#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ic9 s VAL 3 N 0.00 1.89 0.02 0.58 1.01 -1.26 -0.83 120.40 121.81 3ic9 s VAL 3 Ca 0.00 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 61.04 3ic9 s VAL 3 Cb 0.00 -1.61 -0.01 0.00 0.00 0.00 0.00 36.38 34.75 3ic9 s VAL 3 CO 0.00 0.53 -0.07 -0.63 0.00 0.00 0.00 175.10 174.93 3ic9 s ILE 4 N 0.03 0.50 -0.19 2.22 1.01 -0.07 -4.98 121.20 119.71 3ic9 s ILE 4 Ca -0.08 -0.59 -0.09 0.00 0.00 0.00 0.00 60.65 59.89 3ic9 s ILE 4 Cb -0.14 -0.48 -0.05 0.00 0.01 0.00 0.00 42.46 41.79 3ic9 s ILE 4 CO 0.05 -0.08 0.12 0.20 0.00 0.00 0.00 174.94 175.22 3ic9 s ASN 5 N -0.73 6.10 0.10 3.58 0.01 -1.26 0.82 114.94 123.56 3ic9 s ASN 5 Ca -0.03 0.21 0.03 0.00 -0.71 0.00 0.00 52.86 52.37 3ic9 s ASN 5 Cb -0.05 -2.06 -0.04 0.00 0.41 0.00 0.00 41.25 39.51 3ic9 s ASN 5 CO 0.00 0.19 -0.09 0.68 -1.51 0.00 0.00 177.10 176.38 3ic9 s VAL 6 N 0.28 0.86 0.20 1.60 -7.23 -0.51 -4.95 120.40 110.65 3ic9 s VAL 6 Ca 0.07 -1.75 0.02 0.00 -1.81 0.00 0.00 61.98 58.52 3ic9 s VAL 6 Cb -0.11 -1.47 -0.08 0.00 0.56 0.00 0.00 36.38 35.27 3ic9 s VAL 6 CO -0.01 -0.68 1.48 0.44 -0.31 0.00 0.00 175.10 176.03 3ic9 h ASP 7 N 3.33 0.33 -3.18 4.85 3.32 -1.50 -2.55 116.42 121.02 3ic9 h ASP 7 Ca -0.36 -0.21 -0.26 0.00 0.02 0.00 0.00 57.03 56.21 3ic9 h ASP 7 Cb 1.18 -0.10 -0.34 0.00 0.22 0.00 0.00 39.33 40.30 3ic9 h ASP 7 CO 0.57 0.92 -0.60 -0.69 -1.72 0.00 0.00 179.24 177.73 3ic9 s VAL 8 N -3.60 -0.20 -0.11 -1.35 1.01 -0.94 -0.31 120.40 114.89 3ic9 s VAL 8 Ca -0.04 0.28 -0.01 0.00 0.00 0.00 0.00 61.98 62.21 3ic9 s VAL 8 Cb 0.11 -0.30 -0.03 0.00 0.00 0.00 0.00 36.38 36.16 3ic9 s VAL 8 CO 0.82 0.12 -0.07 0.00 0.00 0.00 0.00 175.10 175.96 3ic9 s ALA 9 N 1.90 2.93 -0.24 5.51 0.00 -0.37 -1.96 121.76 129.54 3ic9 s ALA 9 Ca -0.02 -0.87 -0.01 0.00 0.00 0.00 0.00 51.96 51.06 3ic9 s ALA 9 Cb -0.12 -1.34 0.02 0.00 0.00 0.00 0.00 23.12 21.69 3ic9 s ALA 9 CO -0.06 0.40 -0.08 0.42 0.00 0.00 0.00 175.76 176.44 3ic9 s ILE 10 N -0.22 2.79 -0.45 0.00 1.01 -0.10 -0.88 121.20 123.35 3ic9 s ILE 10 Ca 0.03 -0.97 -0.22 0.00 0.00 0.00 0.00 60.65 59.49 3ic9 s ILE 10 Cb -0.13 -2.38 0.03 0.00 0.01 0.00 0.00 42.46 39.99 3ic9 s ILE 10 CO 0.03 0.27 0.74 -0.63 0.00 0.00 0.00 174.94 175.34 3ic9 s ILE 11 N 1.33 4.70 0.00 2.92 1.01 -0.11 -0.64 121.20 130.42 3ic9 s ILE 11 Ca 0.01 0.30 0.00 0.00 0.00 0.00 0.00 60.65 60.96 3ic9 s ILE 11 Cb -0.16 -4.29 0.00 0.00 0.01 0.00 0.00 42.46 38.02 3ic9 s ILE 11 CO -0.06 -0.69 0.00 0.61 0.00 0.00 0.00 174.94 174.80 3ic9 n GLY 12 N 5.01 1.62 2.75 6.18 0.00 0.48 -0.41 105.19 120.81 3ic9 n GLY 12 Ca 0.01 -1.20 -0.35 0.00 0.00 0.00 0.00 46.02 44.48 3ic9 n GLY 12 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3ic9 n THR 13 N 2.64 3.72 -0.77 2.61 -1.04 -1.22 -4.05 114.28 116.17 3ic9 n THR 13 Ca 0.00 -5.03 0.00 0.00 -2.04 0.00 0.00 64.05 56.98 3ic9 n THR 13 Cb 0.00 -1.34 0.00 0.00 -1.82 0.00 0.00 70.33 67.17 3ic9 n THR 13 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3ic9 n GLY 14 N -0.38 2.12 0.20 3.41 0.00 -1.26 -4.48 105.19 104.81 3ic9 n GLY 14 Ca 0.45 -1.85 -0.14 0.00 0.00 0.00 0.00 46.02 44.48 3ic9 n GLY 14 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3ic9 h THR 15 N 0.00 0.69 -0.90 2.61 2.02 -1.93 -3.16 112.91 112.24 3ic9 h THR 15 Ca 0.00 -0.49 -0.01 0.00 0.77 0.00 0.00 66.41 66.68 3ic9 h THR 15 Cb 0.00 0.94 -0.04 0.00 -1.74 0.00 0.00 68.15 67.30 3ic9 h THR 15 CO 0.00 0.09 0.53 0.00 0.37 0.00 0.00 175.52 176.51 3ic9 h ALA 16 N -0.15 1.23 0.00 6.16 0.00 -1.90 -2.17 119.26 122.44 3ic9 h ALA 16 Ca -0.04 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3ic9 h ALA 16 Cb 0.49 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3ic9 h ALA 16 CO 0.07 0.65 0.00 0.41 0.00 0.00 0.00 179.25 180.38 3ic9 n GLY 17 N -1.22 0.92 1.93 0.00 0.00 -1.20 -0.61 105.19 105.02 3ic9 n GLY 17 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3ic9 n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ic9 n GLY 19 N 0.30 0.00 0.27 -0.02 0.00 -0.81 -1.09 105.19 103.84 3ic9 n GLY 19 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3ic9 n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ic9 h ALA 20 N 0.00 0.98 0.07 4.61 0.00 -0.61 -1.65 119.26 122.67 3ic9 h ALA 20 Ca 0.00 0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.96 