Ca 0.01 -0.59 0.08 0.00 -2.23 0.00 0.00 60.65 57.91 2i3s s ILE 28 Cb -0.14 -1.16 -0.04 0.00 -1.58 0.00 0.00 42.46 39.53 2i3s s ILE 28 CO 0.02 0.39 -0.09 0.42 -1.23 0.00 0.00 174.94 174.45 2i3s s THR 29 N 0.50 3.35 0.08 2.92 -4.23 -0.96 0.36 115.64 117.66 2i3s s THR 29 Ca -0.13 -1.38 -0.05 0.00 -1.18 0.00 0.00 61.69 58.95 2i3s s THR 29 Cb -0.15 -2.60 -0.02 0.00 1.34 0.00 0.00 72.50 71.07 2i3s s THR 29 CO 0.04 0.04 0.08 -0.55 -0.54 0.00 0.00 174.62 173.70 2i3s s SER 30 N -2.41 0.30 0.00 3.99 0.15 -0.59 -1.48 113.70 113.65 2i3s s SER 30 Ca 0.23 -0.85 0.17 0.00 0.70 0.00 0.00 55.95 56.19 2i3s s SER 30 Cb -0.10 0.28 0.88 0.00 -1.71 0.00 0.00 66.02 65.36 2i3s s SER 30 CO 0.14 -0.67 1.48 0.79 1.20 0.00 0.00 173.24 176.18 2i3s n TRP 31 N 0.01 0.00 1.75 3.44 7.02 -0.36 -1.62 117.44 127.68 2i3s n TRP 31 Ca -0.14 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.46 2i3s n TRP 31 Cb 0.62 -0.24 0.62 0.00 -2.42 0.00 0.00 31.31 29.88 2i3s n TRP 31 CO 0.00 0.00 0.00 -0.40 -2.02 0.00 0.00 177.69 175.27 2i3s n ASP 32 N -1.24 0.62 0.00 -0.99 3.85 -1.26 -4.18 116.55 113.35 2i3s n ASP 32 Ca 0.09 -1.38 0.00 0.00 -0.71 0.00 0.00 54.79 52.78 2i3s n ASP 32 Cb 0.12 -0.02 0.00 0.00 -1.35 0.00 0.00 41.12 39.87 2i3s n ASP 32 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2i3s n GLY 33 N 0.99 0.73 3.93 6.12 0.00 -0.64 -4.79 105.19 111.53 2i3s n GLY 33 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 2i3s n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2i3s s SER 34 N -2.20 6.36 -0.18 1.61 1.04 -1.23 0.51 113.70 119.60 2i3s s SER 34 Ca 0.00 0.24 0.01 0.00 0.48 0.00 0.00 55.95 56.68 2i3s s SER 34 Cb 0.00 -1.94 0.02 0.00 0.10 0.00 0.00 66.02 64.20 2i3s s SER 34 CO 0.00 0.09 -0.19 -0.22 0.98 0.00 0.00 173.24 173.90 2i3s s LEU 35 N -2.93 2.20 -0.08 2.42 2.96 0.14 -1.54 118.68 121.83 2i3s s LEU 35 Ca 0.35 -0.69 0.03 0.00 -0.22 0.00 0.00 54.13 53.60 2i3s s LEU 35 Cb -0.12 -1.47 -0.02 0.00 0.50 0.00 0.00 46.19 45.08 2i3s s LEU 35 CO 0.28 -0.02 -0.17 -0.89 -1.32 0.00 0.00 176.35 174.24 2i3s s THR 36 N 1.29 2.75 -0.18 3.68 2.01 0.16 -1.13 115.64 124.21 2i3s s THR 36 Ca 0.04 -0.81 -0.04 0.00 0.31 0.00 0.00 61.69 61.20 2i3s s THR 36 Cb -0.13 -2.09 -0.02 0.00 0.01 0.00 0.00 72.50 70.27 2i3s s THR 36 CO -0.12 0.56 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.64 2i3s s VAL 37 N -0.15 3.75 0.17 3.82 1.01 0.11 -1.00 120.40 128.10 2i3s s VAL 37 Ca -0.02 -0.40 0.10 0.00 0.00 0.00 0.00 61.98 61.66 2i3s s VAL 37 Cb -0.14 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.54 2i3s s VAL 37 CO 0.04 0.47 -0.22 -0.31 0.00 0.00 0.00 175.10 175.07 2i3s s TYR 38 N 0.73 2.05 -0.06 5.22 1.51 -0.28 -0.82 117.35 125.68 2i3s s TYR 38 Ca -0.02 -0.41 0.05 0.00 -1.01 0.00 0.00 57.07 55.69 2i3s s TYR 38 Cb -0.14 -1.04 -0.01 0.00 -0.11 0.00 0.00 41.96 40.66 2i3s s TYR 38 CO 0.02 0.38 -0.24 0.21 -1.11 0.00 0.00 175.55 174.82 2i3s s LYS 39 N -2.57 2.54 0.27 -0.62 2.47 -0.43 -0.53 119.74 120.87 2i3s s LYS 39 Ca 0.16 -0.86 0.09 0.00 -1.56 0.00 0.00 55.97 53.80 2i3s s LYS 39 Cb -0.07 -2.11 -0.05 0.00 -1.46 0.00 0.00 37.83 34.13 2i3s s LYS 39 CO 0.08 0.33 -0.12 -0.59 0.16 0.00 0.00 175.35 175.20 2i3s s PHE 40 N -0.04 2.04 -0.27 4.03 -0.12 -0.47 -0.73 117.98 122.42 2i3s s PHE 40 Ca -0.07 -0.55 0.01 0.00 -0.05 0.00 0.00 56.93 56.28 2i3s s PHE 40 Cb -0.14 -1.04 0.08 0.00 -0.63 0.00 0.00 43.02 41.28 2i3s s PHE 40 CO 0.04 0.45 -0.00 0.34 -0.05 0.00 0.00 175.22 176.00 2i3s s ASP 41 N -3.45 4.05 0.61 1.98 3.68 -0.32 -4.81 116.67 118.41 2i3s s ASP 41 Ca 0.28 -1.45 0.39 0.00 2.13 0.00 0.00 52.55 53.90 2i3s s ASP 41 Cb 0.00 -1.20 1.98 0.00 -1.45 0.00 0.00 42.92 42.26 2i3s s ASP 41 CO 0.12 -0.30 2.22 0.16 0.13 0.00 0.00 175.17 177.50 2i3s h ILE 42 N 6.62 0.08 0.00 4.11 3.07 -1.97 0.28 117.51 129.70 2i3s h ILE 42 Ca -0.14 -0.22 -0.26 0.00 1.55 0.00 0.00 64.86 65.79 2i3s h ILE 42 Cb 1.05 1.20 -0.04 0.00 -0.27 0.00 0.00 36.82 38.76 2i3s h ILE 42 CO 0.44 0.01 -1.40 1.67 -1.05 0.00 0.00 178.15 177.82 2i3s n GLN 43 N -3.17 0.57 0.00 0.16 7.27 -1.26 -4.29 117.38 116.66 2i3s n GLN 43 Ca -0.02 0.54 0.13 0.00 0.07 0.00 0.00 57.00 57.73 2i3s n GLN 43 Cb 0.16 -1.72 0.49 0.00 2.41 0.00 0.00 30.24 31.58 2i3s n GLN 43 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2i3s n ALA 44 N -3.48 2.91 -3.52 1.69 0.00 -1.21 -4.97 120.51 111.92 2i3s n ALA 44 Ca -0.34 -0.27 -0.21 0.00 0.00 0.00 0.00 53.44 52.62 2i3s n ALA 44 Cb 0.71 -1.29 0.05 0.00 0.00 0.00 0.00 19.45 18.93 2i3s n ALA 44 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2i3s n LYS 45 N -1.20 -3.42 -4.15 0.00 5.02 0.97 -5.03 118.16 110.36 2i3s n LYS 45 Ca 0.10 0.69 -0.10 0.00 -2.02 0.00 0.00 58.31 56.98 2i3s n LYS 45 Cb 0.31 -5.22 -0.10 0.00 -0.02 0.00 0.00 35.03 30.00 2i3s n LYS 45 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2i3s s ASN 46 N -3.85 0.26 0.01 4.39 6.03 -1.18 -4.97 114.94 115.63 2i3s s ASN 46 Ca 0.26 -1.22 0.00 0.00 -1.03 0.00 0.00 52.86 50.86 2i3s s ASN 46 Cb -0.06 0.32 -0.01 0.00 -3.03 0.00 0.00 41.25 38.47 2i3s s ASN 46 CO 0.79 -0.77 -0.02 0.54 -2.03 0.00 0.00 177.10 175.61 2i3s s VAL 47 N -4.07 0.10 0.06 3.54 0.11 -1.26 -1.17 120.40 117.71 2i3s s VAL 47 Ca 0.27 -0.47 0.07 0.00 -2.93 0.00 0.00 61.98 58.92 2i3s s VAL 47 Cb 0.07 -0.17 -0.03 0.00 -1.53 0.00 0.00 36.38 34.72 2i3s s VAL 47 CO 0.04 -0.23 -0.19 -1.81 -3.33 0.00 0.00 175.10 169.58 2i3s s ASP 48 N -0.73 2.27 -0.25 3.54 1.01 0.09 -4.98 116.67 117.61 2i3s s ASP 48 Ca -0.07 -0.55 -0.26 0.00 0.71 0.00 0.00 52.55 52.38 2i3s s ASP 48 Cb -0.05 -0.16 0.00 0.00 1.01 0.00 0.00 42.92 43.72 2i3s s ASP 48 CO -0.00 0.10 0.88 -0.22 0.21 0.00 0.00 175.17 176.14 2i3s s LEU 49 N -1.36 4.08 -0.21 1.23 2.96 -1.26 -1.31 118.68 122.80 2i3s s LEU 49 Ca 0.05 1.07 -0.06 0.00 -0.22 0.00 0.00 54.13 54.98 2i3s s LEU 49 Cb -0.09 -3.27 -0.20 0.00 0.50 0.00 0.00 46.19 43.13 2i3s s LEU 49 CO 0.02 -0.58 0.00 0.18 -1.32 0.00 0.00 176.35 174.65 2i3s n LEU 50 N 6.14 2.60 -3.53 -0.68 4.32 -0.00 -4.96 117.00 120.88 2i3s n LEU 50 Ca 0.07 0.11 -0.07 0.00 -0.02 0.00 0.00 56.01 56.10 2i3s n LEU 50 Cb 0.47 -0.98 -0.02 0.00 -1.62 0.00 0.00 43.42 41.28 2i3s n LEU 50 CO 0.49 0.79 0.77 -1.58 -1.22 0.00 0.00 177.39 176.64 2i3s s GLN 51 N -2.51 0.70 -0.11 3.23 0.74 -0.94 -5.00 119.66 115.77 2i3s s GLN 51 Ca -0.31 -0.26 -0.05 0.00 0.05 0.00 0.00 55.36 54.79 2i3s s GLN 51 Cb 0.09 0.32 0.05 0.00 1.10 0.00 0.00 33.01 34.57 2i3s s GLN 51 CO 0.64 -0.31 0.24 0.45 -0.55 0.00 0.00 175.29 175.76 2i3s s SER 52 N -2.42 0.00 -0.06 6.67 0.15 -1.26 0.09 113.70 116.87 2i3s s SER 52 Ca 0.06 0.52 0.05 0.00 0.70 0.00 0.00 55.95 57.28 2i3s s SER 52 Cb -0.01 0.47 -0.02 0.00 -1.71 0.00 0.00 66.02 64.75 2i3s s SER 52 CO -0.08 -0.19 -0.20 -0.76 1.20 0.00 0.00 173.24 173.22 2i3s s LEU 53 N 1.68 2.40 -0.11 3.45 2.01 -0.29 -4.97 118.68 122.85 2i3s s LEU 53 Ca -0.05 -0.36 0.02 0.00 0.01 0.00 0.00 54.13 53.75 2i3s s LEU 53 Cb -0.11 -1.47 -0.01 0.00 0.01 0.00 0.00 46.19 44.62 2i3s s LEU 53 CO -0.08 0.28 -0.19 -0.60 1.01 0.00 0.00 176.35 176.77 2i3s s ARG 54 N -0.36 3.19 0.28 1.70 3.52 -1.26 -0.69 118.95 125.32 2i3s s ARG 54 Ca 0.03 -0.80 0.06 0.00 -0.13 0.00 0.00 55.73 54.90 2i3s s ARG 54 Cb -0.12 -2.44 -0.03 0.00 -1.56 0.00 0.00 34.95 30.80 2i3s s ARG 54 CO 0.02 0.20 0.31 -0.47 -0.81 0.00 0.00 175.30 174.55 2i3s s TYR 55 N 0.34 3.17 0.37 5.12 5.04 0.18 -4.97 117.35 126.60 2i3s s TYR 55 Ca -0.16 -0.14 0.24 0.00 -2.44 0.00 0.00 57.07 54.57 2i3s s TYR 55 Cb -0.17 -1.63 1.22 0.00 0.35 0.00 0.00 41.96 41.72 2i3s s TYR 55 CO 0.08 0.34 1.99 1.57 -1.34 0.00 0.00 175.55 178.18 2i3s h LYS 56 N 1.24 0.00 -6.60 4.97 2.10 -1.93 -3.42 116.57 112.94 2i3s h LYS 56 Ca -0.48 0.00 -0.65 0.00 -2.00 0.00 0.00 60.65 57.52 2i3s h LYS 56 Cb 1.24 0.00 -0.18 0.00 -0.90 0.00 0.00 32.23 32.39 2i3s h LYS 56 CO 0.59 0.18 -0.81 -1.01 -2.00 0.00 0.00 179.45 176.40 2i3s s HIS 57 N -4.14 2.37 0.26 0.07 3.76 -1.26 -4.96 115.29 111.40 2i3s s HIS 57 Ca -0.02 -0.33 -0.30 0.00 -0.15 0.00 0.00 55.06 54.26 2i3s s HIS 57 Cb 0.13 -1.18 -0.14 0.00 1.11 0.00 0.00 32.58 32.50 2i3s s HIS 57 CO 0.62 0.49 1.24 -2.30 -0.85 0.00 0.00 174.74 173.94 2i3s n PRO 58 N 0.27 1.72 -3.73 8.40 -0.02 -1.26 -4.18 135.00 136.20 2i3s n PRO 58 Ca -0.13 0.61 -0.36 0.00 -2.02 0.00 0.00 63.50 61.61 2i3s n PRO 58 Cb 0.56 -2.15 -0.08 0.00 -0.02 0.00 0.00 33.50 31.81 2i3s n PRO 58 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2i3s s LEU 59 N 0.05 4.25 -0.02 2.45 1.43 -0.86 -1.61 118.68 124.36 2i3s s LEU 59 Ca 0.64 0.31 0.16 0.00 -1.03 0.00 0.00 54.13 54.21 2i3s s LEU 59 Cb -0.68 -2.12 -0.25 0.00 0.03 0.00 0.00 46.19 43.16 2i3s s LEU 59 CO 0.55 0.21 0.38 0.18 0.23 0.00 0.00 176.35 177.90 2i3s n LEU 60 N 3.25 0.05 -3.81 1.79 4.77 0.10 -3.84 117.00 119.31 2i3s n LEU 60 Ca -0.16 -0.03 -0.05 0.00 -0.03 0.00 0.00 56.01 55.73 2i3s n LEU 60 Cb 0.52 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.60 2i3s n LEU 60 CO 0.36 0.01 0.59 0.00 -1.33 0.00 0.00 177.39 177.02 2i3s n ASN 63 N -0.36 -1.24 -3.78 0.00 2.85 -0.68 -4.71 115.26 107.34 2i3s n ASN 63 Ca -0.12 -1.72 -0.09 0.00 -0.11 0.00 0.00 54.58 52.54 2i3s n ASN 63 Cb 0.63 2.04 -0.03 0.00 1.24 0.00 0.00 39.78 43.65 2i3s n ASN 63 CO 0.00 0.00 0.00 0.72 -2.11 0.00 0.00 177.26 175.87 2i3s s PHE 64 N -3.76 -0.11 -0.13 1.20 -0.12 -1.26 -1.53 117.98 112.26 2i3s s PHE 64 Ca 0.14 -0.25 0.00 0.00 -0.05 0.00 0.00 56.93 56.77 2i3s s PHE 64 Cb -0.02 0.46 0.02 0.00 -0.63 0.00 0.00 43.02 42.85 2i3s s PHE 64 CO 0.05 -1.00 -0.12 0.42 -0.05 0.00 0.00 175.22 174.51 2i3s s ILE 65 N -3.89 1.39 -0.60 -4.49 1.01 0.07 -4.97 121.20 109.71 2i3s s ILE 65 Ca 0.11 -0.53 0.01 0.00 0.00 0.00 0.00 60.65 60.25 2i3s s ILE 65 Cb -0.02 -1.32 0.15 0.00 0.01 0.00 0.00 42.46 41.28 2i3s s ILE 65 CO 0.00 0.43 0.38 -0.62 0.00 0.00 0.00 174.94 175.13 2i3s s ASP 66 N 1.47 4.79 0.00 3.58 3.68 -1.26 -1.60 116.67 127.33 2i3s s ASP 66 Ca 0.03 -3.12 0.00 0.00 2.13 0.00 0.00 52.55 51.59 2i3s s ASP 66 Cb -0.13 -1.73 0.00 0.00 -1.45 0.00 0.00 42.92 39.61 2i3s s ASP 66 CO -0.08 -0.25 0.00 0.59 0.13 0.00 0.00 175.17 175.55 2i3s n ASN 67 N 3.03 0.00 -0.04 -0.34 3.02 -1.26 -4.94 115.26 114.74 2i3s n ASN 67 Ca 0.09 