3ic9 h ALA 20 Cb 0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3ic9 h ALA 20 CO 0.00 0.03 -0.19 -0.92 0.00 0.00 0.00 179.25 178.18 3ic9 h TYR 21 N 0.69 -0.49 -0.43 0.00 3.20 -1.38 0.42 116.97 118.98 3ic9 h TYR 21 Ca 0.33 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.26 3ic9 h TYR 21 Cb 0.27 0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.71 3ic9 h TYR 21 CO -0.08 -0.27 0.19 0.00 -1.64 0.00 0.00 178.16 176.35 3ic9 h ARG 22 N -0.34 0.37 -0.40 1.82 3.08 -1.78 0.18 114.38 117.30 3ic9 h ARG 22 Ca 0.04 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 60.02 3ic9 h ARG 22 Cb 0.38 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 3ic9 h ARG 22 CO -0.13 0.24 0.08 0.00 -1.07 0.00 0.00 179.97 179.09 3ic9 h ALA 23 N 1.25 0.52 -0.59 0.04 0.00 -1.02 -3.05 119.26 116.42 3ic9 h ALA 23 Ca 0.19 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 3ic9 h ALA 23 Cb 0.14 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3ic9 h ALA 23 CO -0.16 0.22 0.10 0.00 0.00 0.00 0.00 179.25 179.40 3ic9 h ALA 24 N 0.93 1.06 0.00 0.00 0.00 0.17 -2.74 119.26 118.69 3ic9 h ALA 24 Ca 0.12 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3ic9 h ALA 24 Cb 0.34 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3ic9 h ALA 24 CO 0.01 0.61 0.00 1.63 0.00 0.00 0.00 179.25 181.49 3ic9 n LYS 25 N -4.23 0.19 0.20 0.00 4.76 0.59 -1.64 118.16 118.03 3ic9 n LYS 25 Ca 0.04 0.44 0.07 0.00 -2.87 0.00 0.00 58.31 55.99 3ic9 n LYS 25 Cb 0.27 -1.88 0.38 0.00 -1.84 0.00 0.00 35.03 31.97 3ic9 n LYS 25 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 3ic9 h LYS 26 N 0.00 0.00 0.00 1.97 1.57 -1.42 -3.33 116.57 115.36 3ic9 h LYS 26 Ca 0.00 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.54 3ic9 h LYS 26 Cb 0.33 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.59 3ic9 h LYS 26 CO 0.00 0.32 -2.17 0.72 -0.57 0.00 0.00 179.45 177.75 3ic9 n HIS 27 N -3.51 0.00 -3.59 -1.35 8.25 -0.65 -5.03 115.22 109.34 3ic9 n HIS 27 Ca -0.00 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.29 3ic9 n HIS 27 Cb 0.47 -0.78 -0.07 0.00 1.12 0.00 0.00 29.99 30.74 3ic9 n HIS 27 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 3ic9 s THR 28 N -2.75 0.02 -0.32 1.59 -1.32 -0.97 -4.95 115.64 106.94 3ic9 s THR 28 Ca -0.09 -0.14 0.22 0.00 -1.21 0.00 0.00 61.69 60.48 3ic9 s THR 28 Cb 0.08 -0.89 0.15 0.00 -1.51 0.00 0.00 72.50 70.33 3ic9 s THR 28 CO 0.79 -0.08 1.31 -2.24 -2.21 0.00 0.00 174.62 172.19 3ic9 h ASP 29 N 3.29 0.00 -1.88 8.08 2.03 -1.87 -3.36 116.42 122.70 3ic9 h ASP 29 Ca -0.28 0.00 -0.71 0.00 -0.73 0.00 0.00 57.03 55.31 3ic9 h ASP 29 Cb 1.15 0.00 -0.15 0.00 -0.83 0.00 0.00 39.33 39.50 3ic9 h ASP 29 CO 0.39 0.05 1.45 -0.54 -1.03 0.00 0.00 179.24 179.56 3ic9 s LYS 30 N -3.26 3.96 -0.04 4.15 3.01 -1.26 -4.94 119.74 121.36 3ic9 s LYS 30 Ca 0.03 -2.23 -0.02 0.00 -1.01 0.00 0.00 55.97 52.73 3ic9 s LYS 30 Cb 0.07 -5.15 0.02 0.00 -1.01 0.00 0.00 37.83 31.76 3ic9 s LYS 30 CO 0.74 -1.90 0.10 0.54 0.51 0.00 0.00 175.35 175.34 3ic9 s VAL 31 N 2.52 -0.03 0.13 3.17 0.11 -1.26 -1.34 120.40 123.70 3ic9 s VAL 31 Ca 0.44 0.11 0.09 0.00 -2.93 0.00 0.00 61.98 59.69 3ic9 s VAL 31 Cb -0.02 -0.16 -0.04 0.00 -1.53 0.00 0.00 36.38 34.63 3ic9 s VAL 31 CO -0.01 0.04 -0.18 0.68 -3.33 0.00 0.00 175.10 172.31 3ic9 s VAL 32 N 0.67 2.84 -0.20 2.04 -7.23 -0.83 -4.61 120.40 113.09 3ic9 s VAL 32 Ca -0.05 -1.55 -0.04 0.00 -1.81 0.00 0.00 61.98 58.52 3ic9 s VAL 32 Cb -0.07 -2.32 -0.02 0.00 0.56 0.00 0.00 36.38 34.53 3ic9 s VAL 32 CO -0.03 0.07 -0.02 -0.76 -0.31 0.00 0.00 175.10 174.05 3ic9 s LEU 33 N -2.24 3.13 -0.14 1.32 1.02 0.11 -0.92 118.68 120.97 3ic9 s LEU 33 Ca 0.19 -0.26 -0.03 0.00 0.02 0.00 0.00 54.13 54.05 3ic9 s LEU 33 Cb -0.10 -1.79 -0.03 0.00 0.02 0.00 0.00 46.19 44.29 3ic9 s LEU 33 CO 0.11 0.05 -0.05 -0.63 0.02 0.00 0.00 176.35 175.84 3ic9 s ILE 34 N 1.09 3.80 -0.06 -0.59 1.01 0.19 -0.99 121.20 125.65 3ic9 s ILE 34 Ca 0.02 -0.40 -0.02 0.00 0.00 0.00 0.00 60.65 60.25 3ic9 s ILE 34 Cb -0.14 -2.64 0.03 0.00 0.01 0.00 0.00 42.46 39.72 3ic9 s ILE 34 CO 0.01 0.52 0.03 -0.70 0.00 0.00 0.00 174.94 174.80 3ic9 s GLU 35 N 0.12 0.29 0.28 2.79 2.56 -0.83 -0.39 118.70 123.52 3ic9 s GLU 35 Ca -0.02 0.22 0.23 0.00 0.00 0.00 0.00 54.97 55.40 3ic9 s GLU 35 Cb -0.14 -0.79 0.11 0.00 2.00 0.00 0.00 34.13 35.32 3ic9 s GLU 35 CO 0.03 -0.32 1.24 0.78 -0.56 0.00 0.00 175.26 176.42 3ic9 h GLY 36 N 8.38 0.00 0.00 -1.50 0.00 -1.73 -0.62 103.07 107.60 3ic9 h GLY 36 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.17 3ic9 h GLY 36 CO 0.21 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.36 3ic9 n GLY 37 N 1.15 5.97 3.76 4.60 0.00 -1.26 -4.69 105.19 114.73 3ic9 n GLY 37 Ca 0.01 -1.89 -0.39 0.00 0.00 0.00 0.00 46.02 43.75 3ic9 n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ic9 s ALA 38 N -2.02 3.33 0.71 4.61 0.00 -1.26 -5.01 121.76 122.11 3ic9 s ALA 38 Ca 0.00 0.89 -0.11 0.00 0.00 0.00 0.00 51.96 52.73 3ic9 s ALA 38 Cb 0.00 -3.33 0.02 0.00 0.00 0.00 0.00 23.12 19.81 3ic9 s ALA 38 CO 0.00 -0.23 1.07 0.71 0.00 0.00 0.00 175.76 177.31 3ic9 s TYR 39 N -1.28 2.93 0.00 0.00 1.51 -1.26 -4.59 117.35 114.66 3ic9 s TYR 39 Ca 0.48 1.47 0.00 0.00 -1.01 0.00 0.00 57.07 58.02 3ic9 s TYR 39 Cb -0.30 -2.95 0.00 0.00 -0.11 0.00 0.00 41.96 38.59 3ic9 s TYR 39 CO 0.39 -1.40 0.00 0.41 -1.11 0.00 0.00 175.55 173.84 3ic9 n GLY 40 N -1.61 1.25 0.48 0.71 0.00 -1.26 -4.91 105.19 99.84 3ic9 n GLY 40 Ca 0.08 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.11 3ic9 n GLY 40 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ic9 n THR 41 N 0.00 -0.83 -0.12 2.61 -2.24 -1.26 -4.18 114.28 108.26 3ic9 n THR 41 Ca 0.00 0.43 -0.03 0.00 -2.27 0.00 0.00 64.05 62.18 3ic9 n THR 41 Cb 0.00 -0.71 0.18 0.00 -2.10 0.00 0.00 70.33 67.70 3ic9 n THR 41 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3ic9 h THR 42 N 0.00 1.23 -0.01 4.28 2.02 -1.94 -2.25 112.91 116.24 3ic9 h THR 42 Ca -0.01 -0.86 0.03 0.00 0.77 0.00 0.00 66.41 66.35 3ic9 h THR 42 Cb 0.31 0.72 -0.04 0.00 -1.74 0.00 0.00 68.15 67.40 3ic9 h THR 42 CO 0.00 0.31 -0.21 0.00 0.37 0.00 0.00 175.52 175.99 3ic9 h ALA 44 N 0.55 0.39 -0.00 0.00 0.00 -1.70 -2.20 119.26 116.31 3ic9 h ALA 44 Ca 0.06 -0.54 -0.07 0.00 0.00 0.00 0.00 54.91 54.37 3ic9 h ALA 44 Cb 0.42 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.16 3ic9 h ALA 44 CO -0.20 0.65 -0.26 0.00 0.00 0.00 0.00 179.25 179.44 3ic9 h ARG 45 N 0.59 0.18 0.00 0.00 3.08 -1.36 -3.41 114.38 113.47 3ic9 h ARG 45 Ca -0.01 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 59.85 3ic9 h ARG 45 Cb 1.22 0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.33 3ic9 h ARG 45 CO 0.13 0.92 -0.25 1.33 -1.07 0.00 0.00 179.97 181.04 3ic9 n VAL 46 N -4.50 0.00 0.00 2.04 0.24 -0.64 -4.81 118.33 110.66 3ic9 n VAL 46 Ca -0.10 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.20 3ic9 n VAL 46 Cb 0.51 0.31 0.00 0.00 -1.47 0.00 0.00 33.84 33.18 3ic9 n VAL 46 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ic9 n GLY 47 N 0.00 2.70 0.15 7.63 0.00 -0.00 -4.72 105.19 110.95 3ic9 n GLY 47 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.82 3ic9 n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ic9 n PRO 50 N -0.09 0.00 -0.13 0.00 -0.04 -1.26 -1.06 135.00 132.41 3ic9 n PRO 50 Ca 0.00 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.36 3ic9 n PRO 50 Cb 0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.45 3ic9 n PRO 50 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3ic9 h SER 51 N 0.00 0.63 -0.25 3.54 4.64 -1.75 -0.35 113.55 120.01 3ic9 h SER 51 Ca 0.00 -0.27 -0.03 0.00 -0.47 0.00 0.00 61.79 61.02 3ic9 h SER 51 Cb 0.00 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 61.91 3ic9 h SER 51 CO 0.00 0.74 0.07 0.11 -0.87 0.00 0.00 176.83 176.87 3ic9 h LYS 52 N 0.49 0.48 -0.58 4.77 6.56 -1.34 -1.15 116.57 125.81 3ic9 h LYS 52 Ca 0.12 -0.08 -0.04 0.00 -1.06 0.00 0.00 60.65 59.59 3ic9 h LYS 52 Cb 0.38 -0.08 -0.02 0.00 -0.57 0.00 0.00 32.23 31.93 3ic9 h LYS 52 CO 0.01 0.45 0.20 -0.07 -2.06 0.00 0.00 179.45 177.99 3ic9 h LEU 53 N 0.47 0.83 -0.66 2.94 3.38 -1.71 -1.32 115.31 119.24 3ic9 h LEU 53 Ca 0.11 -0.19 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 3ic9 h LEU 53 Cb 0.20 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 3ic9 h LEU 53 CO -0.00 0.80 -0.01 0.25 0.09 0.00 0.00 178.44 179.56 3ic9 h LEU 54 N 0.81 1.01 -0.63 1.67 5.85 -0.70 -2.92 115.31 120.41 3ic9 h LEU 54 Ca 0.19 -0.29 -0.06 0.00 0.84 0.00 0.00 57.88 58.56 3ic9 h LEU 54 Cb 0.25 