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.55 2i3s n ASN 67 Cb 0.35 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.49 2i3s n ASN 67 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 2i3s h THR 68 N 0.00 0.37 -3.60 3.41 2.02 -1.99 -3.43 112.91 109.69 2i3s h THR 68 Ca 0.00 0.00 -0.36 0.00 0.77 0.00 0.00 66.41 66.82 2i3s h THR 68 Cb 0.00 0.37 -0.14 0.00 -1.74 0.00 0.00 68.15 66.63 2i3s h THR 68 CO 0.00 0.00 -0.62 1.51 0.37 0.00 0.00 175.52 176.78 2i3s s ASP 69 N -5.01 1.42 -0.13 4.18 1.47 -1.26 -5.13 116.67 112.21 2i3s s ASP 69 Ca -0.15 -1.34 -0.23 0.00 1.18 0.00 0.00 52.55 52.01 2i3s s ASP 69 Cb 0.12 0.11 -0.03 0.00 -0.34 0.00 0.00 42.92 42.78 2i3s s ASP 69 CO 0.67 -0.67 0.73 -0.22 0.68 0.00 0.00 175.17 176.36 2i3s s LEU 70 N -3.32 4.23 -0.12 2.11 2.96 -1.26 -4.47 118.68 118.81 2i3s s LEU 70 Ca 0.35 1.10 -0.00 0.00 -0.22 0.00 0.00 54.13 55.36 2i3s s LEU 70 Cb 0.08 -3.09 0.03 0.00 0.50 0.00 0.00 46.19 43.70 2i3s s LEU 70 CO 0.12 -0.24 -0.08 -1.10 -1.32 0.00 0.00 176.35 173.73 2i3s s GLN 71 N 1.47 1.60 0.06 1.98 -0.21 -0.63 -5.01 119.66 118.93 2i3s s GLN 71 Ca 0.36 -0.32 0.09 0.00 0.02 0.00 0.00 55.36 55.50 2i3s s GLN 71 Cb -0.17 -1.70 -0.03 0.00 1.00 0.00 0.00 33.01 32.11 2i3s s GLN 71 CO 0.15 -0.29 -0.23 0.96 -2.12 0.00 0.00 175.29 173.76 2i3s s ILE 72 N 1.67 2.43 0.14 1.08 -5.25 -1.26 -0.75 121.20 119.27 2i3s s ILE 72 Ca 0.04 -1.36 0.07 0.00 -0.99 0.00 0.00 60.65 58.42 2i3s s ILE 72 Cb -0.13 -2.00 -0.04 0.00 2.95 0.00 0.00 42.46 43.24 2i3s s ILE 72 CO -0.08 0.31 -0.16 -0.31 -1.79 0.00 0.00 174.94 172.91 2i3s s TYR 73 N -0.89 1.60 0.10 1.37 1.51 -0.58 -0.23 117.35 120.21 2i3s s TYR 73 Ca 0.13 -0.52 0.02 0.00 -1.01 0.00 0.00 57.07 55.69 2i3s s TYR 73 Cb -0.10 -0.81 -0.04 0.00 -0.11 0.00 0.00 41.96 40.89 2i3s s TYR 73 CO 0.04 0.23 -0.06 0.14 -1.11 0.00 0.00 175.55 174.79 2i3s s VAL 74 N -2.10 0.66 0.09 0.71 -7.23 -0.15 -1.68 120.40 110.69 2i3s s VAL 74 Ca 0.12 -1.93 0.10 0.00 -1.81 0.00 0.00 61.98 58.46 2i3s s VAL 74 Cb -0.05 -1.70 -0.03 0.00 0.56 0.00 0.00 36.38 35.16 2i3s s VAL 74 CO 0.05 -0.86 -0.26 -0.83 -0.31 0.00 0.00 175.10 172.88 2i3s s GLY 75 N -3.04 1.48 0.24 2.32 0.00 -0.51 -0.36 107.32 107.45 2i3s s GLY 75 Ca 0.12 -1.36 0.10 0.00 0.00 0.00 0.00 44.72 43.58 2i3s s GLY 75 CO -0.05 -1.29 -0.07 -0.51 0.00 0.00 0.00 173.10 171.18 2i3s s THR 76 N -0.93 3.17 0.28 0.90 -4.23 0.06 -0.72 115.64 114.16 2i3s s THR 76 Ca 0.13 -1.95 0.36 0.00 -1.18 0.00 0.00 61.69 59.05 2i3s s THR 76 Cb -0.10 -2.65 0.37 0.00 1.34 0.00 0.00 72.50 71.46 2i3s s THR 76 CO 0.04 -0.31 2.09 1.62 -0.54 0.00 0.00 174.62 177.53 2i3s h VAL 77 N 2.22 0.00 -0.48 2.29 3.04 -1.61 -0.82 116.25 120.89 2i3s h VAL 77 Ca -0.44 -0.11 0.00 0.00 -1.01 0.00 0.00 66.70 65.14 2i3s h VAL 77 Cb 1.24 0.98 0.00 0.00 -2.01 0.00 0.00 31.29 31.49 2i3s h VAL 77 CO 0.58 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 177.14 2i3s n GLN 78 N -2.83 2.10 -0.52 4.17 1.13 -1.26 -2.89 117.38 117.28 2i3s n GLN 78 Ca -0.02 -1.71 0.00 0.00 -1.94 0.00 0.00 57.00 53.34 2i3s n GLN 78 Cb 0.12 -1.37 0.00 0.00 0.11 0.00 0.00 30.24 29.10 2i3s n GLN 78 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2i3s n GLY 79 N 1.26 0.75 3.86 1.08 0.00 -0.35 -4.73 105.19 107.06 2i3s n GLY 79 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 2i3s n GLY 79 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2i3s s GLU 80 N -0.48 3.89 -0.20 1.61 2.02 -1.25 -4.70 118.70 119.58 2i3s s GLU 80 Ca 0.00 0.44 -0.01 0.00 0.02 0.00 0.00 54.97 55.42 2i3s s GLU 80 Cb 0.00 -2.55 0.01 0.00 0.10 0.00 0.00 34.13 31.69 2i3s s GLU 80 CO 0.00 0.24 -0.13 0.42 0.02 0.00 0.00 175.26 175.82 2i3s s ILE 81 N -1.89 2.62 -0.10 -1.63 1.01 -1.26 -0.76 121.20 119.18 2i3s s ILE 81 Ca 0.50 -0.79 0.00 0.00 0.00 0.00 0.00 60.65 60.37 2i3s s ILE 81 Cb -0.11 -2.16 -0.02 0.00 0.01 0.00 0.00 42.46 40.18 2i3s s ILE 81 CO 0.20 0.46 -0.10 -0.76 0.00 0.00 0.00 174.94 174.74 2i3s s LEU 82 N 1.36 2.94 -0.03 2.97 1.43 0.51 -1.14 118.68 126.72 2i3s s LEU 82 Ca 0.05 -0.18 -0.22 0.00 -1.03 0.00 0.00 54.13 52.75 2i3s s LEU 82 Cb -0.14 -1.65 -0.04 0.00 0.03 0.00 0.00 46.19 44.39 2i3s s LEU 82 CO -0.09 0.26 0.66 -0.75 0.23 0.00 0.00 176.35 176.67 2i3s s LYS 83 N -0.22 4.41 -0.05 1.70 2.20 0.18 -0.97 119.74 126.98 2i3s s LYS 83 Ca 0.02 0.84 -0.09 0.00 -0.36 0.00 0.00 55.97 56.37 2i3s s LYS 83 Cb -0.13 -3.40 -0.05 0.00 -1.51 0.00 0.00 37.83 32.74 2i3s s LYS 83 CO 0.03 0.20 0.26 0.08 -0.36 0.00 0.00 175.35 175.55 2i3s s VAL 84 N 0.35 5.31 -0.26 4.02 1.01 0.68 -1.85 120.40 129.66 2i3s s VAL 84 Ca 0.35 0.40 0.01 0.00 0.00 0.00 0.00 61.98 62.74 2i3s s VAL 84 Cb -0.18 -3.54 0.07 0.00 0.00 0.00 0.00 36.38 32.73 2i3s s VAL 84 CO 0.18 0.54 -0.02 -0.62 0.00 0.00 0.00 175.10 175.18 2i3s s ASP 85 N -1.21 4.03 0.32 3.32 3.68 -0.27 -4.47 116.67 122.07 2i3s s ASP 85 Ca 0.21 -1.39 0.26 0.00 2.13 0.00 0.00 52.55 53.76 2i3s s ASP 85 Cb -0.14 -1.22 0.96 0.00 -1.45 0.00 0.00 42.92 41.07 2i3s s ASP 85 CO 0.10 -0.28 1.77 -0.07 0.13 0.00 0.00 175.17 176.82 2i3s h LEU 86 N 7.91 0.00 0.00 -1.34 4.07 -1.94 -3.40 115.31 120.62 2i3s h LEU 86 Ca -0.15 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.81 2i3s h LEU 86 Cb 1.06 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.80 2i3s h LEU 86 CO 0.44 0.00 -0.38 -0.38 -1.08 0.00 0.00 178.44 177.03 2i3s n ILE 87 N -2.49 0.86 -1.73 1.22 5.41 -1.26 -5.09 119.36 116.27 2i3s n ILE 87 Ca 0.03 0.27 -0.07 0.00 1.00 0.00 0.00 62.75 63.98 2i3s n ILE 87 Cb 0.32 -1.77 0.04 0.00 -0.71 0.00 0.00 39.64 37.52 2i3s n ILE 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2i3s n GLY 88 N 2.23 -0.34 3.31 7.39 0.00 -1.26 -5.05 105.19 111.46 2i3s n GLY 88 Ca -0.05 -1.81 -0.27 0.00 0.00 0.00 0.00 46.02 43.88 2i3s n GLY 88 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2i3s s SER 89 N -2.16 2.82 0.58 1.61 0.01 -1.26 -3.87 113.70 111.43 2i3s s SER 89 Ca 0.18 -0.61 -0.18 0.00 1.31 0.00 0.00 55.95 56.66 2i3s s SER 89 Cb -0.01 -0.22 -0.04 0.00 0.21 0.00 0.00 66.02 65.96 2i3s s SER 89 CO 0.13 0.18 1.12 -2.16 0.41 0.00 0.00 173.24 172.91 2i3s s PRO 90 N -1.46 3.19 0.24 12.44 0.04 -1.26 -5.09 135.00 143.10 2i3s s PRO 90 Ca 0.10 1.53 -0.01 0.00 0.04 0.00 0.00 61.00 62.65 2i3s s PRO 90 Cb -0.10 -1.99 0.28 0.00 0.04 0.00 0.00 34.50 32.73 2i3s s PRO 90 CO 0.03 -0.97 1.66 0.77 0.04 0.00 0.00 177.00 178.53 2i3s h SER 91 N 0.81 0.65 -4.37 6.66 0.02 -1.80 -3.42 113.55 112.10 2i3s h SER 91 Ca -0.49 -0.23 -0.70 0.00 -0.84 0.00 0.00 61.79 59.53 2i3s h SER 91 Cb 1.26 -0.18 -0.30 0.00 0.14 0.00 0.00 62.40 63.31 2i3s h SER 91 CO 0.56 0.88 -0.88 -0.36 -1.14 0.00 0.00 176.83 175.89 2i3s s PHE 92 N -4.53 2.38 -0.16 3.45 0.40 -1.26 -1.12 117.98 117.14 2i3s s PHE 92 Ca -0.08 -0.54 -0.02 0.00 -0.60 0.00 0.00 56.93 55.69 2i3s s PHE 92 Cb 0.13 -1.54 0.05 0.00 0.51 0.00 0.00 43.02 42.17 2i3s s PHE 92 CO 0.82 -0.10 -0.00 -1.14 0.70 0.00 0.00 175.22 175.50 2i3s s GLN 93 N -0.45 0.91 0.26 0.44 2.00 -0.77 -4.96 119.66 117.10 2i3s s GLN 93 Ca 0.05 -0.38 -0.30 0.00 -2.00 0.00 0.00 55.36 52.74 2i3s s GLN 93 Cb -0.11 -1.89 -0.10 0.00 0.80 0.00 0.00 33.01 31.71 2i3s s GLN 93 CO 0.01 -0.52 1.34 0.00 -0.50 0.00 0.00 175.29 175.62 2i3s s ALA 94 N 1.79 3.54 0.37 1.58 0.00 -1.26 -0.65 121.76 127.14 2i3s s ALA 94 Ca 0.00 1.22 -0.16 0.00 0.00 0.00 0.00 51.96 53.02 2i3s s ALA 94 Cb -0.16 -3.50 -0.09 0.00 0.00 0.00 0.00 23.12 19.37 2i3s s ALA 94 CO -0.07 -0.62 0.81 -0.51 0.00 0.00 0.00 175.76 175.37 2i3s s LEU 95 N -0.83 3.98 0.62 0.00 1.43 -0.29 -4.92 118.68 118.68 2i3s s LEU 95 Ca 0.54 1.40 -0.02 0.00 -1.03 0.00 0.00 54.13 55.02 2i3s s LEU 95 Cb -0.39 -4.23 0.05 0.00 0.03 0.00 0.00 46.19 41.65 2i3s s LEU 95 CO 0.45 -0.29 0.88 0.42 0.23 0.00 0.00 176.35 178.04 2i3s s THR 96 N -2.11 2.49 -1.78 5.49 -4.23 -0.64 -4.36 115.64 110.50 2i3s s THR 96 Ca 0.56 -0.50 0.00 0.00 -1.18 0.00 0.00 61.69 60.57 2i3s s THR 96 Cb -0.10 -2.99 0.00 0.00 1.34 0.00 0.00 72.50 70.75 2i3s s THR 96 CO 0.18 0.00 0.00 0.59 -0.54 0.00 0.00 174.62 174.85 2i3s n ASN 97 N -2.59 -5.05 -4.67 3.99 3.02 -1.26 -1.57 115.26 107.12 2i3s n ASN 97 Ca 0.08 0.38 -0.43 0.00 -0.03 0.00 0.00 54.58 54.59 2i3s n ASN 97 Cb 0.60 -4.07 -0.02 0.00 -0.61 0.00 0.00 39.78 35.68 2i3s n ASN 97 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2i3s s ASN 98 N -2.77 7.08 0.00 6.41 3.84 -1.26 -4.66 114.94 123.59 2i3s s ASN 98 Ca 0.00 1.52 0.22 0.00 0.21 0.00 0.00 52.86 54.81 2i3s s ASN 98 Cb 0.00 -2.54 0.26 0.00 -0.55 0.00 0.00 41.25 38.41 2i3s s ASN 98 CO 0.00 -0.64 1.26 -0.62 -2.79 0.00 0.00 177.10 174.31 2i3s n GLU 99 N 6.06 2.21 -2.06 0.43 1.02 -1.26 -4.98 120.64 122.06 2i3s n GLU 99 Ca 0.12 -1.97 -0.41 0.00 -0.02 0.00 0.00 57.16 54.87 2i3s n GLU 99 Cb 0.46 -1.45 -0.02 0.00 -0.02 0.00 0.00 31.44 30.41 2i3s n GLU 99 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2i3s s ALA 100 N -1.70 3.60 -0.44 0.62 0.00 -1.26 -4.91 121.76 117.67 2i3s s ALA 100 Ca 0.30 1.28 0.13 0.00 0.00 0.00 0.00 51.96 53.67 2i3s s ALA 100 Cb 0.20 -3.54 0.37 0.00 0.00 0.00 0.00 23.12 20.14 2i3s s ALA 100 CO 0.29 -0.70 1.29 0.09 0.00 0.00 0.00 175.76 176.73 2i3s n ASN 101 N 2.33 3.18 -3.93 0.00 3.02 -1.26 -4.86 115.26 113.73 2i3s n ASN 101 Ca 0.06 -2.54 -0.10 0.00 -0.03 0.00 0.00 54.58 51.98 2i3s n ASN 101 Cb 0.41 -0.36 -0.05 0.00 -0.61 0.00 0.00 39.78 39.17 2i3s n ASN 101 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2i3s s LEU 102 N -1.96 0.39 0.43 3.41 1.43 -1.26 -4.97 118.68 116.15 2i3s s LEU 102 Ca 0.30 -0.99 -0.23 0.00 -1.03 0.00 0.00 54.13 52.18 2i3s s LEU 102 Cb 0.22 1.72 -0.11 0.00 0.03 0.00 0.00 46.19 48.04 2i3s s LEU 102 CO 0.10 -1.15 0.75 0.61 0.23 0.00 0.00 176.35 176.88 2i3s n GLY 103 N -0.39 -0.94 3.53 -3.19 0.00 -1.14 -3.63 105.19 99.42 2i3s n GLY 103 Ca -0.01 0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 2i3s n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2i3s s ILE 104 N -1.39 4.44 -0.29 -0.61 -1.09 -0.98 -0.60 121.20 120.69 2i3s s ILE 104 Ca 0.64 0.37 0.22 0.00 -2.23 0.00 0.00 60.65 59.64 2i3s s ILE 104 Cb -0.58 -4.49 0.10 0.00 -1.58 0.00 0.00 42.46 35.91 2i3s s ILE 104 CO 0.57 -1.01 1.23 0.00 -1.23 0.00 0.00 174.94 174.49 2i3s s ARG 106 N -3.26 0.87 -0.15 0.00 1.81 -1.18 -4.72 118.95 112.32 2i3s s ARG 106 Ca 0.02 0.06 -0.03 0.00 -1.72 0.00 0.00 55.73 54.06 2i3s s ARG 106 Cb 0.08 0.40 0.05 0.00 -0.45 0.00 0.00 34.95 35.03 2i3s s ARG 106 CO 0.75 -0.26 0.04 0.42 -0.68 0.00 0.00 175.30 175.58 2i3s s ILE 107 N -1.23 0.31 0.28 1.52 1.01 -1.26 -0.94 121.20 120.89 2i3s s ILE 107 Ca -0.12 -0.27 0.08 0.00 0.00 0.00 0.00 60.65 60.34 2i3s s ILE 107 Cb -0.02 -0.77 -0.04 0.00 0.01 0.00 0.00 42.46 41.64 2i3s s ILE 107 CO 0.07 -0.11 0.14 0.00 0.00 0.00 0.00 174.94 175.04 2i3s s LYS 109 N -3.81 3.85 -0.35 0.00 -0.14 -1.26 -0.58 119.74 117.45 2i3s s LYS 109 Ca 0.34 1.84 -0.00 0.00 -1.36 0.00 0.00 55.97 56.79 2i3s s LYS 109 Cb -0.06 -2.52 0.13 0.00 -1.68 0.00 0.00 37.83 33.70 2i3s s LYS 109 CO 0.23 -0.49 0.20 -0.47 -0.76 0.00 0.00 175.35 174.06 2i3s s TYR 110 N -1.47 0.74 0.00 3.18 6.04 -0.71 -4.67 117.35 120.45 2i3s s TYR 110 Ca 0.61 -1.55 0.00 0.00 0.04 0.00 0.00 57.07 56.17 2i3s s TYR 110 Cb -0.30 -0.97 0.00 0.00 -1.04 0.00 0.00 41.96 39.64 2i3s s TYR 110 CO 0.37 -0.83 0.00 0.41 -1.54 0.00 0.00 175.55 173.97 2i3s n GLY 111 N 4.21 -0.09 0.00 8.97 0.00 -1.26 -2.42 105.19 114.61 2i3s n GLY 111 Ca 0.09 -0.99 0.10 0.00 0.00 0.00 0.00 46.02 45.23 2i3s n GLY 111 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2i3s n ASP 112 N -0.79 0.82 0.00 1.61 9.92 -1.26 -4.55 116.55 122.31 2i3s n ASP 112 Ca 0.00 -0.77 0.00 0.00 -0.53 0.00 0.00 54.79 53.49 2i3s n ASP 112 Cb 0.00 1.02 0.00 0.00 -0.64 0.00 0.00 41.12 41.50 2i3s n ASP 112 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 2i3s n ASP 113 N -1.61 0.67 -4.21 -2.24 5.75 -1.26 -4.70 116.55 108.96 2i3s n ASP 113 Ca 0.03 -1.33 -0.19 0.00 -0.01 0.00 0.00 54.79 53.29 2i3s n ASP 113 Cb 0.36 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 40.35 2i3s n ASP 113 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2i3s s LYS 114 N -0.33 1.55 0.05 0.11 1.02 -1.02 -4.56 119.74 116.57 2i3s s LYS 114 Ca 0.00 -1.87 -0.03 0.00 0.02 0.00 0.00 55.97 54.09 2i3s s LYS 114 Cb 0.00 -0.32 -0.03 0.00 -0.52 0.00 0.00 37.83 36.96 2i3s s LYS 114 CO 0.00 -0.35 0.03 -0.51 -0.92 0.00 0.00 175.35 173.60 2i3s s LEU 115 N -3.38 2.16 -0.06 3.17 1.43 -0.33 -1.74 118.68 119.93 2i3s s LEU 115 Ca 0.36 -0.82 0.02 0.00 -1.03 0.00 0.00 54.13 52.65 2i3s s LEU 115 Cb 0.07 0.42 0.02 0.00 0.03 0.00 0.00 46.19 46.72 2i3s s LEU 115 CO 0.15 -0.59 -0.10 -0.63 0.23 0.00 0.00 176.35 175.41 2i3s s ILE 116 N -3.52 0.98 0.10 -0.59 1.01 0.25 -0.14 121.20 119.29 2i3s s ILE 116 Ca 0.03 -0.38 0.05 0.00 0.00 0.00 0.00 60.65 60.34 2i3s s ILE 116 Cb 0.05 -0.91 -0.04 0.00 0.01 0.00 0.00 42.46 41.56 2i3s s ILE 116 CO -0.09 0.32 0.03 0.00 0.00 0.00 0.00 174.94 175.20 2i3s s ALA 117 N 0.75 3.37 0.01 9.38 0.00 0.11 -0.05 121.76 135.32 2i3s s ALA 117 Ca -0.13 -1.12 0.04 0.00 0.00 0.00 0.00 51.96 50.75 2i3s s ALA 117 Cb -0.15 -1.25 -0.01 0.00 0.00 0.00 0.00 23.12 21.70 2i3s s ALA 117 CO 0.03 0.68 -0.12 0.00 0.00 0.00 0.00 175.76 176.35 2i3s s ALA 118 N -1.39 0.95 0.20 0.00 0.00 -0.12 -0.55 121.76 120.86 2i3s s ALA 118 Ca 0.27 -0.57 0.09 0.00 0.00 0.00 0.00 51.96 51.75 2i3s s ALA 118 Cb -0.12 -0.21 -0.04 0.00 0.00 0.00 0.00 23.12 22.76 2i3s s ALA 118 CO 0.20 0.21 -0.05 -1.54 0.00 0.00 0.00 175.76 174.58 2i3s s SER 119 N -0.52 4.45 0.40 0.00 1.04 -0.51 -0.89 113.70 117.67 2i3s s SER 119 Ca 0.03 -0.55 0.11 0.00 0.48 0.00 0.00 55.95 56.02 2i3s s SER 119 Cb -0.05 -0.82 0.91 0.00 0.10 0.00 0.00 66.02 66.15 2i3s s SER 119 CO 0.00 0.08 1.96 -0.50 0.98 0.00 0.00 173.24 175.76 2i3s h TRP 120 N 2.62 0.58 -0.00 5.02 6.55 -1.01 -1.35 115.95 128.36 2i3s h TRP 120 Ca -0.46 0.02 0.00 0.00 0.95 0.00 0.00 58.89 59.39 2i3s h TRP 120 Cb 1.21 -0.19 0.00 0.00 -0.86 0.00 0.00 29.16 29.32 2i3s h TRP 120 CO 0.65 0.28 0.00 -0.40 -1.05 0.00 0.00 178.44 177.92 2i3s n ASP 121 N -4.48 0.31 0.00 -3.49 5.75 -1.26 -1.99 116.55 111.39 2i3s n ASP 121 Ca 0.11 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 52.89 2i3s n ASP 121 Cb 0.33 -0.15 0.00 0.00 -1.03 0.00 0.00 41.12 40.28 2i3s n ASP 121 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2i3s n GLY 122 N 0.36 0.70 3.89 6.12 0.00 -0.51 -4.82 105.19 110.93 2i3s n GLY 122 Ca 0.00 -0.57 -0.36 0.00 0.00 0.00 0.00 46.02 45.10 2i3s n GLY 122 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2i3s s LEU 123 N 0.00 4.38 -0.18 0.99 1.02 -1.25 -1.36 118.68 122.28 2i3s s LEU 123 Ca 0.00 0.45 0.01 0.00 0.02 0.00 0.00 54.13 54.61 2i3s s LEU 123 Cb 0.00 -2.33 0.04 0.00 0.02 0.00 0.00 46.19 43.92 2i3s s LEU 123 CO 0.00 0.34 -0.12 -0.63 0.02 0.00 0.00 176.35 175.97 2i3s s ILE 124 N -1.16 1.63 -0.00 -0.59 1.01 -0.53 -1.43 121.20 120.14 2i3s s ILE 124 Ca 0.21 -0.90 0.06 0.00 0.00 0.00 0.00 60.65 60.02 2i3s s ILE 124 Cb -0.12 -1.65 -0.02 0.00 0.01 0.00 0.00 42.46 40.68 2i3s s ILE 124 CO 0.10 0.26 -0.20 -1.61 0.00 0.00 0.00 174.94 173.50 2i3s s GLU 125 N 1.42 1.54 -0.03 2.79 2.02 0.29 -1.35 118.70 125.38 2i3s s GLU 125 Ca 0.01 -0.74 -0.16 0.00 0.02 0.00 0.00 54.97 54.10 2i3s s GLU 125 Cb -0.15 -1.51 -0.05 0.00 0.10 0.00 0.00 34.13 32.51 2i3s s GLU 125 CO -0.09 0.41 0.44 0.08 0.02 0.00 0.00 175.26 176.12 2i3s s VAL 126 N -0.52 5.04 -0.23 2.63 1.01 0.61 0.05 120.40 128.99 2i3s s VAL 126 Ca 0.07 0.90 -0.03 0.00 0.00 0.00 0.00 61.98 62.92 2i3s s VAL 126 Cb -0.08 -3.76 0.00 0.00 0.00 0.00 0.00 36.38 32.55 2i3s s VAL 126 CO -0.00 0.50 -0.04 -0.63 0.00 0.00 0.00 175.10 174.93 2i3s s ILE 127 N -0.59 3.26 -0.43 2.22 1.01 0.80 -2.16 121.20 125.31 2i3s s ILE 127 Ca 0.25 -0.66 0.05 0.00 0.00 0.00 0.00 60.65 60.29 2i3s s ILE 127 Cb -0.16 -2.54 0.18 0.00 0.01 0.00 0.00 42.46 39.94 2i3s s ILE 127 CO 0.13 0.34 0.42 -0.67 0.00 0.00 0.00 174.94 175.16 2i3s n ASP 128 N 4.77 -1.08 -0.30 3.58 2.03 -1.26 -1.19 116.55 123.10 2i3s n ASP 128 Ca -0.18 -2.49 0.23 0.00 0.52 0.00 0.00 54.79 52.87 2i3s n ASP 128 Cb 0.50 -0.08 0.53 0.00 -0.72 0.00 0.00 41.12 41.34 2i3s n ASP 128 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2i3s h PRO 129 N 5.46 0.36 -0.02 -0.67 0.13 -1.80 -0.93 132.00 134.51 2i3s h PRO 129 Ca 0.22 -0.02 -0.08 0.00 -0.87 0.00 0.00 66.00 65.25 2i3s h PRO 129 Cb 0.95 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.99 2i3s h PRO 129 CO 0.30 0.24 -0.34 0.00 -0.23 0.00 0.00 178.00 177.96 2i3s h ARG 130 N 0.37 0.04 0.00 0.86 3.08 -1.89 -2.82 114.38 114.02 2i3s h ARG 130 Ca 0.55 -0.02 -0.14 0.00 0.07 0.00 0.00 59.98 60.45 2i3s h ARG 130 Cb 1.46 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.48 2i3s h ARG 130 CO -0.23 0.38 -1.30 0.09 -1.07 0.00 0.00 179.97 177.84 2i3s n ASN 131 N -4.12 1.64 0.09 7.04 3.02 -0.65 -4.74 115.26 117.55 2i3s n ASN 131 Ca -0.02 0.27 0.13 0.00 -0.03 0.00 0.00 54.58 54.93 2i3s n ASN 131 Cb 0.39 -0.63 0.31 0.00 -0.61 0.00 0.00 39.78 39.24 2i3s n ASN 131 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 2i3s h TYR 132 N -0.76 0.00 0.00 3.10 0.05 -1.39 -3.50 116.97 114.48 2i3s h TYR 132 Ca -0.21 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.57 2i3s h TYR 132 Cb 1.03 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.77 2i3s h TYR 132 CO -0.23 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.29 2i3s n GLY 133 N 1.31 1.43 2.05 3.88 0.00 -1.06 -3.70 105.19 109.10 2i3s n GLY 133 Ca 0.05 -0.50 -0.16 0.00 0.00 0.00 0.00 46.02 45.40 2i3s n GLY 133 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2i3s n ASP 134 N 6.14 5.99 -3.98 1.61 8.00 -1.26 -4.38 116.55 128.68 2i3s n ASP 134 Ca 0.00 -2.86 -0.10 0.00 0.71 0.00 0.00 54.79 52.54 2i3s n ASP 134 Cb 0.00 -1.22 -0.06 0.00 -0.02 0.00 0.00 41.12 39.82 2i3s n ASP 134 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2i3s s GLY 135 N 0.98 0.53 0.53 0.44 0.00 -1.24 -1.62 107.32 106.94 2i3s s GLY 135 Ca 0.44 -0.88 0.01 0.00 0.00 0.00 0.00 44.72 44.29 2i3s s GLY 135 CO -0.07 -0.73 0.09 3.33 0.00 0.00 0.00 173.10 175.72 2i3s n VAL 136 N -0.31 0.00 -3.68 1.40 0.24 -0.61 -4.56 118.33 110.81 2i3s n VAL 136 Ca -0.04 -2.40 -0.19 0.00 -2.04 0.00 0.00 64.34 59.67 2i3s n VAL 136 Cb 0.63 0.38 -0.17 0.00 -1.47 0.00 0.00 33.84 33.20 2i3s n VAL 136 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2i3s s ILE 137 N -2.85 -0.15 -0.56 1.34 -1.09 -0.92 -4.75 121.20 112.23 2i3s s ILE 137 Ca 0.07 0.40 -0.28 0.00 -2.23 0.00 0.00 60.65 58.60 2i3s s ILE 137 Cb -0.01 -0.19 0.02 0.00 -1.58 0.00 0.00 42.46 40.71 2i3s s ILE 137 CO 0.04 0.17 1.33 0.00 -1.23 0.00 0.00 174.94 175.24 2i3s s ALA 138 N 2.13 2.89 -0.02 9.38 0.00 -1.26 -0.28 121.76 134.60 2i3s s ALA 138 Ca 0.04 -0.71 0.11 0.00 0.00 0.00 0.00 51.96 51.39 2i3s s ALA 138 Cb -0.12 -4.07 -0.23 0.00 0.00 0.00 0.00 23.12 18.70 2i3s s ALA 138 CO -0.04 -2.80 0.77 0.28 0.00 0.00 0.00 175.76 173.97 2i3s h VAL 139 N 6.29 1.00 -3.82 0.00 2.07 -1.58 -3.48 116.25 116.73 2i3s h VAL 139 Ca -0.26 -2.82 -0.17 0.00 0.82 0.00 0.00 66.70 64.27 2i3s h VAL 139 Cb 1.08 2.50 -0.22 0.00 -1.52 0.00 0.00 31.29 33.13 2i3s h VAL 139 CO 1.18 0.59 -0.64 -0.54 0.02 0.00 0.00 177.57 178.17 2i3s s LYS 140 N -2.62 0.33 -0.18 1.57 -0.14 -1.09 -5.02 119.74 112.58 2i3s s LYS 140 Ca -0.04 -0.48 -0.03 0.00 -1.36 0.00 0.00 55.97 54.06 2i3s s LYS 140 Cb 0.08 0.12 0.06 0.00 -1.68 0.00 0.00 37.83 36.41 2i3s s LYS 140 CO 0.82 -0.06 0.04 1.21 -0.76 0.00 0.00 175.35 176.61 2i3s s ASN 141 N -1.27 2.76 0.00 2.83 3.84 -1.26 -1.45 114.94 120.38 2i3s s ASN 141 Ca -0.14 -0.75 0.07 0.00 0.21 0.00 0.00 52.86 52.24 2i3s s ASN 141 Cb -0.08 -0.53 0.32 0.00 -0.55 0.00 0.00 41.25 40.40 2i3s s ASN 141 CO -0.00 -0.31 1.13 0.18 -2.79 0.00 0.00 177.10 175.31 2i3s n LEU 142 N 5.09 0.00 -0.36 3.21 4.77 -0.46 -2.25 117.00 126.99 2i3s n LEU 142 Ca -0.08 0.38 0.04 0.00 -0.03 0.00 0.00 56.01 56.31 2i3s n LEU 142 Cb 0.48 -0.38 0.10 0.00 -2.33 0.00 0.00 43.42 41.29 2i3s n LEU 142 CO 0.12 -0.29 0.58 0.59 -1.33 0.00 0.00 177.39 177.06 2i3s n ASN 143 N -1.38 2.59 0.00 -1.43 3.02 -1.26 -4.76 115.26 112.04 2i3s n ASN 143 Ca 0.02 -2.15 0.00 0.00 -0.03 0.00 0.00 54.58 52.43 2i3s n ASN 143 Cb 0.06 -0.18 0.00 0.00 -0.61 0.00 0.00 39.78 39.06 2i3s n ASN 143 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2i3s n SER 144 N -0.10 0.00 -0.01 6.41 7.64 -0.96 -5.23 113.62 121.38 2i3s n SER 144 Ca 0.08 