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 3ic9 h LEU 54 CO -0.01 1.07 0.17 0.40 -0.34 0.00 0.00 178.44 179.73 3ic9 h ILE 55 N 0.94 1.25 -0.30 4.05 2.04 -1.05 -0.40 117.51 124.04 3ic9 h ILE 55 Ca 0.17 -0.89 -0.03 0.00 1.00 0.00 0.00 64.86 65.10 3ic9 h ILE 55 Cb 0.56 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 3ic9 h ILE 55 CO 0.03 0.34 0.08 0.00 0.00 0.00 0.00 178.15 178.60 3ic9 h ALA 56 N 1.06 0.40 -0.46 1.87 0.00 -1.20 0.24 119.26 121.17 3ic9 h ALA 56 Ca 0.20 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 54.97 3ic9 h ALA 56 Cb 0.33 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3ic9 h ALA 56 CO -0.00 0.06 0.25 0.00 0.00 0.00 0.00 179.25 179.55 3ic9 h ALA 57 N 0.91 0.58 -0.12 0.00 0.00 -1.39 -1.90 119.26 117.34 3ic9 h ALA 57 Ca 0.10 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.04 3ic9 h ALA 57 Cb 0.28 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3ic9 h ALA 57 CO 0.00 -0.09 -0.08 0.00 0.00 0.00 0.00 179.25 179.08 3ic9 h ALA 58 N 1.22 0.01 -0.64 0.00 0.00 -0.62 -1.85 119.26 117.38 3ic9 h ALA 58 Ca 0.19 0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.23 3ic9 h ALA 58 Cb 0.06 0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.97 3ic9 h ALA 58 CO -0.11 -0.54 0.31 -0.44 0.00 0.00 0.00 179.25 178.47 3ic9 h ASP 59 N -0.09 0.40 -0.56 0.00 3.32 -0.31 -0.20 116.42 118.99 3ic9 h ASP 59 Ca 0.07 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.15 3ic9 h ASP 59 Cb 0.20 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 3ic9 h ASP 59 CO -0.17 0.24 0.22 0.00 -1.72 0.00 0.00 179.24 177.81 3ic9 h ALA 60 N 1.39 0.73 -0.21 3.45 0.00 -1.14 -0.13 119.26 123.35 3ic9 h ALA 60 Ca 0.31 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3ic9 h ALA 60 Cb 0.30 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3ic9 h ALA 60 CO -0.24 0.34 0.10 1.03 0.00 0.00 0.00 179.25 180.48 3ic9 h SER 61 N 0.77 0.26 -0.06 0.00 0.87 -0.73 -2.10 113.55 112.56 3ic9 h SER 61 Ca 0.19 -0.11 -0.02 0.00 -1.23 0.00 0.00 61.79 60.62 3ic9 h SER 61 Cb 0.21 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.10 3ic9 h SER 61 CO -0.01 0.30 -0.02 0.22 -0.53 0.00 0.00 176.83 176.78 3ic9 h TYR 62 N 0.21 0.14 -0.42 2.24 3.20 -0.93 -2.95 116.97 118.46 3ic9 h TYR 62 Ca 0.07 -0.03 0.06 0.00 3.14 0.00 0.00 58.73 61.96 3ic9 h TYR 62 Cb 0.10 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 3ic9 h TYR 62 CO -0.03 0.48 0.28 0.45 -1.64 0.00 0.00 178.16 177.70 3ic9 h HIS 63 N -0.24 0.33 -0.04 -3.82 3.86 -1.01 0.64 115.15 114.87 3ic9 h HIS 63 Ca 0.01 0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.24 3ic9 h HIS 63 Cb 0.44 -0.11 -0.00 0.00 1.06 0.00 0.00 27.41 28.80 3ic9 h HIS 63 CO 0.06 0.18 0.04 0.00 0.86 0.00 0.00 177.93 179.07 3ic9 h ALA 64 N 1.77 1.75 -0.01 2.45 0.00 -1.20 -0.97 119.26 123.06 3ic9 h ALA 64 Ca 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3ic9 h ALA 64 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3ic9 h ALA 64 CO -0.04 -0.06 -0.21 -1.13 0.00 0.00 0.00 179.25 177.81 3ic9 n SER 65 N -4.09 0.88 -1.04 0.00 3.41 0.21 -4.26 113.62 108.73 3ic9 n SER 65 Ca -0.02 -0.81 0.03 0.00 -0.26 0.00 0.00 58.87 57.81 3ic9 n SER 65 Cb 0.13 0.07 0.24 0.00 -0.26 0.00 0.00 64.21 64.39 3ic9 n SER 65 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ic9 n GLN 66 N -0.72 2.51 0.11 4.33 1.13 -0.37 -4.68 117.38 119.70 3ic9 n GLN 66 Ca 0.13 -2.97 0.13 0.00 -1.94 0.00 0.00 57.00 52.35 3ic9 n GLN 66 Cb 0.33 -1.85 0.33 0.00 0.11 0.00 0.00 30.24 29.16 3ic9 n GLN 66 CO 0.00 0.00 0.00 1.79 -1.44 0.00 0.00 177.06 177.41 3ic9 h THR 67 N 1.48 0.00 0.00 5.09 1.35 -1.74 -3.35 112.91 115.74 3ic9 h THR 67 Ca 0.10 -0.56 -0.02 0.00 -0.55 0.00 0.00 66.41 65.38 3ic9 h THR 67 Cb 1.58 1.49 -0.00 0.00 -1.73 0.00 0.00 68.15 69.48 3ic9 h THR 67 CO 0.32 0.00 -0.10 0.44 -0.25 0.00 0.00 175.52 175.93 3ic9 h ASP 68 N 0.00 0.00 -0.65 5.36 5.19 -1.69 -1.75 116.42 122.88 3ic9 h ASP 68 Ca 0.00 0.00 0.02 0.00 -0.62 0.00 0.00 57.03 56.43 3ic9 h ASP 68 Cb 0.78 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.26 3ic9 h ASP 68 CO 0.00 0.10 0.43 0.25 -3.12 0.00 0.00 179.24 176.90 3ic9 h LEU 69 N 0.00 0.70 -0.09 1.55 5.85 -1.85 -2.43 115.31 119.04 3ic9 h LEU 69 Ca -0.00 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.71 