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.96 2i3s n SER 144 Cb 0.40 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.60 2i3s n SER 144 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2i3s n ASN 151 N -0.16 -0.63 -4.40 6.43 5.03 -1.26 -5.14 115.26 115.13 2i3s n ASN 151 Ca 0.00 0.00 -0.23 0.00 0.87 0.00 0.00 54.58 55.22 2i3s n ASN 151 Cb 0.00 0.29 -0.11 0.00 -1.02 0.00 0.00 39.78 38.95 2i3s n ASN 151 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 2i3s s LYS 152 N -4.62 1.46 -0.24 3.52 1.02 -1.26 -4.16 119.74 115.46 2i3s s LYS 152 Ca 0.00 -1.58 -0.06 0.00 0.02 0.00 0.00 55.97 54.35 2i3s s LYS 152 Cb 0.00 -1.54 -0.02 0.00 -0.52 0.00 0.00 37.83 35.75 2i3s s LYS 152 CO 0.00 0.30 0.03 0.42 -0.92 0.00 0.00 175.35 175.18 2i3s s ILE 153 N -2.27 3.98 -0.17 2.17 1.01 -0.84 -3.00 121.20 122.08 2i3s s ILE 153 Ca 0.22 -0.30 0.19 0.00 0.00 0.00 0.00 60.65 60.75 2i3s s ILE 153 Cb -0.05 -2.86 -0.26 0.00 0.01 0.00 0.00 42.46 39.30 2i3s s ILE 153 CO 0.10 0.35 0.14 0.49 0.00 0.00 0.00 174.94 176.02 2i3s n PHE 154 N 4.88 0.00 -3.81 3.97 0.99 0.30 -4.12 117.46 119.67 2i3s n PHE 154 Ca -0.17 0.00 -0.09 0.00 -0.00 0.00 0.00 57.45 57.19 2i3s n PHE 154 Cb 0.51 -0.91 -0.03 0.00 -1.00 0.00 0.00 39.48 38.04 2i3s n PHE 154 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.76 176.68 2i3s s THR 155 N -2.66 0.01 -0.02 4.37 -1.32 -1.12 -4.96 115.64 109.95 2i3s s THR 155 Ca -0.10 -0.92 -0.29 0.00 -1.21 0.00 0.00 61.69 59.17 2i3s s THR 155 Cb 0.07 -1.79 0.08 0.00 -1.51 0.00 0.00 72.50 69.34 2i3s s THR 155 CO 0.84 -0.05 0.70 -0.32 -2.21 0.00 0.00 174.62 173.58 2i3s s MET 156 N -3.91 1.06 0.11 7.08 1.75 -1.26 -1.06 119.30 123.07 2i3s s MET 156 Ca 0.12 0.09 -0.10 0.00 -1.25 0.00 0.00 55.69 54.55 2i3s s MET 156 Cb -0.03 0.50 0.01 0.00 2.84 0.00 0.00 34.83 38.15 2i3s s MET 156 CO 0.02 -0.36 0.25 0.34 -0.65 0.00 0.00 175.02 174.61 2i3s s ASP 157 N -1.53 0.03 0.07 1.11 2.15 -0.35 -4.89 116.67 113.28 2i3s s ASP 157 Ca -0.07 -0.61 -0.12 0.00 0.43 0.00 0.00 52.55 52.17 2i3s s ASP 157 Cb -0.00 0.38 0.02 0.00 -0.30 0.00 0.00 42.92 43.01 2i3s s ASP 157 CO 0.04 -0.78 0.28 0.42 -0.17 0.00 0.00 175.17 174.97 2i3s s THR 158 N -3.86 0.10 0.00 1.71 -4.23 -1.26 -1.32 115.64 106.78 2i3s s THR 158 Ca 0.06 -0.82 0.00 0.00 -1.18 0.00 0.00 61.69 59.75 2i3s s THR 158 Cb 0.04 -1.10 0.00 0.00 1.34 0.00 0.00 72.50 72.78 2i3s s THR 158 CO -0.10 -0.45 0.00 -0.46 -0.54 0.00 0.00 174.62 173.07 2i3s n ASN 159 N 0.25 0.00 0.24 3.99 0.23 -0.60 -4.94 115.26 114.43 2i3s n ASN 159 Ca -0.17 -0.56 0.10 0.00 -0.53 0.00 0.00 54.58 53.41 2i3s n ASN 159 Cb 0.61 0.00 0.61 0.00 -2.08 0.00 0.00 39.78 38.92 2i3s n ASN 159 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2i3s h SER 160 N 0.00 0.00 0.00 0.53 4.64 -1.97 -3.32 113.55 113.44 2i3s h SER 160 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2i3s h SER 160 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2i3s h SER 160 CO 0.00 0.18 -0.15 -1.54 -0.87 0.00 0.00 176.83 174.46 2i3s n SER 161 N -3.80 0.18 -3.97 4.97 3.41 -1.26 -4.58 113.62 108.58 2i3s n SER 161 Ca -0.02 -0.56 -0.09 0.00 -0.26 0.00 0.00 58.87 57.94 2i3s n SER 161 Cb 0.28 1.00 -0.10 0.00 -0.26 0.00 0.00 64.21 65.14 2i3s n SER 161 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2i3s s ARG 162 N -1.28 0.50 -0.06 4.33 0.52 -1.25 -0.65 118.95 121.06 2i3s s ARG 162 Ca 0.01 -0.77 0.03 0.00 -0.52 0.00 0.00 55.73 54.48 2i3s s ARG 162 Cb 0.02 0.19 0.01 0.00 0.52 0.00 0.00 34.95 35.69 2i3s s ARG 162 CO 0.12 -0.11 -0.16 -1.17 0.02 0.00 0.00 175.30 174.00 2i3s s LEU 163 N -2.01 1.80 0.01 2.53 0.20 -0.41 -1.55 118.68 119.24 2i3s s LEU 163 Ca -0.07 -0.36 0.01 0.00 0.69 0.00 0.00 54.13 54.41 2i3s s LEU 163 Cb -0.03 -0.96 -0.01 0.00 -0.43 0.00 0.00 46.19 44.77 2i3s s LEU 163 CO -0.04 0.09 -0.05 -0.51 -0.29 0.00 0.00 176.35 175.55 2i3s s ILE 164 N 0.43 0.37 0.05 6.68 2.07 -0.43 -0.85 121.20 129.51 2i3s s ILE 164 Ca -0.12 -0.36 0.07 0.00 -1.41 0.00 0.00 60.65 58.83 2i3s s ILE 164 Cb -0.15 -0.34 -0.03 0.00 0.13 0.00 0.00 42.46 42.07 2i3s s ILE 164 CO 0.04 -0.00 -0.20 0.68 -1.91 0.00 0.00 174.94 173.55 2i3s s VAL 165 N -0.36 1.63 -0.22 4.00 -7.23 -0.24 -1.21 120.40 116.76 2i3s s VAL 165 Ca -0.01 -1.22 -0.13 0.00 -1.81 0.00 0.00 61.98 58.81 2i3s s VAL 165 Cb -0.03 -1.43 -0.04 0.00 0.56 0.00 0.00 36.38 35.44 2i3s s VAL 165 CO -0.00 0.16 0.28 -0.83 -0.31 0.00 0.00 175.10 174.40 2i3s s GLY 166 N -1.25 2.03 0.33 2.32 0.00 -0.22 -1.68 107.32 108.85 2i3s s GLY 166 Ca 0.07 -0.72 0.02 0.00 0.00 0.00 0.00 44.72 44.09 2i3s s GLY 166 CO 0.02 0.61 0.19 1.03 0.00 0.00 0.00 173.10 174.95 2i3s n MET 167 N 4.41 1.06 -1.39 2.90 2.81 0.71 -0.54 117.12 127.07 2i3s n MET 167 Ca -0.12 -2.15 -0.30 0.00 -1.81 0.00 0.00 57.70 53.33 2i3s n MET 167 Cb 0.52 0.32 0.12 0.00 -0.71 0.00 0.00 33.22 33.46 2i3s n MET 167 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2i3s s ASN 168 N -2.91 3.91 -1.16 7.83 4.22 -1.16 -3.70 114.94 121.97 2i3s s ASN 168 Ca 0.14 1.34 0.00 0.00 -2.14 0.00 0.00 52.86 52.20 2i3s s ASN 168 Cb -0.01 -2.04 0.00 0.00 1.28 0.00 0.00 41.25 40.48 2i3s s ASN 168 CO 0.09 -2.34 0.00 0.59 -2.04 0.00 0.00 177.10 173.40 2i3s n ASN 169 N -3.68 -4.15 -4.17 3.54 3.02 -1.26 -3.66 115.26 104.89 2i3s n ASN 169 Ca 0.07 0.08 -0.36 0.00 -0.03 0.00 0.00 54.58 54.34 2i3s n ASN 169 Cb 0.56 -3.18 -0.05 0.00 -0.61 0.00 0.00 39.78 36.50 2i3s n ASN 169 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2i3s n SER 170 N -0.32 -1.01 -4.13 6.41 3.41 -1.24 -4.96 113.62 111.77 2i3s n SER 170 Ca -0.14 -1.23 -0.16 0.00 -0.26 0.00 0.00 58.87 57.08 2i3s n SER 170 Cb 0.56 -1.51 -0.12 0.00 -0.26 0.00 0.00 64.21 62.88 2i3s n SER 170 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2i3s s GLN 171 N -7.27 0.72 0.23 4.33 -0.21 -1.24 -3.29 119.66 112.92 2i3s s GLN 171 Ca 0.19 -0.92 0.09 0.00 0.02 0.00 0.00 55.36 54.74 2i3s s GLN 171 Cb -0.11 -0.57 -0.04 0.00 1.00 0.00 0.00 33.01 33.29 2i3s s GLN 171 CO 0.95 0.11 -0.01 0.14 -2.12 0.00 0.00 175.29 174.36 2i3s s VAL 172 N -1.55 3.54 -0.03 1.09 -7.23 -0.12 -0.20 120.40 115.90 2i3s s VAL 172 Ca -0.03 -1.72 -0.01 0.00 -1.81 0.00 0.00 61.98 58.41 2i3s s VAL 172 Cb -0.09 -2.85 0.03 0.00 0.56 0.00 0.00 36.38 34.04 2i3s s VAL 172 CO 0.01 -0.26 0.06 -1.58 -0.31 0.00 0.00 175.10 173.01 2i3s s GLN 173 N -3.36 0.01 0.12 4.82 0.74 -0.68 -0.68 119.66 120.62 2i3s s GLN 173 Ca 0.29 0.20 0.06 0.00 0.05 0.00 0.00 55.36 55.97 2i3s s GLN 173 Cb -0.08 -0.18 -0.04 0.00 1.10 0.00 0.00 33.01 33.82 2i3s s GLN 173 CO 0.19 -0.14 -0.15 1.67 -0.55 0.00 0.00 175.29 176.32 2i3s s TRP 174 N 0.90 1.44 0.08 1.67 1.48 -0.75 -1.08 118.94 122.68 2i3s s TRP 174 Ca -0.07 -0.53 0.07 0.00 -1.06 0.00 0.00 56.10 54.51 2i3s s TRP 174 Cb -0.10 -0.76 -0.03 0.00 -1.16 0.00 0.00 33.47 31.42 2i3s s TRP 174 CO -0.03 0.15 -0.18 -0.06 -4.06 0.00 0.00 176.95 172.78 2i3s s PHE 175 N -1.97 1.51 0.48 1.66 0.40 -0.03 -1.30 117.98 118.74 2i3s s PHE 175 Ca 0.08 -0.43 -0.19 0.00 -0.60 0.00 0.00 56.93 55.79 2i3s s PHE 175 Cb -0.06 -0.85 -0.09 0.00 0.51 0.00 0.00 43.02 42.54 2i3s s PHE 175 CO 0.03 0.12 0.99 -0.98 0.70 0.00 0.00 175.22 176.09 2i3s s ARG 176 N -1.72 3.95 -0.04 0.44 1.70 -1.26 -1.29 118.95 120.73 2i3s s ARG 176 Ca 0.03 1.16 0.06 0.00 -0.47 0.00 0.00 55.73 56.51 2i3s s ARG 176 Cb -0.10 -2.13 -0.01 0.00 -0.57 0.00 0.00 34.95 32.14 2i3s s ARG 176 CO 0.03 -0.28 -0.23 -0.51 -1.08 0.00 0.00 175.30 173.23 2i3s s LEU 177 N -3.60 2.03 0.58 -1.89 1.43 0.18 -3.52 118.68 113.90 2i3s s LEU 177 Ca 0.63 -0.46 -0.20 0.00 -1.03 0.00 0.00 54.13 53.07 2i3s s LEU 177 Cb -0.12 -1.26 -0.04 0.00 0.03 0.00 0.00 46.19 44.80 2i3s s LEU 177 CO 0.21 0.25 1.30 -2.65 0.23 0.00 0.00 176.35 175.69 2i3s n PRO 178 N 2.83 1.44 -1.68 1.29 -0.02 -1.26 -4.43 135.00 133.18 2i3s n PRO 178 Ca -0.17 0.54 -0.45 0.00 -2.02 0.00 0.00 63.50 61.40 2i3s n PRO 178 Cb 0.52 -2.52 -0.03 0.00 -0.02 0.00 0.00 33.50 31.46 2i3s n PRO 178 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2i3s n LEU 179 N -1.23 3.20 -4.23 2.45 4.77 -1.23 -4.99 117.00 115.75 2i3s n LEU 179 Ca 0.12 1.14 -0.32 0.00 -0.03 0.00 0.00 56.01 56.92 2i3s n LEU 179 Cb 0.46 -1.44 -0.17 0.00 -2.33 0.00 0.00 43.42 39.94 2i3s n LEU 179 CO 0.51 -0.42 -0.56 0.00 -1.33 0.00 0.00 177.39 175.60 2i3s h GLU 181 N 6.66 0.00 -0.00 0.00 9.09 -1.95 -0.44 114.58 127.93 2i3s h GLU 181 Ca -0.20 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.21 2i3s h GLU 181 Cb 1.23 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.33 2i3s h GLU 181 CO 0.47 0.00 -0.01 -0.25 0.05 0.00 0.00 179.01 179.28 2i3s n ASP 182 N -4.44 0.01 -4.52 3.06 9.92 -1.26 -4.72 116.55 114.60 2i3s n ASP 182 Ca 0.02 0.26 -0.43 0.00 -0.53 0.00 0.00 54.79 54.12 2i3s n ASP 182 Cb 0.31 -0.42 -0.04 0.00 -0.64 0.00 0.00 41.12 40.33 2i3s n ASP 182 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2i3s s ASP 183 N -2.85 6.32 0.00 -2.24 3.68 -0.18 -4.88 116.67 116.52 2i3s s ASP 183 Ca 0.19 -0.41 0.20 0.00 2.13 0.00 0.00 52.55 54.65 2i3s s ASP 183 Cb 0.19 -2.44 0.76 0.00 -1.45 0.00 0.00 42.92 39.98 2i3s s ASP 183 CO 0.51 -1.29 1.54 0.59 0.13 0.00 0.00 175.17 176.66 2i3s n ASN 184 N 7.60 1.42 0.00 -0.34 5.03 -1.26 -4.89 115.26 122.82 2i3s n ASN 184 Ca 0.01 -1.69 0.00 0.00 0.87 0.00 0.00 54.58 53.77 2i3s n ASN 184 Cb 0.47 -0.10 0.00 0.00 -1.02 0.00 0.00 39.78 39.14 2i3s n ASN 184 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2i3s n GLY 185 N 1.07 -1.08 3.10 7.41 0.00 -1.26 -4.99 105.19 109.44 2i3s n GLY 185 Ca 0.15 -1.41 -0.32 0.00 0.00 0.00 0.00 46.02 44.44 2i3s n GLY 185 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2i3s s THR 186 N -2.81 2.00 0.01 2.61 -1.32 -0.42 -4.93 115.64 110.79 2i3s s THR 186 Ca 0.00 -1.00 -0.24 0.00 -1.21 0.00 0.00 61.69 59.24 2i3s s THR 186 Cb 0.00 -1.87 -0.05 0.00 -1.51 0.00 0.00 72.50 69.07 2i3s s THR 186 CO 0.00 0.44 0.71 -0.63 -2.21 0.00 0.00 174.62 172.93 2i3s s ILE 187 N 1.29 4.83 0.08 5.08 1.01 -1.26 -1.81 121.20 130.42 2i3s s ILE 187 Ca 0.03 1.50 0.00 0.00 0.00 0.00 0.00 60.65 62.18 2i3s s ILE 187 Cb -0.14 -4.06 -0.04 0.00 0.01 0.00 0.00 42.46 38.23 2i3s s ILE 187 CO -0.11 0.36 -0.04 -1.61 0.00 0.00 0.00 174.94 173.54 2i3s s GLU 188 N 0.04 0.74 0.43 2.79 2.02 0.14 -5.00 118.70 119.87 2i3s s GLU 188 Ca 0.36 -1.29 -0.24 0.00 0.02 0.00 0.00 54.97 53.82 2i3s s GLU 188 Cb -0.19 0.03 -0.08 0.00 0.10 0.00 0.00 34.13 33.99 2i3s s GLU 188 CO 0.21 -0.09 1.12 -1.21 0.02 0.00 0.00 175.26 175.31 2i3s s GLU 189 N -3.90 3.97 0.37 1.61 0.41 -1.26 -0.94 118.70 118.95 2i3s s GLU 189 Ca 0.11 1.67 0.23 0.00 -0.41 0.00 0.00 54.97 56.57 2i3s s GLU 189 Cb 0.07 -2.50 0.30 0.00 -1.78 0.00 0.00 34.13 30.22 2i3s s GLU 189 CO -0.07 -0.35 1.49 0.66 -0.49 0.00 0.00 175.26 176.51 2i3s h SER 190 N 2.31 0.00 0.00 -0.19 4.64 -1.89 -3.43 113.55 114.99 2i3s h SER 190 Ca -0.49 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 2i3s h SER 190 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2i3s h SER 190 CO 0.61 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.19 2i3s n GLY 191 N 1.14 0.76 3.33 -0.77 0.00 -1.26 -4.70 105.19 103.68 2i3s n GLY 191 Ca 0.03 -0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 2i3s n GLY 191 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2i3s s LEU 192 N 0.00 2.19 -0.05 0.99 1.43 -1.26 -4.82 118.68 117.15 2i3s s LEU 192 Ca 0.00 -0.59 -0.14 0.00 -1.03 0.00 0.00 54.13 52.36 2i3s s LEU 192 Cb 0.00 -1.20 -0.30 0.00 0.03 0.00 0.00 46.19 44.72 2i3s s LEU 192 CO 0.00 0.22 0.70 0.50 0.23 0.00 0.00 176.35 178.01 2i3s h LYS 193 N 4.70 0.36 -6.49 1.70 3.64 -1.97 -3.46 116.57 115.05 2i3s h LYS 193 Ca -0.46 -0.62 -0.48 0.00 -1.27 0.00 0.00 60.65 57.83 2i3s h LYS 193 Cb 1.15 0.23 0.02 0.00 -0.41 0.00 0.00 32.23 33.21 2i3s h LYS 193 CO 0.43 1.29 -0.18 0.71 -2.27 0.00 0.00 179.45 179.44 2i3s s TYR 194 N -2.53 1.91 0.10 1.91 1.51 -1.26 -4.81 117.35 114.18 2i3s s TYR 194 Ca -0.16 -0.63 -0.35 0.00 -1.01 0.00 0.00 57.07 54.92 2i3s s TYR 194 Cb 0.04 -2.23 -0.18 0.00 -0.11 0.00 0.00 41.96 39.48 2i3s s TYR 194 CO 0.84 -0.82 1.02 0.94 -1.11 0.00 0.00 175.55 176.42 2i3s n GLN 195 N -2.04 0.45 -2.78 -0.62 7.27 -1.26 -4.65 117.38 113.75 2i3s n GLN 195 Ca 0.11 0.16 -0.42 0.00 0.07 0.00 0.00 57.00 56.93 2i3s n GLN 195 Cb 0.61 -1.58 -0.03 0.00 2.41 0.00 0.00 30.24 31.65 2i3s n GLN 195 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 2i3s s ILE 196 N -0.20 4.90 -0.23 1.69 1.01 -1.26 -1.84 121.20 125.27 2i3s s ILE 196 Ca 0.80 1.94 -0.18 0.00 0.00 0.00 0.00 60.65 63.21 2i3s s ILE 196 Cb -1.05 -4.26 -0.15 0.00 0.01 0.00 0.00 42.46 37.01 2i3s s ILE 196 CO 0.54 0.18 -0.07 0.54 0.00 0.00 0.00 174.94 176.13 2i3s n ARG 197 N 3.89 0.57 -4.07 2.79 5.12 0.14 -4.92 116.66 120.19 2i3s n ARG 197 Ca 0.05 0.43 -0.09 0.00 -1.93 0.00 0.00 57.85 56.30 2i3s n ARG 197 Cb 0.51 -1.62 -0.09 0.00 -1.16 0.00 0.00 32.46 30.10 2i3s n ARG 197 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2i3s s ASP 198 N -7.03 0.25 0.00 0.55 2.15 -1.21 -4.69 116.67 106.68 2i3s s ASP 198 Ca -0.32 -1.04 -0.03 0.00 0.43 0.00 0.00 52.55 51.59 2i3s s ASP 198 Cb 0.09 0.32 -0.01 0.00 -0.30 0.00 0.00 42.92 43.03 2i3s s ASP 198 CO 0.52 -0.76 0.04 0.54 -0.17 0.00 0.00 175.17 175.35 2i3s s VAL 199 N -3.99 0.07 -0.13 1.11 0.11 -1.26 -1.74 120.40 114.56 2i3s s VAL 199 Ca 0.18 -0.55 -0.05 0.00 -2.93 0.00 0.00 61.98 58.63 2i3s s VAL 199 Cb 0.06 -0.25 0.06 0.00 -1.53 0.00 0.00 36.38 34.72 2i3s s VAL 199 CO -0.01 -0.30 0.28 0.00 -3.33 0.00 0.00 175.10 171.73 2i3s s ALA 200 N -0.94 -0.63 0.35 1.54 0.00 -0.35 -4.61 121.76 117.13 2i3s s ALA 200 Ca -0.10 1.03 -0.28 0.00 0.00 0.00 0.00 51.96 52.61 2i3s s ALA 200 Cb -0.06 -0.94 -0.10 0.00 0.00 0.00 0.00 23.12 22.03 2i3s s ALA 200 CO 0.00 -0.51 1.28 -0.51 0.00 0.00 0.00 175.76 176.02 2i3s s LEU 201 N 2.07 4.36 0.60 0.00 1.43 -1.26 -0.73 118.68 125.15 2i3s s LEU 201 Ca -0.02 2.63 -0.18 0.00 -1.03 0.00 0.00 54.13 55.53 2i3s s LEU 201 Cb -0.11 -3.74 -0.03 0.00 0.03 0.00 0.00 46.19 42.34 2i3s s LEU 201 CO -0.09 -0.60 1.15 -0.76 0.23 0.00 0.00 176.35 176.28 2i3s s LEU 202 N -1.99 3.61 -0.38 1.79 1.43 0.09 -4.84 118.68 118.39 2i3s s LEU 202 Ca 0.51 2.21 -0.40 0.00 -1.03 0.00 0.00 54.13 55.42 2i3s s LEU 202 Cb -0.38 -4.58 -0.15 0.00 0.03 0.00 0.00 46.19 41.11 2i3s s LEU 202 CO 0.50 -1.50 2.00 -2.65 0.23 0.00 0.00 176.35 174.93 2i3s n PRO 203 N -1.76 0.71 0.00 1.29 -0.02 -1.26 -4.68 135.00 129.28 2i3s n PRO 203 Ca 0.12 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 2i3s n PRO 203 Cb 0.51 -2.01 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 2i3s n PRO 203 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2i3s n LYS 204 N 6.86 0.00 -0.23 -0.52 4.76 -1.26 -1.78 118.16 125.99 2i3s n LYS 204 Ca 0.40 0.00 0.32 0.00 -2.87 0.00 0.00 58.31 56.16 2i3s n LYS 204 Cb 0.10 0.00 0.71 0.00 -1.84 0.00 0.00 35.03 34.01 2i3s n LYS 204 CO 0.00 0.00 0.00 1.05 -1.37 0.00 0.00 177.40 177.08 2i3s h GLU 205 N 0.00 0.00 0.00 1.97 9.09 -2.02 -2.79 114.58 120.82 2i3s h GLU 205 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2i3s h GLU 205 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 2i3s h GLU 205 CO 0.00 0.00 0.00 1.04 0.05 0.00 0.00 179.01 180.10 2i3s n GLN 206 N -3.96 0.14 -3.84 1.06 6.02 -0.73 -4.93 117.38 111.13 2i3s n GLN 206 Ca 0.22 0.40 -0.36 0.00 -0.01 0.00 0.00 57.00 57.25 2i3s n GLN 206 Cb 1.16 -1.78 0.03 0.00 1.02 0.00 0.00 30.24 30.67 2i3s n GLN 206 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 2i3s n GLU 207 N -2.05 -1.11 -0.78 -1.09 -0.58 -1.06 -4.90 120.64 109.07 2i3s n GLU 207 Ca 0.02 0.32 0.00 0.00 -0.42 0.00 0.00 57.16 57.09 2i3s n GLU 207 Cb 0.20 -3.66 0.00 0.00 -0.57 0.00 0.00 31.44 27.41 2i3s n GLU 207 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2i3s n GLY 208 N -1.86 2.26 3.41 0.62 0.00 -1.26 -2.16 105.19 106.21 2i3s n GLY 208 Ca -0.12 -0.96 -0.15 0.00 0.00 0.00 0.00 46.02 44.78 2i3s n GLY 208 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2i3s s TYR 209 N -7.50 -0.47 -0.06 1.61 -0.85 -0.54 -0.73 117.35 108.82 2i3s s TYR 209 Ca 0.00 0.66 0.04 0.00 -0.52 0.00 0.00 57.07 57.25 2i3s s TYR 209 Cb 0.00 0.33 -0.02 0.00 0.38 0.00 0.00 41.96 42.65 2i3s s TYR 209 CO 0.00 -0.60 -0.19 0.00 -1.52 0.00 0.00 175.55 173.25 2i3s s ALA 210 N -1.87 2.45 -0.06 9.51 0.00 0.10 -1.34 121.76 130.54 2i3s s ALA 210 Ca -0.08 -1.01 0.03 0.00 0.00 0.00 0.00 51.96 50.90 2i3s s ALA 210 Cb -0.01 -0.86 0.00 0.00 0.00 0.00 0.00 23.12 22.25 2i3s s ALA 210 CO 0.03 0.47 -0.16 0.00 0.00 0.00 0.00 175.76 176.10 2i3s s SER 212 N 0.37 5.67 0.51 0.00 1.04 -0.71 -0.13 113.70 120.44 2i3s s SER 212 Ca -0.11 0.03 0.04 0.00 0.48 0.00 0.00 55.95 56.39 2i3s s SER 212 Cb -0.15 -1.56 -0.00 0.00 0.10 0.00 0.00 66.02 64.41 2i3s s SER 212 CO 0.04 0.17 0.16 -0.94 0.98 0.00 0.00 173.24 173.65 2i3s s SER 213 N -2.42 4.33 0.08 7.02 1.04 -0.35 -0.68 113.70 122.71 2i3s s SER 213 Ca 0.30 -1.44 0.28 0.00 0.48 0.00 0.00 55.95 55.57 2i3s s SER 213 Cb -0.12 0.33 1.08 0.00 0.10 0.00 0.00 66.02 67.41 2i3s s SER 213 CO 0.23 -0.89 1.87 2.30 0.98 0.00 0.00 173.24 177.73 2i3s n ILE 214 N -1.42 0.22 -2.50 -1.02 -5.35 -0.77 -0.83 119.36 107.69 2i3s n ILE 214 Ca -0.11 -0.10 -0.31 0.00 -0.27 0.00 0.00 62.75 61.97 2i3s n ILE 214 Cb 0.66 -0.54 -0.00 0.00 -1.74 0.00 0.00 39.64 38.02 2i3s n ILE 214 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 2i3s n ASP 215 N -1.77 5.40 -3.82 7.28 5.75 -1.26 -2.22 116.55 125.91 2i3s n ASP 215 Ca 0.06 -3.73 -0.31 0.00 -0.01 0.00 0.00 54.79 50.80 2i3s n ASP 215 Cb 0.37 -0.65 0.02 0.00 -1.03 0.00 0.00 41.12 39.82 2i3s n ASP 215 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2i3s n GLY 216 N -0.40 -0.69 3.12 6.12 0.00 0.02 -4.76 105.19 108.59 2i3s n GLY 216 Ca 0.40 0.33 -0.10 0.00 0.00 0.00 0.00 46.02 46.65 2i3s n GLY 216 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2i3s s ARG 217 N -6.35 0.56 -0.03 1.61 0.52 -1.26 -1.14 118.95 112.87 2i3s s ARG 217 Ca 0.30 -0.63 0.01 0.00 -0.52 0.00 0.00 55.73 54.88 2i3s s ARG 217 Cb -0.12 0.23 0.03 0.00 0.52 0.00 0.00 34.95 35.60 2i3s s ARG 217 CO 0.88 -0.14 -0.01 0.08 0.02 0.00 0.00 175.30 176.13 2i3s s VAL 218 N -2.22 0.25 -0.04 3.52 1.01 -0.51 -1.21 120.40 121.20 2i3s s VAL 218 Ca -0.08 0.03 0.05 0.00 0.00 0.00 0.00 61.98 61.98 2i3s s VAL 218 Cb -0.03 -0.33 -0.02 0.00 0.00 0.00 0.00 36.38 36.00 2i3s s VAL 218 CO -0.03 0.16 -0.20 0.00 0.00 0.00 0.00 175.10 175.04 2i3s s ALA 219 N 0.95 2.42 -0.17 5.51 0.00 0.81 -0.95 121.76 130.33 2i3s s ALA 219 Ca -0.10 -1.03 0.01 0.00 0.00 0.00 0.00 51.96 50.83 2i3s s ALA 219 Cb -0.14 -0.80 0.01 0.00 0.00 0.00 0.00 23.12 22.20 2i3s s ALA 219 CO -0.01 0.51 -0.18 0.08 0.00 0.00 0.00 175.76 176.16 2i3s s VAL 220 N -0.56 2.25 0.26 0.00 1.01 0.91 -0.53 120.40 123.74 2i3s s VAL 220 Ca 0.08 -0.89 0.08 0.00 0.00 0.00 0.00 61.98 61.25 2i3s s VAL 220 Cb -0.11 -1.94 -0.05 0.00 0.00 0.00 0.00 36.38 34.27 2i3s s VAL 220 CO 0.01 0.53 -0.11 -1.61 0.00 0.00 0.00 175.10 173.91 2i3s s GLU 221 N 1.17 1.51 -0.03 2.72 0.41 -0.45 -2.17 118.70 121.87 2i3s s GLU 221 Ca 0.02 -1.73 0.04 0.00 -0.41 0.00 0.00 54.97 52.89 2i3s s GLU 221 Cb -0.14 -1.28 -0.00 0.00 -1.78 0.00 0.00 34.13 30.93 2i3s s GLU 221 CO -0.09 0.14 -0.14 -0.06 -0.49 0.00 0.00 175.26 174.62 2i3s s PHE 222 N -2.89 1.34 0.28 1.61 0.08 -1.26 -1.46 117.98 115.68 2i3s s PHE 222 Ca 0.27 -0.33 -0.03 0.00 0.12 0.00 0.00 56.93 56.97 2i3s s PHE 222 Cb 0.01 -0.90 0.40 0.00 -0.57 0.00 0.00 43.02 41.95 2i3s s PHE 222 CO 0.11 -0.09 1.95 0.74 -0.10 0.00 0.00 175.22 177.83 2i3s h PHE 223 N 6.11 1.11 -0.73 0.36 -1.00 -1.78 -2.87 116.94 118.15 2i3s h PHE 223 Ca -0.34 0.03 -0.51 0.00 2.81 0.00 0.00 57.97 59.96 2i3s h PHE 223 Cb 1.17 -0.38 -0.35 0.00 3.61 0.00 0.00 35.95 40.00 2i3s h PHE 223 CO 0.42 0.69 -0.40 -0.25 -1.61 0.00 0.00 178.31 177.16 2i3s n ASP 224 N -4.41 5.09 -4.69 2.17 8.00 -1.26 -5.04 116.55 116.41 2i3s n ASP 224 Ca 0.11 -3.77 -0.43 0.00 0.71 0.00 0.00 54.79 51.41 2i3s n ASP 224 Cb 0.04 -0.50 -0.01 0.00 -0.02 0.00 0.00 41.12 40.63 2i3s n ASP 224 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2i3s n ASP 225 N -0.81 2.65 0.00 -2.24 4.64 -1.09 -4.96 116.55 114.75 2i3s n ASP 225 Ca 0.46 1.20 0.00 0.00 -1.38 0.00 0.00 54.79 55.06 2i3s n ASP 225 Cb 0.90 -1.46 0.00 0.00 -1.04 0.00 0.00 41.12 39.52 2i3s n ASP 225 CO 0.00 0.00 0.00 1.67 -0.82 0.00 0.00 177.20 178.05 2i3s n GLN 226 N 0.76 0.00 -3.29 -0.67 -0.06 -1.26 -5.06 117.38 107.79 