3ic9 h LEU 69 Cb 0.55 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.41 3ic9 h LEU 69 CO 0.01 0.50 -0.42 0.49 -0.34 0.00 0.00 178.44 178.67 3ic9 n PHE 70 N -4.45 0.00 0.00 1.25 3.01 -0.70 -4.92 117.46 111.65 3ic9 n PHE 70 Ca 0.07 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.53 3ic9 n PHE 70 Cb 0.09 -0.24 0.00 0.00 -0.01 0.00 0.00 39.48 39.32 3ic9 n PHE 70 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3ic9 n GLY 71 N 1.47 1.13 3.39 1.37 0.00 -0.91 -5.11 105.19 106.53 3ic9 n GLY 71 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 3ic9 n GLY 71 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ic9 s ILE 72 N -2.00 2.62 0.18 -0.61 1.09 -0.98 -5.00 121.20 116.50 3ic9 s ILE 72 Ca 0.00 -0.88 0.09 0.00 -1.10 0.00 0.00 60.65 58.75 3ic9 s ILE 72 Cb 0.00 -1.99 -0.04 0.00 -1.06 0.00 0.00 42.46 39.37 3ic9 s ILE 72 CO 0.00 0.58 -0.18 0.00 -0.10 0.00 0.00 174.94 175.24 3ic9 s GLN 73 N -0.57 1.30 0.12 2.79 -2.07 -1.26 -2.08 119.66 117.90 3ic9 s GLN 73 Ca 0.08 -1.45 0.07 0.00 -1.82 0.00 0.00 55.36 52.24 3ic9 s GLN 73 Cb -0.11 -1.32 -0.04 0.00 -1.09 0.00 0.00 33.01 30.46 3ic9 s GLN 73 CO 0.01 0.26 -0.17 0.14 -1.32 0.00 0.00 175.29 174.21 3ic9 s VAL 74 N -2.21 1.54 0.03 3.63 -7.23 -1.26 -5.04 120.40 109.87 3ic9 s VAL 74 Ca 0.17 -1.67 -0.16 0.00 -1.81 0.00 0.00 61.98 58.51 3ic9 s VAL 74 Cb -0.05 -1.57 -0.30 0.00 0.56 0.00 0.00 36.38 35.02 3ic9 s VAL 74 CO 0.07 -0.27 1.06 0.44 -0.31 0.00 0.00 175.10 176.09 3ic9 h ASP 75 N 3.69 0.81 -3.41 4.85 5.19 -2.01 -3.49 116.42 122.06 3ic9 h ASP 75 Ca -0.42 -0.85 0.08 0.00 -0.62 0.00 0.00 57.03 55.22 3ic9 h ASP 75 Cb 1.19 -0.26 -0.26 0.00 0.18 0.00 0.00 39.33 40.19 3ic9 h ASP 75 CO 0.46 1.59 0.54 -0.60 -3.12 0.00 0.00 179.24 178.11 3ic9 s ARG 76 N -2.86 0.48 -0.13 3.56 3.52 -1.26 -5.15 118.95 117.11 3ic9 s ARG 76 Ca -0.10 0.38 0.02 0.00 -0.13 0.00 0.00 55.73 55.89 3ic9 s ARG 76 Cb 0.05 0.23 0.02 0.00 -1.56 0.00 0.00 34.95 33.68 3ic9 s ARG 76 CO 0.92 -0.10 -0.17 0.42 -0.81 0.00 0.00 175.30 175.56 3ic9 s ILE 77 N -0.28 1.70 -0.16 4.11 1.01 -1.26 -5.12 121.20 121.20 3ic9 s ILE 77 Ca 0.02 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 59.93 3ic9 s ILE 77 Cb -0.03 -1.55 0.03 0.00 0.01 0.00 0.00 42.46 40.92 3ic9 s ILE 77 CO -0.05 0.48 -0.11 -0.55 0.00 0.00 0.00 174.94 174.71 3ic9 s SER 78 N 1.08 2.86 -0.43 3.58 0.15 -1.26 -5.09 113.70 114.59 3ic9 s SER 78 Ca -0.03 -0.61 -0.16 0.00 0.70 0.00 0.00 55.95 55.85 3ic9 s SER 78 Cb -0.14 -1.13 0.03 0.00 -1.71 0.00 0.00 66.02 63.06 3ic9 s SER 78 CO -0.05 -0.10 0.40 -0.69 1.20 0.00 0.00 173.24 174.00 3ic9 s VAL 79 N 1.50 5.15 -1.01 4.45 1.01 -1.26 -5.00 120.40 125.24 3ic9 s VAL 79 Ca 0.03 -0.56 -0.18 0.00 0.00 0.00 0.00 61.98 61.27 3ic9 s VAL 79 Cb -0.14 -4.04 0.13 0.00 0.00 0.00 0.00 36.38 32.33 3ic9 s VAL 79 CO -0.09 -0.44 1.25 0.21 0.00 0.00 0.00 175.10 176.02 3ic9 s ASN 80 N 1.95 6.71 0.29 3.32 2.47 -1.26 -4.89 114.94 123.53 3ic9 s ASN 80 Ca 0.09 -2.19 0.04 0.00 0.42 0.00 0.00 52.86 51.22 3ic9 s ASN 80 Cb -0.19 -2.42 0.74 0.00 -1.45 0.00 0.00 41.25 37.92 3ic9 s ASN 80 CO 0.11 -1.05 1.71 1.23 -3.72 0.00 0.00 177.10 175.38 3ic9 h GLY 81 N 10.60 1.59 0.99 1.21 0.00 -1.94 -0.95 103.07 114.57 3ic9 h GLY 81 Ca 0.20 -0.21 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 3ic9 h GLY 81 CO 1.18 -0.23 0.26 0.50 0.00 0.00 0.00 176.54 178.25 3ic9 h LYS 82 N 0.46 0.84 -0.23 4.80 1.57 -1.91 -2.65 116.57 119.45 3ic9 h LYS 82 Ca 0.56 -0.13 -0.12 0.00 -1.87 0.00 0.00 60.65 59.09 3ic9 h LYS 82 Cb 1.04 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 3ic9 h LYS 82 CO -0.50 0.70 -0.38 0.00 -0.57 0.00 0.00 179.45 178.70 3ic9 h ALA 83 N 1.10 0.91 0.00 3.86 0.00 -1.69 -1.47 119.26 121.98 3ic9 h ALA 83 Ca 0.20 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3ic9 h ALA 83 Cb 0.15 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3ic9 h ALA 83 CO -0.02 0.63 0.00 0.28 0.00 0.00 0.00 179.25 180.14 3ic9 n VAL 84 N -4.04 0.00 0.00 0.00 0.31 -0.43 -1.69 118.33 112.48 3ic9 n VAL 84 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 3ic9 n VAL 84 Cb 0.49 -0.06 0.00 0.00 -0.91 0.00 0.00 33.84 33.37 3ic9 n VAL 84 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 3ic9 n LYS 86 N 0.42 0.00 -0.31 5.55 3.00 -0.55 -2.64 118.16 123.64 