2i3s n GLN 226 Ca 0.06 0.12 0.00 0.00 -2.00 0.00 0.00 57.00 55.18 2i3s n GLN 226 Cb 0.35 -0.58 0.00 0.00 -4.06 0.00 0.00 30.24 25.95 2i3s n GLN 226 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2i3s n GLY 227 N 2.34 -1.37 1.05 1.69 0.00 -1.26 -4.97 105.19 102.67 2i3s n GLY 227 Ca 0.00 -0.97 0.09 0.00 0.00 0.00 0.00 46.02 45.14 2i3s n GLY 227 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2i3s n ASP 228 N 0.88 3.60 0.00 1.61 9.92 -1.26 0.80 116.55 132.09 2i3s n ASP 228 Ca 0.00 -2.09 0.00 0.00 -0.53 0.00 0.00 54.79 52.17 2i3s n ASP 228 Cb 0.00 -0.39 0.00 0.00 -0.64 0.00 0.00 41.12 40.09 2i3s n ASP 228 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 2i3s n ASP 229 N 1.02 0.00 -2.37 -2.24 5.68 -1.26 -2.01 116.55 115.36 2i3s n ASP 229 Ca 0.19 0.86 -0.30 0.00 -0.50 0.00 0.00 54.79 55.04 2i3s n ASP 229 Cb 0.58 -0.42 0.03 0.00 -1.14 0.00 0.00 41.12 40.17 2i3s n ASP 229 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 2i3s n TYR 230 N -2.77 3.08 -2.81 2.11 4.02 -1.26 -4.85 117.16 114.69 2i3s n TYR 230 Ca 0.00 -2.66 -0.21 0.00 -0.01 0.00 0.00 57.90 55.02 2i3s n TYR 230 Cb 0.00 -0.66 0.01 0.00 -0.02 0.00 0.00 39.34 38.68 2i3s n TYR 230 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2i3s n ASN 231 N -0.66 -5.70 0.10 7.72 5.15 -0.85 -4.88 115.26 116.14 2i3s n ASN 231 Ca 0.48 -0.17 -0.04 0.00 -0.60 0.00 0.00 54.58 54.25 2i3s n ASN 231 Cb 0.69 -4.67 0.07 0.00 -0.53 0.00 0.00 39.78 35.34 2i3s n ASN 231 CO 0.00 0.00 0.00 -1.28 1.40 0.00 0.00 177.26 177.38 2i3s h SER 232 N -0.81 0.09 -3.12 1.20 0.87 -1.76 -3.45 113.55 106.57 2i3s h SER 232 Ca -0.49 -0.07 -0.54 0.00 -1.23 0.00 0.00 61.79 59.46 2i3s h SER 232 Cb 1.35 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.29 2i3s h SER 232 CO 0.56 0.80 0.63 -0.55 -0.53 0.00 0.00 176.83 177.73 2i3s s SER 233 N -6.85 7.01 0.00 6.23 0.15 0.24 -4.67 113.70 115.81 2i3s s SER 233 Ca -0.02 2.05 0.25 0.00 0.70 0.00 0.00 55.95 58.93 2i3s s SER 233 Cb 0.12 -2.58 0.58 0.00 -1.71 0.00 0.00 66.02 62.43 2i3s s SER 233 CO 0.79 -0.53 1.48 0.29 1.20 0.00 0.00 173.24 176.46 2i3s n LYS 234 N 4.19 2.07 -2.04 5.44 5.02 -1.26 -4.97 118.16 126.61 2i3s n LYS 234 Ca 0.10 -1.57 -0.36 0.00 -2.02 0.00 0.00 58.31 54.45 2i3s n LYS 234 Cb 0.45 -1.47 0.02 0.00 -0.02 0.00 0.00 35.03 34.02 2i3s n LYS 234 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 2i3s s ARG 235 N -1.87 3.18 0.11 1.97 1.70 -1.26 -4.97 118.95 117.81 2i3s s ARG 235 Ca 0.34 1.87 -0.26 0.00 -0.47 0.00 0.00 55.73 57.20 2i3s s ARG 235 Cb 0.20 -2.08 0.08 0.00 -0.57 0.00 0.00 34.95 32.58 2i3s s ARG 235 CO 0.31 -1.05 1.06 -0.59 -1.08 0.00 0.00 175.30 173.95 2i3s s PHE 236 N -1.55 -0.08 0.07 5.89 -0.12 -0.92 -5.03 117.98 116.25 2i3s s PHE 236 Ca 0.73 -0.19 -0.07 0.00 -0.05 0.00 0.00 56.93 57.36 2i3s s PHE 236 Cb -0.31 0.62 -0.01 0.00 -0.63 0.00 0.00 43.02 42.69 2i3s s PHE 236 CO 0.35 -0.70 0.14 0.00 -0.05 0.00 0.00 175.22 174.96 2i3s s ALA 237 N -2.89 -0.07 -0.02 1.99 0.00 -1.26 -0.06 121.76 119.44 2i3s s ALA 237 Ca 0.14 -0.71 -0.15 0.00 0.00 0.00 0.00 51.96 51.25 2i3s s ALA 237 Cb 0.00 0.41 0.02 0.00 0.00 0.00 0.00 23.12 23.55 2i3s s ALA 237 CO 0.01 -0.45 0.31 -0.59 0.00 0.00 0.00 175.76 175.04 2i3s s PHE 238 N -3.67 -0.20 0.39 0.00 -0.71 -0.13 -4.99 117.98 108.67 2i3s s PHE 238 Ca 0.04 0.31 -0.14 0.00 -1.04 0.00 0.00 56.93 56.10 2i3s s PHE 238 Cb 0.05 0.10 -0.08 0.00 -1.21 0.00 0.00 43.02 41.88 2i3s s PHE 238 CO -0.10 -0.38 0.81 1.03 -1.34 0.00 0.00 175.22 175.24 2i3s s ARG 239 N -1.23 3.93 0.15 1.99 0.52 -1.26 -1.42 118.95 121.62 2i3s s ARG 239 Ca -0.13 0.68 -0.25 0.00 -0.52 0.00 0.00 55.73 55.51 2i3s s ARG 239 Cb -0.05 -2.35 0.06 0.00 0.52 0.00 0.00 34.95 33.14 2i3s s ARG 239 CO 0.04 -0.00 0.91 0.00 0.02 0.00 0.00 175.30 176.26 2i3s n HIS 241 N -0.43 -1.61 -4.24 0.00 8.25 -1.26 -4.24 115.22 111.68 2i3s n HIS 241 Ca -0.07 0.46 -0.16 0.00 -0.26 0.00 0.00 57.72 57.69 2i3s n HIS 241 Cb 0.61 -3.28 -0.11 0.00 1.12 0.00 0.00 29.99 28.33 2i3s n HIS 241 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2i3s s ARG 242 N -6.70 1.03 -0.26 -0.41 0.52 -1.26 -1.64 118.95 110.24 2i3s s ARG 242 Ca 0.28 -1.32 0.01 0.00 -0.52 0.00 0.00 55.73 54.18 2i3s s ARG 242 Cb -0.12 -0.78 0.07 0.00 0.52 0.00 0.00 34.95 34.64 2i3s s ARG 242 CO 0.92 0.13 -0.02 -1.17 0.02 0.00 0.00 175.30 175.18 2i3s s LEU 243 N -2.74 2.82 -0.46 2.53 2.96 0.59 -4.97 118.68 119.41 2i3s s LEU 243 Ca 0.12 -1.37 -0.29 0.00 -0.22 0.00 0.00 54.13 52.37 2i3s s LEU 243 Cb -0.02 -1.20 0.03 0.00 0.50 0.00 0.00 46.19 45.50 2i3s s LEU 243 CO 0.02 -0.28 1.13 0.20 -1.32 0.00 0.00 176.35 176.10 2i3s s ASN 244 N 1.36 6.66 0.42 3.68 -0.87 -1.26 -1.49 114.94 123.43 2i3s s ASN 244 Ca -0.02 0.51 0.07 0.00 -1.57 0.00 0.00 52.86 51.86 2i3s s ASN 244 Cb -0.19 -2.55 -0.03 0.00 -0.02 0.00 0.00 41.25 38.47 2i3s s ASN 244 CO -0.09 -1.21 0.32 -0.76 -2.57 0.00 0.00 177.10 172.79 2i3s s LEU 245 N 4.36 3.26 0.23 0.60 1.43 -1.26 -5.03 118.68 122.28 2i3s s LEU 245 Ca 0.47 -0.88 -0.07 0.00 -1.03 0.00 0.00 54.13 52.63 2i3s s LEU 245 Cb -0.08 -1.81 0.33 0.00 0.03 0.00 0.00 46.19 44.66 2i3s s LEU 245 CO 0.30 -0.65 1.80 0.07 0.23 0.00 0.00 176.35 178.10 2i3s h LYS 246 N 1.13 0.68 0.00 1.70 2.10 -2.03 -3.37 116.57 116.78 2i3s h LYS 246 Ca -0.41 -0.04 -0.23 0.00 -2.00 0.00 0.00 60.65 57.97 2i3s h LYS 246 Cb 1.26 -0.15 -0.04 0.00 -0.90 0.00 0.00 32.23 32.40 2i3s h LYS 246 CO 0.61 0.45 -1.83 -0.25 -2.00 0.00 0.00 179.45 176.44 2i3s n ASP 247 N -4.79 2.47 -3.92 7.07 8.00 -1.26 -5.01 116.55 119.10 2i3s n ASP 247 Ca 0.11 -0.02 -0.23 0.00 0.71 0.00 0.00 54.79 55.37 2i3s n ASP 247 Cb 0.24 -0.28 -0.17 0.00 -0.02 0.00 0.00 41.12 40.89 2i3s n ASP 247 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2i3s s THR 248 N -2.29 0.79 0.51 -3.53 2.01 -1.26 -5.14 115.64 106.75 2i3s s THR 248 Ca -0.20 -0.24 -0.17 0.00 0.31 0.00 0.00 61.69 61.40 2i3s s THR 248 Cb 0.06 -0.80 -0.08 0.00 0.01 0.00 0.00 72.50 71.69 2i3s s THR 248 CO 0.32 0.30 0.99 0.20 -0.69 0.00 0.00 174.62 175.73 2i3s s ASN 249 N 1.11 6.57 -0.15 3.53 0.02 -1.26 -4.04 114.94 120.72 2i3s s ASN 249 Ca -0.07 1.61 -0.00 0.00 -1.02 0.00 0.00 52.86 53.37 2i3s s ASN 249 Cb -0.14 -2.51 -0.01 0.00 0.02 0.00 0.00 41.25 38.61 2i3s s ASN 249 CO -0.01 -0.62 -0.14 -0.22 0.02 0.00 0.00 177.10 176.13 2i3s s LEU 250 N -4.03 2.57 -0.19 0.60 2.96 -0.56 -4.97 118.68 115.07 2i3s s LEU 250 Ca 0.60 -0.42 -0.02 0.00 -0.22 0.00 0.00 54.13 54.07 2i3s s LEU 250 Cb -0.10 -1.59 -0.00 0.00 0.50 0.00 0.00 46.19 45.00 2i3s s LEU 250 CO 0.30 0.10 -0.11 0.00 -1.32 0.00 0.00 176.35 175.33 2i3s s ALA 251 N 0.70 2.62 0.14 5.97 0.00 -1.26 -0.30 121.76 129.63 2i3s s ALA 251 Ca -0.07 -1.12 0.03 0.00 0.00 0.00 0.00 51.96 50.80 2i3s s ALA 251 Cb -0.15 -1.44 -0.04 0.00 0.00 0.00 0.00 23.12 21.49 2i3s s ALA 251 CO 0.02 -0.26 0.20 0.71 0.00 0.00 0.00 175.76 176.43 2i3s s TYR 252 N 1.18 3.33 0.43 0.00 1.51 -0.65 -4.59 117.35 118.56 2i3s s TYR 252 Ca 0.02 0.07 -0.26 0.00 -1.01 0.00 0.00 57.07 55.89 2i3s s TYR 252 Cb -0.14 -1.61 -0.09 0.00 -0.11 0.00 0.00 41.96 40.01 2i3s s TYR 252 CO -0.04 0.52 1.42 -2.14 -1.11 0.00 0.00 175.55 174.21 2i3s s PRO 253 N -3.04 3.78 -0.73 -1.71 0.02 -0.94 -0.80 135.00 131.58 2i3s s PRO 253 Ca 0.33 2.41 -0.10 0.00 0.02 0.00 0.00 61.00 63.65 2i3s s PRO 253 Cb -0.11 -2.71 0.19 0.00 0.02 0.00 0.00 34.50 31.89 2i3s s PRO 253 CO 0.26 -0.74 0.63 0.08 -0.33 0.00 0.00 177.00 176.90 2i3s s VAL 254 N -1.20 4.89 0.14 3.83 1.01 -0.01 -1.00 120.40 128.07 2i3s s VAL 254 Ca 0.59 -2.57 -0.09 0.00 0.00 0.00 0.00 61.98 59.90 2i3s s VAL 254 Cb -0.43 -4.08 -0.09 0.00 0.00 0.00 0.00 36.38 31.78 2i3s s VAL 254 CO 0.56 -0.96 1.42 0.78 0.00 0.00 0.00 175.10 176.91 2i3s h ASN 255 N 7.59 0.89 -3.44 3.32 2.35 -1.35 -3.40 115.58 121.54 2i3s h ASN 255 Ca 0.04 -0.48 -0.25 0.00 -0.55 0.00 0.00 56.30 55.05 2i3s h ASN 255 Cb 1.01 -0.26 -0.32 0.00 0.05 0.00 0.00 38.32 38.81 2i3s h ASN 255 CO 0.75 1.26 -0.62 -0.55 -1.65 0.00 0.00 177.43 176.63 2i3s s SER 256 N -6.96 -0.08 0.05 5.81 0.15 -1.15 -4.36 113.70 107.16 2i3s s SER 256 Ca -0.10 0.26 0.05 0.00 0.70 0.00 0.00 55.95 56.85 2i3s s SER 256 Cb 0.10 0.14 -0.02 0.00 -1.71 0.00 0.00 66.02 64.53 2i3s s SER 256 CO 0.88 -0.15 -0.13 0.27 1.20 0.00 0.00 173.24 175.31 2i3s s ILE 257 N 1.17 1.01 -0.08 6.45 -4.36 -1.26 -0.93 121.20 123.20 2i3s s ILE 257 Ca -0.09 -1.10 -0.31 0.00 -0.26 0.00 0.00 60.65 58.89 2i3s s ILE 257 Cb -0.12 -0.96 0.08 0.00 1.25 0.00 0.00 42.46 42.72 2i3s s ILE 257 CO -0.05 -0.13 0.76 -0.70 0.24 0.00 0.00 174.94 175.06 2i3s s GLU 258 N -1.39 0.94 0.05 0.37 2.12 -0.60 -4.82 118.70 115.38 2i3s s GLU 258 Ca -0.01 0.25 -0.11 0.00 0.36 0.00 0.00 54.97 55.45 2i3s s GLU 258 Cb -0.09 0.44 -0.06 0.00 0.26 0.00 0.00 34.13 34.69 2i3s s GLU 258 CO 0.01 -0.29 0.40 -0.06 -0.54 0.00 0.00 175.26 174.79 2i3s s PHE 259 N -1.13 3.63 0.33 5.30 0.40 -1.26 -0.21 117.98 125.04 2i3s s PHE 259 Ca -0.08 0.85 -0.24 0.00 -0.60 0.00 0.00 56.93 56.85 2i3s s PHE 259 Cb -0.00 -2.20 -0.10 0.00 0.51 0.00 0.00 43.02 41.23 2i3s s PHE 259 CO 0.08 0.56 0.92 -1.54 0.70 0.00 0.00 175.22 175.94 2i3s s SER 260 N -1.53 7.24 0.46 1.36 1.04 -0.81 -4.81 113.70 116.64 2i3s s SER 260 Ca 0.30 1.77 0.28 0.00 0.48 0.00 0.00 55.95 58.78 2i3s s SER 260 Cb -0.15 -2.56 0.92 0.00 0.10 0.00 0.00 66.02 64.34 2i3s s SER 260 CO 0.16 -0.11 1.81 1.55 0.98 0.00 0.00 173.24 177.63 2i3s h PRO 261 N 2.95 0.00 0.00 4.02 0.13 -1.85 -2.26 132.00 134.98 2i3s h PRO 261 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2i3s h PRO 261 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2i3s h PRO 261 CO 0.64 0.00 0.00 -2.13 -0.23 0.00 0.00 178.00 176.28 2i3s n ARG 262 N -2.94 0.00 0.00 0.86 3.00 -1.26 -4.57 116.66 111.75 2i3s n ARG 262 Ca 0.02 0.29 0.13 0.00 -0.00 0.00 0.00 57.85 58.29 2i3s n ARG 262 Cb 0.39 -0.76 0.40 0.00 0.00 0.00 0.00 32.46 32.49 2i3s n ARG 262 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 2i3s n HIS 263 N -1.78 0.00 -3.21 -0.14 8.25 -1.26 -4.94 115.22 112.13 2i3s n HIS 263 Ca 0.00 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.23 2i3s n HIS 263 Cb 0.00 -0.35 0.03 0.00 1.12 0.00 0.00 29.99 30.80 2i3s n HIS 263 