3ic9 n LYS 86 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.26 3ic9 n LYS 86 Cb 0.02 0.00 0.07 0.00 0.00 0.00 0.00 35.03 35.12 3ic9 n LYS 86 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.40 177.31 3ic9 h ARG 87 N 0.00 1.19 -0.56 1.64 1.12 -1.59 0.21 114.38 116.39 3ic9 h ARG 87 Ca 0.00 -0.17 0.04 0.00 -1.11 0.00 0.00 59.98 58.75 3ic9 h ARG 87 Cb 0.00 -0.22 -0.05 0.00 -0.01 0.00 0.00 29.97 29.70 3ic9 h ARG 87 CO 0.00 0.90 0.30 0.82 -3.11 0.00 0.00 179.97 178.88 3ic9 h ILE 88 N 1.17 0.98 -0.27 1.20 2.04 -1.76 -1.64 117.51 119.24 3ic9 h ILE 88 Ca 0.29 -0.20 -0.09 0.00 1.00 0.00 0.00 64.86 65.86 3ic9 h ILE 88 Cb 0.10 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 3ic9 h ILE 88 CO -0.04 0.11 -0.18 1.56 0.00 0.00 0.00 178.15 179.60 3ic9 h GLN 89 N 0.58 0.59 -0.33 2.37 4.20 -1.63 -1.11 115.11 119.78 3ic9 h GLN 89 Ca 0.24 -0.28 -0.12 0.00 0.06 0.00 0.00 58.65 58.55 3ic9 h GLN 89 Cb 0.12 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 3ic9 h GLN 89 CO -0.15 0.86 -0.27 1.79 -0.67 0.00 0.00 178.83 180.39 3ic9 h THR 90 N 0.32 1.29 -0.46 -0.54 1.35 -0.53 -0.00 112.91 114.34 3ic9 h THR 90 Ca 0.05 -1.42 -0.05 0.00 -0.55 0.00 0.00 66.41 64.45 3ic9 h THR 90 Cb 0.71 1.47 -0.02 0.00 -1.73 0.00 0.00 68.15 68.58 3ic9 h THR 90 CO 0.05 0.46 0.11 -0.33 -0.25 0.00 0.00 175.52 175.56 3ic9 h GLU 91 N 0.53 0.74 -0.35 4.72 4.39 -1.32 -1.06 114.58 122.23 3ic9 h GLU 91 Ca 0.06 -0.18 -0.11 0.00 0.34 0.00 0.00 59.36 59.47 3ic9 h GLU 91 Cb 0.83 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.37 3ic9 h GLU 91 CO 0.07 0.73 -0.22 0.07 -1.16 0.00 0.00 179.01 178.50 3ic9 h ARG 92 N 0.61 0.68 -0.86 2.33 -0.00 -1.11 -2.09 114.38 113.94 3ic9 h ARG 92 Ca 0.14 -0.27 0.08 0.00 -0.00 0.00 0.00 59.98 59.94 3ic9 h ARG 92 Cb 0.33 -0.04 -0.06 0.00 -0.00 0.00 0.00 29.97 30.21 3ic9 h ARG 92 CO 0.00 0.85 0.56 -0.44 -0.00 0.00 0.00 179.97 180.94 3ic9 h ASP 93 N 0.60 0.80 -0.09 0.08 3.45 -0.70 0.42 116.42 120.98 3ic9 h ASP 93 Ca 0.09 0.01 0.02 0.00 0.43 0.00 0.00 57.03 57.58 3ic9 h ASP 93 Cb 0.70 -0.15 -0.02 0.00 -0.56 0.00 0.00 39.33 39.30 3ic9 h ASP 93 CO 0.05 0.49 -0.02 -0.09 -1.57 0.00 0.00 179.24 178.10 3ic9 h ARG 94 N 0.90 -0.00 -0.33 3.56 2.43 -0.66 -0.55 114.38 119.73 3ic9 h ARG 94 Ca 0.39 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.54 3ic9 h ARG 94 Cb 0.32 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.86 3ic9 h ARG 94 CO -0.15 -0.00 0.13 0.74 -1.51 0.00 0.00 179.97 179.17 3ic9 h PHE 95 N -0.00 0.50 -0.62 2.20 0.04 -0.64 -2.58 116.94 115.84 3ic9 h PHE 95 Ca 0.05 -0.04 0.11 0.00 2.80 0.00 0.00 57.97 60.89 3ic9 h PHE 95 Cb 0.07 -0.15 -0.08 0.00 2.20 0.00 0.00 35.95 37.99 3ic9 h PHE 95 CO -0.15 0.48 0.16 0.28 -0.60 0.00 0.00 178.31 178.49 3ic9 h VAL 96 N 0.38 0.67 -0.98 -0.55 2.07 -0.92 -2.68 116.25 114.23 3ic9 h VAL 96 Ca 0.11 -0.10 0.13 0.00 0.82 0.00 0.00 66.70 67.65 3ic9 h VAL 96 Cb 0.19 0.33 -0.09 0.00 -1.52 0.00 0.00 31.29 30.21 3ic9 h VAL 96 CO -0.01 0.06 0.61 1.23 0.02 0.00 0.00 177.57 179.47 3ic9 h GLY 97 N 0.30 1.62 0.92 2.17 0.00 -0.69 0.26 103.07 107.65 3ic9 h GLY 97 Ca 0.32 -0.40 -0.02 0.00 0.00 0.00 0.00 47.33 47.24 3ic9 h GLY 97 CO -0.38 0.12 0.12 0.74 0.00 0.00 0.00 176.54 177.14 3ic9 h PHE 98 N 0.93 0.45 -0.34 5.60 0.05 -1.30 0.18 116.94 122.51 3ic9 h PHE 98 Ca 0.50 -0.03 -0.00 0.00 3.82 0.00 0.00 57.97 62.25 3ic9 h PHE 98 Cb 0.53 -0.14 -0.02 0.00 2.00 0.00 0.00 35.95 38.33 3ic9 h PHE 98 CO -0.01 0.44 0.20 0.28 -0.18 0.00 0.00 178.31 179.04 3ic9 h VAL 99 N 0.33 1.12 -0.45 -0.55 2.07 -1.14 -2.53 116.25 115.10 3ic9 h VAL 99 Ca 0.10 -0.28 0.03 0.00 0.82 0.00 0.00 66.70 67.36 3ic9 h VAL 99 Cb 0.18 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 3ic9 h VAL 99 CO -0.01 0.12 0.25 0.58 0.02 0.00 0.00 177.57 178.54 3ic9 h VAL 100 N 0.43 1.02 -0.70 2.57 2.07 -0.18 -1.62 116.25 119.85 3ic9 h VAL 100 Ca 0.12 -0.18 0.15 0.00 0.82 0.00 0.00 66.70 67.61 3ic9 h VAL 100 Cb 0.02 0.46 -0.11 0.00 -1.52 0.00 0.00 31.29 30.14 3ic9 h VAL 100 CO -0.02 0.09 0.13 -0.33 0.02 0.00 0.00 177.57 177.46 3ic9 h GLU 101 N 0.51 0.22 -0.06 1.57 5.08 -0.46 0.12 114.58 121.56 3ic9 h GLU 101 Ca 0.19 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 3ic9 h GLU 101 Cb 0.04 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 