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2i3s n LYS 264 N -1.49 -4.91 -2.77 -0.41 5.02 -0.85 -4.98 118.16 107.77 2i3s n LYS 264 Ca 0.06 0.78 -0.30 0.00 -2.02 0.00 0.00 58.31 56.84 2i3s n LYS 264 Cb 0.34 -5.63 -0.02 0.00 -0.02 0.00 0.00 35.03 29.69 2i3s n LYS 264 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2i3s s PHE 265 N -3.14 3.49 -0.24 2.13 2.99 -1.26 -4.74 117.98 117.20 2i3s s PHE 265 Ca 0.38 1.01 -0.15 0.00 0.00 0.00 0.00 56.93 58.18 2i3s s PHE 265 Cb -0.18 -2.43 -0.04 0.00 0.00 0.00 0.00 43.02 40.37 2i3s s PHE 265 CO 0.47 -0.16 0.35 -1.17 -0.00 0.00 0.00 175.22 174.70 2i3s s LEU 266 N -4.07 4.09 -0.14 -0.37 2.96 0.61 -1.92 118.68 119.84 2i3s s LEU 266 Ca 0.51 0.33 -0.09 0.00 -0.22 0.00 0.00 54.13 54.66 2i3s s LEU 266 Cb -0.10 -2.40 -0.04 0.00 0.50 0.00 0.00 46.19 44.14 2i3s s LEU 266 CO 0.35 -0.11 0.16 -0.31 -1.32 0.00 0.00 176.35 175.12 2i3s s TYR 267 N 1.66 3.54 -0.04 5.38 1.51 0.71 -0.11 117.35 129.99 2i3s s TYR 267 Ca 0.15 0.49 0.04 0.00 -1.01 0.00 0.00 57.07 56.75 2i3s s TYR 267 Cb -0.15 -2.05 -0.00 0.00 -0.11 0.00 0.00 41.96 39.64 2i3s s TYR 267 CO 0.09 0.56 -0.17 0.95 -1.11 0.00 0.00 175.55 175.86 2i3s s THR 268 N -0.49 1.44 -0.13 -0.71 -4.23 -0.01 -1.55 115.64 109.95 2i3s s THR 268 Ca 0.13 -0.73 0.01 0.00 -1.18 0.00 0.00 61.69 59.93 2i3s s THR 268 Cb -0.12 -1.24 -0.00 0.00 1.34 0.00 0.00 72.50 72.48 2i3s s THR 268 CO 0.03 0.42 -0.18 0.00 -0.54 0.00 0.00 174.62 174.35 2i3s s ALA 269 N 0.03 2.42 0.34 3.99 0.00 -0.11 -0.08 121.76 128.35 2i3s s ALA 269 Ca -0.04 -0.98 0.07 0.00 0.00 0.00 0.00 51.96 51.01 2i3s s ALA 269 Cb -0.11 -1.09 -0.07 0.00 0.00 0.00 0.00 23.12 21.85 2i3s s ALA 269 CO 0.02 0.14 -0.02 0.20 0.00 0.00 0.00 175.76 176.10 2i3s s GLY 270 N 0.55 2.15 0.00 0.00 0.00 -0.52 -1.02 107.32 108.48 2i3s s GLY 270 Ca -0.11 -2.09 0.07 0.00 0.00 0.00 0.00 44.72 42.59 2i3s s GLY 270 CO 0.04 -1.95 1.02 1.44 0.00 0.00 0.00 173.10 173.65 2i3s n SER 271 N -0.76 0.00 -0.55 1.64 7.64 -0.17 -1.66 113.62 119.76 2i3s n SER 271 Ca -0.05 -1.16 0.14 0.00 1.01 0.00 0.00 58.87 58.81 2i3s n SER 271 Cb 0.65 0.00 0.46 0.00 -1.01 0.00 0.00 64.21 64.31 2i3s n SER 271 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2i3s n ASP 272 N -0.66 1.72 0.00 6.43 5.75 -1.26 -4.58 116.55 123.95 2i3s n ASP 272 Ca 0.05 -1.58 0.00 0.00 -0.01 0.00 0.00 54.79 53.25 2i3s n ASP 272 Cb 0.03 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.11 2i3s n ASP 272 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2i3s n GLY 273 N 1.20 0.44 3.43 6.12 0.00 -0.66 -4.98 105.19 110.73 2i3s n GLY 273 Ca 0.18 -0.63 -0.29 0.00 0.00 0.00 0.00 46.02 45.28 2i3s n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2i3s s ILE 274 N -2.00 2.48 -0.16 -0.61 1.01 -1.25 -3.44 121.20 117.24 2i3s s ILE 274 Ca 0.00 -1.66 -0.01 0.00 0.00 0.00 0.00 60.65 58.98 2i3s s ILE 274 Cb 0.00 -2.12 -0.01 0.00 0.01 0.00 0.00 42.46 40.34 2i3s s ILE 274 CO 0.00 0.09 -0.12 -0.63 0.00 0.00 0.00 174.94 174.28 2i3s s ILE 275 N -1.10 2.96 0.24 2.92 1.01 -1.26 -1.44 121.20 124.53 2i3s s ILE 275 Ca 0.16 -0.67 0.09 0.00 0.00 0.00 0.00 60.65 60.22 2i3s s ILE 275 Cb -0.10 -2.27 -0.04 0.00 0.01 0.00 0.00 42.46 40.06 2i3s s ILE 275 CO 0.08 0.50 0.03 -0.44 0.00 0.00 0.00 174.94 175.10 2i3s s SER 276 N 0.73 4.74 -0.09 3.58 0.01 0.88 -0.91 113.70 122.64 2i3s s SER 276 Ca -0.06 -0.52 0.04 0.00 1.31 0.00 0.00 55.95 56.72 2i3s s SER 276 Cb -0.15 -0.97 0.00 0.00 0.21 0.00 0.00 66.02 65.11 2i3s s SER 276 CO 0.02 0.02 -0.21 0.00 0.41 0.00 0.00 173.24 173.47 2i3s s TRP 278 N 0.44 1.51 -0.41 0.00 0.52 0.85 -1.14 118.94 120.71 2i3s s TRP 278 Ca -0.17 -0.36 -0.11 0.00 0.02 0.00 0.00 56.10 55.48 2i3s s TRP 278 Cb -0.17 -0.89 0.06 0.00 -1.15 0.00 0.00 33.47 31.31 2i3s s TRP 278 CO 0.07 0.07 0.25 1.21 0.02 0.00 0.00 176.95 178.57 2i3s s ASN 279 N -1.17 5.74 0.11 2.95 3.84 -0.84 -0.29 114.94 125.28 2i3s s ASN 279 Ca 0.04 -1.26 0.25 0.00 0.21 0.00 0.00 52.86 52.11 2i3s s ASN 279 Cb -0.08 -2.02 0.97 0.00 -0.55 0.00 0.00 41.25 39.56 2i3s s ASN 279 CO 0.02 -0.48 1.78 0.18 -2.79 0.00 0.00 177.10 175.80 2i3s n LEU 280 N 4.98 0.37 0.11 3.21 4.77 -1.26 0.25 117.00 129.44 2i3s n LEU 280 Ca -0.11 0.55 -0.22 0.00 -0.03 0.00 0.00 56.01 56.19 2i3s n LEU 280 Cb 0.44 -0.45 -0.14 0.00 -2.33 0.00 0.00 43.42 40.95 2i3s n LEU 280 CO 0.39 -0.17 -0.12 1.56 -1.33 0.00 0.00 177.39 177.72 2i3s h GLN 281 N 0.00 0.55 -0.02 3.23 7.50 -1.94 -3.29 115.11 121.14 2i3s h GLN 281 Ca 0.00 -0.82 0.00 0.00 0.50 0.00 0.00 58.65 58.33 2i3s h GLN 281 Cb 0.53 0.29 0.00 0.00 0.05 0.00 0.00 27.48 28.34 2i3s h GLN 281 CO 0.00 1.38 -0.39 0.25 -1.50 0.00 0.00 178.83 178.57 2i3s n THR 282 N -3.74 0.00 -3.88 -0.54 -2.24 -1.18 -4.98 114.28 97.72 2i3s n THR 282 Ca -0.14 -0.31 -0.31 0.00 -2.27 0.00 0.00 64.05 61.03 2i3s n THR 282 Cb 1.03 1.26 0.01 0.00 -2.10 0.00 0.00 70.33 70.53 2i3s n THR 282 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2i3s n ARG 283 N 0.10 -4.57 -4.26 -0.78 1.74 0.14 -4.98 116.66 104.05 2i3s n ARG 283 Ca 0.09 0.53 -0.22 0.00 -0.77 0.00 0.00 57.85 57.48 2i3s n ARG 283 Cb 0.44 -5.36 -0.12 0.00 -1.02 0.00 0.00 32.46 26.41 2i3s n ARG 283 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2i3s s LYS 284 N -6.58 1.03 -0.08 5.56 1.02 -1.02 -4.99 119.74 114.68 2i3s s LYS 284 Ca 0.64 -1.08 -0.30 0.00 0.02 0.00 0.00 55.97 55.25 2i3s s LYS 284 Cb -0.33 -1.21 -0.02 0.00 -0.52 0.00 0.00 37.83 35.75 2i3s s LYS 284 CO 0.79 0.28 1.07 0.21 -0.92 0.00 0.00 175.35 176.77 2i3s s LYS 285 N -1.82 4.41 -0.01 1.68 2.20 -1.26 -1.99 119.74 122.94 2i3s s LYS 285 Ca 0.04 1.49 -0.21 0.00 -0.36 0.00 0.00 55.97 56.92 2i3s s LYS 285 Cb -0.10 -3.54 -0.24 0.00 -1.51 0.00 0.00 37.83 32.44 2i3s s LYS 285 CO 0.03 -0.35 1.07 0.82 -0.36 0.00 0.00 175.35 176.56 2i3s h ILE 286 N 5.05 1.46 -1.31 5.43 1.08 -1.48 -3.48 117.51 124.26 2i3s h ILE 286 Ca -0.32 -2.09 0.41 0.00 -0.39 0.00 0.00 64.86 62.46 2i3s h ILE 286 Cb 1.15 2.68 -0.12 0.00 -3.07 0.00 0.00 36.82 37.46 2i3s h ILE 286 CO 0.86 0.60 1.01 -1.59 -0.69 0.00 0.00 178.15 178.34 2i3s s LYS 287 N -3.13 0.00 -0.03 2.37 -2.85 -1.15 -5.01 119.74 109.95 2i3s s LYS 287 Ca -0.14 -0.00 0.06 0.00 -1.00 0.00 0.00 55.97 54.89 2i3s s LYS 287 Cb 0.03 0.00 -0.01 0.00 -2.06 0.00 0.00 37.83 35.78 2i3s s LYS 287 CO 0.81 -0.00 -0.22 -0.80 0.10 0.00 0.00 175.35 175.23 2i3s s ASN 288 N -3.31 2.62 0.58 0.03 -0.87 -1.26 -0.15 114.94 112.58 2i3s s ASN 288 Ca 0.20 -0.41 -0.08 0.00 -1.57 0.00 0.00 52.86 51.00 2i3s s ASN 288 Cb 0.06 -0.45 -0.03 0.00 -0.02 0.00 0.00 41.25 40.81 2i3s s ASN 288 CO -0.06 0.25 0.94 -0.36 -2.57 0.00 0.00 177.10 175.30 2i3s s PHE 289 N -0.36 3.52 0.42 2.20 0.40 -0.09 -4.99 117.98 119.09 2i3s s PHE 289 Ca 0.04 1.02 -0.26 0.00 -0.60 0.00 0.00 56.93 57.13 2i3s s PHE 289 Cb -0.10 -2.62 -0.09 0.00 0.51 0.00 0.00 43.02 40.72 2i3s s PHE 289 CO 0.01 -0.63 1.38 0.00 0.70 0.00 0.00 175.22 176.68 2i3s s ALA 290 N -3.03 3.29 0.11 5.36 0.00 -1.26 -4.55 121.76 121.68 2i3s s ALA 290 Ca 0.53 1.38 -0.33 0.00 0.00 0.00 0.00 51.96 53.54 2i3s s ALA 290 Cb -0.11 -3.55 -0.12 0.00 0.00 0.00 0.00 23.12 19.34 2i3s s ALA 290 CO 0.49 -1.02 1.72 1.17 0.00 0.00 0.00 175.76 178.13 2i3s n LYS 291 N 0.03 2.42 0.03 0.00 4.81 -1.26 -4.85 118.16 119.33 2i3s n LYS 291 Ca 0.04 0.88 -0.12 0.00 -0.87 0.00 0.00 58.31 58.23 2i3s n LYS 291 Cb 0.42 -2.70 -0.09 0.00 0.02 0.00 0.00 35.03 32.68 2i3s n LYS 291 CO 0.00 0.00 0.00 0.74 1.17 0.00 0.00 177.40 179.31 2i3s h PHE 292 N 7.34 -0.13 -0.62 5.64 -1.00 -1.89 -3.50 116.94 122.78 2i3s h PHE 292 Ca -0.46 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.32 2i3s h PHE 292 Cb 1.24 0.04 0.00 0.00 3.61 0.00 0.00 35.95 40.84 2i3s h PHE 292 CO 0.72 0.35 0.00 0.27 -1.61 0.00 0.00 178.31 178.04 2i3s n ASN 293 N -4.90 0.00 -0.10 2.17 2.04 -1.26 -5.03 115.26 108.18 2i3s n ASN 293 Ca -0.08 0.00 0.14 0.00 -0.44 0.00 0.00 54.58 54.20 2i3s n ASN 293 Cb 0.27 0.00 0.65 0.00 -2.53 0.00 0.00 39.78 38.18 2i3s n ASN 293 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 2i3s n GLU 294 N 0.00 0.70 -3.59 -3.83 1.02 -1.26 -4.92 120.64 108.77 2i3s n GLU 294 Ca 0.00 -0.21 -0.21 0.00 -0.02 0.00 0.00 57.16 56.73 2i3s n GLU 294 Cb 0.00 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 29.89 2i3s n GLU 294 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2i3s s ASP 295 N -2.44 5.06 0.43 1.62 1.11 -1.26 -5.00 116.67 116.19 2i3s s ASP 295 Ca 0.30 -0.73 -0.22 0.00 0.18 0.00 0.00 52.55 52.08 2i3s s ASP 295 Cb 0.20 -0.60 -0.09 0.00 1.07 0.00 0.00 42.92 43.50 2i3s s ASP 295 CO 0.46 -0.63 1.01 -0.44 1.18 0.00 0.00 175.17 176.75 2i3s s SER 296 N -4.12 6.72 -0.33 0.27 0.01 -0.98 -4.11 113.70 111.16 2i3s s SER 296 Ca 0.48 1.88 -0.23 0.00 1.31 0.00 0.00 55.95 59.38 2i3s s SER 296 Cb -0.03 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.64 2i3s s SER 296 CO 0.28 -0.51 0.76 -0.69 0.41 0.00 0.00 173.24 173.48 2i3s s VAL 297 N -1.92 4.80 -1.40 3.43 1.01 -0.97 -0.70 120.40 124.65 2i3s s VAL 297 Ca 0.62 1.00 0.17 0.00 0.00 0.00 0.00 61.98 63.77 2i3s s VAL 297 Cb -0.16 -4.14 -0.05 0.00 0.00 0.00 0.00 36.38 32.03 2i3s s VAL 297 CO 0.20 -0.30 0.85 1.33 0.00 0.00 0.00 175.10 177.18 2i3s n VAL 298 N 5.61 0.00 -3.62 2.92 0.24 -0.38 -4.07 118.33 119.03 2i3s n VAL 298 Ca 0.03 -0.27 -0.11 0.00 -2.04 0.00 0.00 64.34 61.95 2i3s n VAL 298 Cb 0.48 1.16 -0.07 0.00 -1.47 0.00 0.00 33.84 33.94 2i3s n VAL 298 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2i3s s LYS 299 N -2.14 0.60 0.06 7.34 2.47 -1.20 -4.56 119.74 122.30 2i3s s LYS 299 Ca 0.12 0.59 0.00 0.00 -1.56 0.00 0.00 55.97 55.13 2i3s s LYS 299 Cb 0.14 0.29 -0.04 0.00 -1.46 0.00 0.00 37.83 36.76 2i3s s LYS 299 CO 0.49 -0.09 -0.05 0.96 0.16 0.00 0.00 175.35 176.82 2i3s s ILE 300 N 0.02 0.38 -0.07 5.43 -4.36 -1.26 -1.10 121.20 120.23 2i3s s ILE 300 Ca 0.01 -1.66 -0.05 0.00 -0.26 0.00 0.00 60.65 58.69 2i3s s ILE 300 Cb -0.04 -1.32 0.03 0.00 1.25 0.00 0.00 42.46 42.37 2i3s s ILE 300 CO -0.03 -0.84 0.18 0.00 0.24 0.00 0.00 174.94 174.49 2i3s s ALA 301 N -3.27 -0.43 -0.04 2.27 0.00 -0.11 -4.85 121.76 115.33 2i3s s ALA 301 Ca 0.04 0.64 0.06 0.00 0.00 0.00 0.00 51.96 52.71 2i3s s ALA 301 Cb 0.03 -0.40 -0.01 0.00 0.00 0.00 0.00 23.12 22.74 2i3s s ALA 