3ic9 h GLU 101 CO -0.10 0.15 0.04 0.77 -1.00 0.00 0.00 179.01 178.87 3ic9 h SER 102 N 0.23 0.07 -0.91 1.42 0.02 -0.91 -1.40 113.55 112.08 3ic9 h SER 102 Ca 0.38 -0.01 0.05 0.00 -0.84 0.00 0.00 61.79 61.37 3ic9 h SER 102 Cb 0.64 -0.02 -0.06 0.00 0.14 0.00 0.00 62.40 63.11 3ic9 h SER 102 CO -0.51 0.06 0.58 0.58 -1.14 0.00 0.00 176.83 176.41 3ic9 h VAL 103 N 0.08 1.11 -0.47 2.27 2.07 -0.49 -1.82 116.25 119.00 3ic9 h VAL 103 Ca 0.02 -0.38 -0.04 0.00 0.82 0.00 0.00 66.70 67.13 3ic9 h VAL 103 Cb 0.00 -0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 29.66 3ic9 h VAL 103 CO -0.00 0.20 0.15 -0.33 0.02 0.00 0.00 177.57 177.60 3ic9 h GLU 104 N 1.10 0.70 0.00 1.57 5.08 -0.31 -1.91 114.58 120.81 3ic9 h GLU 104 Ca 0.37 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.59 3ic9 h GLU 104 Cb 0.07 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.20 3ic9 h GLU 104 CO -0.14 0.61 -0.13 0.66 -1.00 0.00 0.00 179.01 179.01 3ic9 h SER 105 N 0.68 0.00 -3.92 1.42 4.64 -0.39 -3.45 113.55 112.54 3ic9 h SER 105 Ca 0.16 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.95 3ic9 h SER 105 Cb 0.20 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 62.38 3ic9 h SER 105 CO -0.01 0.13 0.67 -0.36 -0.87 0.00 0.00 176.83 176.39 3ic9 s PHE 106 N -4.06 2.83 -0.10 4.77 0.08 -0.72 -4.91 117.98 115.87 3ic9 s PHE 106 Ca -0.02 1.34 -0.40 0.00 0.12 0.00 0.00 56.93 57.97 3ic9 s PHE 106 Cb 0.12 -3.78 -0.18 0.00 -0.57 0.00 0.00 43.02 38.61 3ic9 s PHE 106 CO 0.58 -2.28 1.35 -0.25 -0.10 0.00 0.00 175.22 174.53 3ic9 n ASP 107 N 0.46 1.11 -0.26 1.36 10.43 -1.26 -4.86 116.55 123.52 3ic9 n ASP 107 Ca 0.02 1.14 0.06 0.00 2.57 0.00 0.00 54.79 58.58 3ic9 n ASP 107 Cb 0.42 -1.04 0.20 0.00 1.84 0.00 0.00 41.12 42.54 3ic9 n ASP 107 CO 0.00 0.00 0.00 -0.33 -1.07 0.00 0.00 177.20 175.80 3ic9 h GLU 108 N 4.50 0.32 0.00 -1.24 3.07 -1.91 0.08 114.58 119.41 3ic9 h GLU 108 Ca -0.48 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.36 3ic9 h GLU 108 Cb 1.37 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 29.21 3ic9 h GLU 108 CO 0.79 0.21 0.00 0.00 -1.40 0.00 0.00 179.01 178.62 3ic9 n GLN 109 N -5.10 0.04 -0.14 2.33 10.64 -1.26 -2.19 117.38 121.69 3ic9 n GLN 109 Ca 0.15 0.33 0.08 0.00 -1.83 0.00 0.00 57.00 55.73 3ic9 n GLN 109 Cb 0.47 -1.58 0.26 0.00 -0.86 0.00 0.00 30.24 28.53 3ic9 n GLN 109 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 3ic9 n ASP 110 N -1.64 1.88 -3.89 2.61 8.00 0.02 -4.87 116.55 118.65 3ic9 n ASP 110 Ca 0.03 -1.87 -0.23 0.00 0.71 0.00 0.00 54.79 53.42 3ic9 n ASP 110 Cb 0.15 -0.19 -0.17 0.00 -0.02 0.00 0.00 41.12 40.89 3ic9 n ASP 110 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3ic9 s LYS 111 N -1.62 1.09 -0.07 -1.24 1.02 -0.93 0.06 119.74 118.04 3ic9 s LYS 111 Ca 0.28 -0.15 0.04 0.00 0.02 0.00 0.00 55.97 56.17 3ic9 s LYS 111 Cb 0.15 -1.13 -0.00 0.00 -0.52 0.00 0.00 37.83 36.33 3ic9 s LYS 111 CO 0.21 -0.15 -0.21 0.42 -0.92 0.00 0.00 175.35 174.70 3ic9 s ILE 112 N 1.27 1.80 -0.14 2.17 1.01 -0.16 -4.97 121.20 122.18 3ic9 s ILE 112 Ca -0.05 -0.89 -0.22 0.00 0.00 0.00 0.00 60.65 59.49 3ic9 s ILE 112 Cb -0.14 -1.56 -0.03 0.00 0.01 0.00 0.00 42.46 40.75 3ic9 s ILE 112 CO -0.02 0.50 0.67 -0.13 0.00 0.00 0.00 174.94 175.96 3ic9 s ARG 113 N 0.23 4.31 0.00 2.79 1.81 -1.26 -1.97 118.95 124.86 3ic9 s ARG 113 Ca -0.12 0.74 0.00 0.00 -1.72 0.00 0.00 55.73 54.63 3ic9 s ARG 113 Cb -0.16 -3.52 0.00 0.00 -0.45 0.00 0.00 34.95 30.82 3ic9 s ARG 113 CO 0.06 -0.12 0.00 0.41 -0.68 0.00 0.00 175.30 174.97 3ic9 n GLY 114 N 3.47 2.43 3.73 -3.53 0.00 -0.24 -4.90 105.19 106.16 3ic9 n GLY 114 Ca -0.01 -1.81 -0.37 0.00 0.00 0.00 0.00 46.02 43.83 3ic9 n GLY 114 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ic9 s PHE 115 N -1.64 3.50 0.14 1.61 0.40 -1.26 -2.06 117.98 118.68 3ic9 s PHE 115 Ca 0.00 0.75 -0.09 0.00 -0.60 0.00 0.00 56.93 56.99 3ic9 s PHE 115 Cb 0.00 -2.42 -0.06 0.00 0.51 0.00 0.00 43.02 41.05 3ic9 s PHE 115 CO 0.00 0.24 0.45 0.00 0.70 0.00 0.00 175.22 176.61 3ic9 s ALA 116 N 0.40 3.68 0.05 5.36 0.00 -1.26 -0.71 121.76 129.29 3ic9 s ALA 116 Ca 0.21 -0.36 0.01 0.00 0.00 0.00 0.00 51.96 51.81 3ic9 s ALA 116 Cb -0.14 -2.31 -0.03 0.00 0.00 0.00 0.00 23.12 20.63 3ic9 s ALA 116 CO 0.07 0.56 -0.05 -1.59 0.00 0.00 0.00 175.76 