301 CO -0.06 -0.12 -0.23 0.00 0.00 0.00 0.00 175.76 175.34 2i3s n SER 303 N 2.82 1.08 -0.17 0.00 3.41 0.21 -4.75 113.62 116.22 2i3s n SER 303 Ca -0.17 -1.71 -0.02 0.00 -0.26 0.00 0.00 58.87 56.71 2i3s n SER 303 Cb 0.52 0.33 0.20 0.00 -0.26 0.00 0.00 64.21 65.00 2i3s n SER 303 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2i3s h ASP 304 N 0.53 0.83 0.00 4.04 5.19 -1.99 -3.33 116.42 121.68 2i3s h ASP 304 Ca -0.10 -0.10 0.00 0.00 -0.62 0.00 0.00 57.03 56.20 2i3s h ASP 304 Cb 0.40 -0.21 0.00 0.00 0.18 0.00 0.00 39.33 39.69 2i3s h ASP 304 CO 0.17 0.73 -1.03 0.59 -3.12 0.00 0.00 179.24 176.57 2i3s n ASN 305 N -4.32 1.92 -4.03 6.45 3.02 -1.26 -4.88 115.26 112.15 2i3s n ASN 305 Ca 0.06 -0.28 -0.08 0.00 -0.03 0.00 0.00 54.58 54.25 2i3s n ASN 305 Cb 0.16 1.26 -0.10 0.00 -0.61 0.00 0.00 39.78 40.49 2i3s n ASN 305 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2i3s s ILE 306 N -2.33 0.18 -0.23 2.41 -4.36 -1.25 -1.34 121.20 114.27 2i3s s ILE 306 Ca -0.01 -1.48 0.01 0.00 -0.26 0.00 0.00 60.65 58.91 2i3s s ILE 306 Cb 0.06 -1.15 0.06 0.00 1.25 0.00 0.00 42.46 42.68 2i3s s ILE 306 CO 0.38 -0.82 -0.06 -0.22 0.24 0.00 0.00 174.94 174.46 2i3s s LEU 307 N -2.49 2.58 -0.11 0.37 0.20 -0.99 -0.62 118.68 117.63 2i3s s LEU 307 Ca 0.00 -1.16 -0.09 0.00 0.69 0.00 0.00 54.13 53.57 2i3s s LEU 307 Cb 0.03 -1.20 -0.04 0.00 -0.43 0.00 0.00 46.19 44.54 2i3s s LEU 307 CO -0.07 -0.23 0.20 0.00 -0.29 0.00 0.00 176.35 175.96 2i3s s LEU 309 N -0.73 2.50 -0.01 0.00 2.34 -0.31 -0.93 118.68 121.55 2i3s s LEU 309 Ca 0.16 -0.99 0.03 0.00 0.06 0.00 0.00 54.13 53.38 2i3s s LEU 309 Cb -0.13 -0.02 -0.01 0.00 -0.56 0.00 0.00 46.19 45.47 2i3s s LEU 309 CO 0.05 -0.48 -0.09 0.00 -1.06 0.00 0.00 176.35 174.76 2i3s s ALA 310 N -3.62 0.79 -0.07 1.48 0.00 -0.26 -1.16 121.76 118.92 2i3s s ALA 310 Ca 0.10 -0.41 0.03 0.00 0.00 0.00 0.00 51.96 51.68 2i3s s ALA 310 Cb 0.05 -0.20 -0.02 0.00 0.00 0.00 0.00 23.12 22.95 2i3s s ALA 310 CO -0.06 0.19 -0.14 0.95 0.00 0.00 0.00 175.76 176.70 2i3s s THR 311 N -0.22 3.04 0.04 0.00 -4.23 0.17 -1.25 115.64 113.20 2i3s s THR 311 Ca 0.04 -0.71 -0.04 0.00 -1.18 0.00 0.00 61.69 59.79 2i3s s THR 311 Cb -0.04 -2.21 -0.02 0.00 1.34 0.00 0.00 72.50 71.58 2i3s s THR 311 CO -0.00 0.58 0.05 -0.44 -0.54 0.00 0.00 174.62 174.27 2i3s s SER 312 N -0.47 0.25 -0.44 3.99 0.01 0.12 -1.30 113.70 115.86 2i3s s SER 312 Ca 0.06 -0.62 -0.28 0.00 1.31 0.00 0.00 55.95 56.42 2i3s s SER 312 Cb -0.12 0.20 0.03 0.00 0.21 0.00 0.00 66.02 66.34 2i3s s SER 312 CO 0.02 -0.50 1.07 -0.62 0.41 0.00 0.00 173.24 173.62 2i3s s ASP 313 N -2.18 6.65 -0.21 2.44 -1.08 -1.26 -2.32 116.67 118.72 2i3s s ASP 313 Ca -0.04 0.49 0.13 0.00 -0.52 0.00 0.00 52.55 52.62 2i3s s ASP 313 Cb -0.01 -2.52 0.42 0.00 -1.46 0.00 0.00 42.92 39.35 2i3s s ASP 313 CO -0.05 -1.13 1.29 -0.90 0.52 0.00 0.00 175.17 174.90 2i3s n ASP 314 N 7.49 2.39 0.05 -0.34 3.85 -1.26 -4.67 116.55 124.06 2i3s n ASP 314 Ca 0.10 -3.53 0.06 0.00 -0.71 0.00 0.00 54.79 50.71 2i3s n ASP 314 Cb 0.49 -0.53 0.27 0.00 -1.35 0.00 0.00 41.12 39.99 2i3s n ASP 314 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 2i3s n THR 315 N -1.12 1.36 0.30 2.12 -2.24 -1.26 -1.44 114.28 112.00 2i3s n THR 315 Ca 0.22 0.42 0.17 0.00 -2.27 0.00 0.00 64.05 62.60 2i3s n THR 315 Cb 0.80 -1.34 0.80 0.00 -2.10 0.00 0.00 70.33 68.49 2i3s n THR 315 CO 0.00 0.00 0.00 2.19 -0.57 0.00 0.00 175.07 176.69 2i3s h PHE 316 N 0.00 0.00 0.00 4.78 -0.00 -2.00 -2.44 116.94 117.28 2i3s h PHE 316 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 2i3s h PHE 316 Cb 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.08 2i3s h PHE 316 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 178.31 178.67 2i3s n LYS 317 N -2.80 0.08 -0.09 6.09 2.85 -0.52 -1.83 118.16 121.94 2i3s n LYS 317 Ca -0.01 0.44 0.03 0.00 -1.05 0.00 0.00 58.31 57.73 2i3s n LYS 317 Cb 0.18 -1.69 0.08 0.00 -0.65 0.00 0.00 35.03 32.95 2i3s n LYS 317 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 2i3s n THR 318 N -1.84 0.84 -2.02 0.58 -2.24 -0.92 -5.03 114.28 103.65 2i3s n THR 318 Ca 0.01 -0.92 -0.37 0.00 -2.27 0.00 0.00 64.05 60.50 2i3s n THR 318 Cb 0.11 0.60 0.02 0.00 -2.10 0.00 0.00 70.33 68.97 2i3s n THR 318 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2i3s s ASN 319 N -0.93 5.48 0.43 3.42 0.01 -0.76 -4.91 114.94 117.68 2i3s s ASN 319 Ca 0.13 2.47 0.10 0.00 -0.71 0.00 0.00 52.86 54.85 2i3s s ASN 319 Cb 0.07 -2.61 0.93 0.00 0.41 0.00 0.00 41.25 40.05 2i3s s ASN 319 CO 0.09 -1.40 2.04 0.00 -1.51 0.00 0.00 177.10 176.32 2i3s h ALA 320 N 1.37 1.72 -2.62 0.60 0.00 -1.96 -3.45 119.26 114.92 2i3s h ALA 320 Ca -0.50 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.21 2i3s h ALA 320 Cb 1.28 -0.10 -0.13 0.00 0.00 0.00 0.00 17.79 18.84 2i3s h ALA 320 CO 0.57 0.23 -0.39 0.00 0.00 0.00 0.00 179.25 179.66 2i3s s ALA 321 N -5.18 0.25 -0.44 0.00 0.00 -1.26 -5.05 121.76 110.08 2i3s s ALA 321 Ca -0.07 -1.07 -0.02 0.00 0.00 0.00 0.00 51.96 50.80 2i3s s ALA 321 Cb 0.17 0.94 0.21 0.00 0.00 0.00 0.00 23.12 24.44 2i3s s ALA 321 CO 0.72 -0.64 2.25 0.44 0.00 0.00 0.00 175.76 178.53 2i3s n ILE 322 N -0.22 3.11 -2.66 0.00 -0.00 -1.26 -4.20 119.36 114.13 2i3s n ILE 322 Ca -0.05 -2.38 -0.04 0.00 -0.00 0.00 0.00 62.75 60.27 2i3s n ILE 322 Cb 0.63 -1.38 0.06 0.00 -0.00 0.00 0.00 39.64 38.94 2i3s n ILE 322 CO 0.00 0.00 0.00 -0.90 -0.00 0.00 0.00 176.55 175.65 2i3s n ASP 323 N 0.28 -1.37 -4.93 7.28 5.75 -1.26 -5.16 116.55 117.15 2i3s n ASP 323 Ca 0.42 -1.97 -0.21 0.00 -0.01 0.00 0.00 54.79 53.02 2i3s n ASP 323 Cb 0.56 0.87 -0.02 0.00 -1.03 0.00 0.00 41.12 41.51 2i3s n ASP 323 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 2i3s s GLN 324 N 0.10 3.11 0.36 0.11 -0.21 -1.26 -5.06 119.66 116.82 2i3s s GLN 324 Ca 0.11 -0.99 -0.27 0.00 0.02 0.00 0.00 55.36 54.22 2i3s s GLN 324 Cb 0.23 -2.73 -0.12 0.00 1.00 0.00 0.00 33.01 31.40 2i3s s GLN 324 CO -0.06 0.25 1.30 2.41 -2.12 0.00 0.00 175.29 177.08 2i3s n THR 325 N -1.43 2.13 0.00 -0.19 -1.04 -1.26 -4.97 114.28 107.52 2i3s n THR 325 Ca -0.05 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.46 2i3s n THR 325 Cb 0.58 -1.60 0.00 0.00 -1.82 0.00 0.00 70.33 67.49 2i3s n THR 325 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2i3s n ILE 326 N 0.21 0.00 -1.60 12.58 3.06 -1.26 -5.06 119.36 127.28 2i3s n ILE 326 Ca 0.05 0.00 -0.01 0.00 -2.50 0.00 0.00 62.75 60.29 2i3s n ILE 326 Cb 0.37 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.55 2i3s n ILE 326 CO 0.00 0.00 0.00 1.21 -2.50 0.00 0.00 176.55 175.26 2i3s n GLU 327 N 0.00 -0.19 -3.99 9.51 4.07 -1.26 -5.09 120.64 123.69 2i3s n GLU 327 Ca 0.00 0.63 -0.32 0.00 -0.06 0.00 0.00 57.16 57.42 2i3s n GLU 327 Cb 0.00 -1.78 -0.05 0.00 -0.06 0.00 0.00 31.44 29.55 2i3s n GLU 327 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 2i3s s LEU 328 N -1.03 4.12 0.77 4.31 1.43 -1.26 -5.09 118.68 121.93 2i3s s LEU 328 Ca 0.02 0.18 -0.15 0.00 -1.03 0.00 0.00 54.13 53.15 2i3s s LEU 328 Cb -0.00 -2.64 0.03 0.00 0.03 0.00 0.00 46.19 43.61 2i3s s LEU 328 CO 0.06 0.20 1.00 0.59 0.23 0.00 0.00 176.35 178.43 2i3s n ASN 329 N 0.61 0.43 -4.81 2.29 5.03 -1.26 -4.97 115.26 112.59 2i3s n ASN 329 Ca -0.08 0.61 -0.34 0.00 0.87 0.00 0.00 54.58 55.64 2i3s n ASN 329 Cb 0.52 -1.42 -0.06 0.00 -1.02 0.00 0.00 39.78 37.79 2i3s n ASN 329 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2i3s s ALA 330 N -1.97 3.03 0.83 5.41 0.00 -1.26 -4.28 121.76 123.52 2i3s s ALA 330 Ca 0.72 0.47 -0.11 0.00 0.00 0.00 0.00 51.96 53.04 2i3s s ALA 330 Cb -0.32 -3.18 0.09 0.00 0.00 0.00 0.00 23.12 19.72 2i3s s ALA 330 CO 0.52 0.04 1.09 -1.12 0.00 0.00 0.00 175.76 176.29 2i3s s SER 331 N -2.05 4.02 0.02 0.00 0.01 0.25 -4.79 113.70 111.16 2i3s s SER 331 Ca 0.61 1.65 0.00 0.00 1.31 0.00 0.00 55.95 59.53 2i3s s SER 331 Cb -0.12 -2.34 -0.02 0.00 0.21 0.00 0.00 66.02 63.75 2i3s s SER 331 CO 0.16 -2.32 -0.04 -0.44 0.41 0.00 0.00 173.24 171.02 2i3s s SER 332 N -3.42 0.32 -0.02 2.44 0.01 -0.42 -4.82 113.70 107.79 2i3s s SER 332 Ca 0.62 -0.46 0.03 0.00 1.31 0.00 0.00 55.95 57.46 2i3s s SER 332 Cb -0.17 0.08 -0.00 0.00 0.21 0.00 0.00 66.02 66.13 2i3s s SER 332 CO 0.56 -0.25 -0.12 -0.63 0.41 0.00 0.00 173.24 173.21 2i3s s ILE 333 N -1.30 1.02 0.10 1.44 1.01 -1.26 -0.66 121.20 121.56 2i3s s ILE 333 Ca -0.13 -0.52 0.03 0.00 0.00 0.00 0.00 60.65 60.03 2i3s s ILE 333 Cb -0.09 -0.88 -0.04 0.00 0.01 0.00 0.00 42.46 41.46 2i3s s ILE 333 CO -0.01 0.30 -0.08 -0.31 0.00 0.00 0.00 174.94 174.84 2i3s s TYR 334 N -0.03 0.99 -0.11 3.97 1.51 -0.31 -0.31 117.35 123.06 2i3s s TYR 334 Ca -0.00 -0.76 0.00 0.00 -1.01 0.00 0.00 57.07 55.30 2i3s s TYR 334 Cb -0.08 -0.55 0.02 0.00 -0.11 0.00 0.00 41.96 41.24 2i3s s TYR 334 CO 0.00 -0.05 -0.09 0.42 -1.11 0.00 0.00 175.55 174.72 2i3s s ILE 335 N -2.97 1.12 -0.51 2.71 1.01 0.75 -1.16 121.20 122.16 2i3s s ILE 335 Ca 0.09 -0.37 -0.17 0.00 0.00 0.00 0.00 60.65 60.19 2i3s s ILE 335 Cb 0.01 -1.10 0.09 0.00 0.01 0.00 0.00 42.46 41.46 2i3s s ILE 335 CO -0.02 0.38 0.52 -0.63 0.00 0.00 0.00 174.94 175.19 2i3s s ILE 336 N 1.46 5.08 0.41 2.92 1.01 -0.06 -1.13 121.20 130.88 2i3s s ILE 336 Ca 0.01 -1.01 -0.23 0.00 0.00 0.00 0.00 60.65 59.41 2i3s s ILE 336 Cb -0.13 -4.27 -0.10 0.00 0.01 0.00 0.00 42.46 37.97 2i3s s ILE 336 CO -0.06 -0.78 1.00 -0.36 0.00 0.00 0.00 174.94 174.74 2i3s s PHE 337 N 2.03 3.32 -1.59 3.97 0.08 0.17 -2.33 117.98 123.62 2i3s s PHE 337 Ca 0.08 1.65 -0.13 0.00 0.12 0.00 0.00 56.93 58.65 2i3s s PHE 337 Cb -0.24 -3.01 0.10 0.00 -0.57 0.00 0.00 43.02 39.30 2i3s s PHE 337 CO 0.07 -0.36 0.73 -0.25 -0.10 0.00 0.00 175.22 175.31 2i3s n ASP 338 N -0.24 -2.80 0.32 1.36 10.43 -0.45 -1.66 116.55 123.51 2i3s n ASP 338 Ca 0.06 -0.96 0.21 0.00 2.57 0.00 0.00 54.79 56.66 2i3s n ASP 338 Cb 0.51 -3.08 1.04 0.00 1.84 0.00 0.00 41.12 41.43 2i3s n ASP 338 CO 0.00 0.00 0.00 0.10 -1.07 0.00 0.00 177.20 176.23 2i3s h TYR 339 N -1.71 0.00 0.00 1.24 -0.00 -1.68 -3.30 116.97 111.52 2i3s h TYR 339 Ca -0.60 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.13 2i3s h TYR 339 Cb 1.38 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.11 2i3s h TYR 339 CO 0.58 0.00 0.00 -0.85 -0.00 0.00 0.00 178.16 177.89