174.75 3ic9 s LYS 117 N -2.31 0.58 -0.07 0.00 -2.85 -0.60 -4.77 119.74 109.72 3ic9 s LYS 117 Ca 0.39 -1.01 -0.30 0.00 -1.00 0.00 0.00 55.97 54.05 3ic9 s LYS 117 Cb -0.13 -0.02 -0.03 0.00 -2.06 0.00 0.00 37.83 35.59 3ic9 s LYS 117 CO 0.20 -0.04 1.22 -0.06 0.10 0.00 0.00 175.35 176.77 3ic9 s PHE 118 N -2.74 3.12 -0.06 1.78 0.08 0.19 -0.77 117.98 119.59 3ic9 s PHE 118 Ca -0.01 1.17 0.01 0.00 0.12 0.00 0.00 56.93 58.22 3ic9 s PHE 118 Cb -0.01 -3.44 -0.26 0.00 -0.57 0.00 0.00 43.02 38.75 3ic9 s PHE 118 CO -0.04 -1.41 0.61 -0.07 -0.10 0.00 0.00 175.22 174.21 3ic9 h LEU 119 N 8.45 0.27 0.00 -0.37 3.38 -1.49 -3.43 115.31 122.13 3ic9 h LEU 119 Ca -0.33 -0.52 -0.00 0.00 0.09 0.00 0.00 57.88 57.12 3ic9 h LEU 119 Cb 1.15 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.81 3ic9 h LEU 119 CO 0.90 1.46 0.02 -0.90 0.09 0.00 0.00 178.44 180.00 3ic9 n ASP 120 N -3.33 -0.15 0.00 -0.43 3.85 -1.17 -4.84 116.55 110.48 3ic9 n ASP 120 Ca -0.22 -1.11 0.10 0.00 -0.71 0.00 0.00 54.79 52.85 3ic9 n ASP 120 Cb 1.05 0.25 0.47 0.00 -1.35 0.00 0.00 41.12 41.54 3ic9 n ASP 120 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 3ic9 n GLU 121 N -0.04 0.19 0.00 0.11 1.02 -1.26 -2.79 120.64 117.88 3ic9 n GLU 121 Ca -0.01 0.12 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 3ic9 n GLU 121 Cb 0.04 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 29.96 3ic9 n GLU 121 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3ic9 n HIS 122 N -1.36 0.00 -4.72 -0.32 8.25 -1.26 -4.94 115.22 110.87 3ic9 n HIS 122 Ca 0.08 -0.02 -0.28 0.00 -0.26 0.00 0.00 57.72 57.24 3ic9 n HIS 122 Cb 0.18 -0.00 -0.17 0.00 1.12 0.00 0.00 29.99 31.12 3ic9 n HIS 122 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3ic9 s THR 123 N -0.05 1.50 0.08 1.59 2.01 -1.12 0.13 115.64 119.78 3ic9 s THR 123 Ca 0.00 -0.68 0.07 0.00 0.31 0.00 0.00 61.69 61.40 3ic9 s THR 123 Cb 0.00 -1.34 -0.04 0.00 0.01 0.00 0.00 72.50 71.13 3ic9 s THR 123 CO 0.00 0.44 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.47 3ic9 s LEU 124 N 0.67 2.87 -0.11 4.42 1.02 -0.47 -1.34 118.68 125.73 3ic9 s LEU 124 Ca -0.13 -0.41 0.02 0.00 0.02 0.00 0.00 54.13 53.62 3ic9 s LEU 124 Cb -0.16 -1.68 -0.01 0.00 0.02 0.00 0.00 46.19 44.36 3ic9 s LEU 124 CO 0.04 0.21 -0.20 -1.58 0.02 0.00 0.00 176.35 174.84 3ic9 s GLN 125 N -1.93 3.18 -0.32 1.70 0.74 0.05 -0.77 119.66 122.31 3ic9 s GLN 125 Ca 0.18 -0.80 -0.12 0.00 0.05 0.00 0.00 55.36 54.67 3ic9 s GLN 125 Cb -0.11 -2.43 -0.03 0.00 1.10 0.00 0.00 33.01 31.54 3ic9 s GLN 125 CO 0.10 0.20 0.22 0.08 -0.55 0.00 0.00 175.29 175.34 3ic9 s VAL 126 N 0.33 5.25 0.00 1.34 1.01 0.56 -1.55 120.40 127.34 3ic9 s VAL 126 Ca -0.16 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 61.71 3ic9 s VAL 126 Cb -0.17 -3.64 0.00 0.00 0.00 0.00 0.00 36.38 32.57 3ic9 s VAL 126 CO 0.08 0.07 0.00 0.47 0.00 0.00 0.00 175.10 175.72 3ic9 n ASP 127 N 5.09 0.00 -0.10 3.32 10.43 0.11 -1.99 116.55 133.41 3ic9 n ASP 127 Ca -0.13 0.00 0.01 0.00 2.57 0.00 0.00 54.79 57.24 3ic9 n ASP 127 Cb 0.50 0.00 0.02 0.00 1.84 0.00 0.00 41.12 43.48 3ic9 n ASP 127 CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 3ic9 n ASP 128 N 1.98 1.64 -0.08 -2.24 3.85 -1.26 -4.80 116.55 115.63 3ic9 n ASP 128 Ca 0.00 -1.52 -0.09 0.00 -0.71 0.00 0.00 54.79 52.47 3ic9 n ASP 128 Cb 0.00 -0.02 -0.13 0.00 -1.35 0.00 0.00 41.12 39.62 3ic9 n ASP 128 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3ic9 n HIS 129 N -0.09 0.00 -4.14 2.11 1.44 -0.84 -4.97 115.22 108.73 3ic9 n HIS 129 Ca 0.02 0.00 -0.15 0.00 -2.01 0.00 0.00 57.72 55.57 3ic9 n HIS 129 Cb 0.16 -0.81 -0.12 0.00 0.12 0.00 0.00 29.99 29.33 3ic9 n HIS 129 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 3ic9 s SER 130 N -5.13 0.99 -0.04 4.39 0.01 -1.14 -2.53 113.70 110.25 3ic9 s SER 130 Ca -0.10 -0.43 0.06 0.00 1.31 0.00 0.00 55.95 56.78 3ic9 s SER 130 Cb 0.05 -0.02 -0.01 0.00 0.21 0.00 0.00 66.02 66.26 3ic9 s SER 130 CO 0.65 -0.10 -0.21 -1.10 0.41 0.00 0.00 173.24 172.90 3ic9 s GLN 131 N -1.18 2.03 -0.19 12.44 -0.21 -0.01 -0.32 119.66 132.21 3ic9 s GLN 131 Ca -0.05 -0.75 -0.02 0.00 0.02 0.00 0.00 55.36 54.56 3ic9 s GLN 131 Cb -0.08 -1.79 -0.00 0.00 1.00 0.00 0.00 33.01 32.14 3ic9 s GLN 131 CO 0.01 0.35 -0.10 0.08 -2.12 0.00 0.00 175.29 173.51 3ic9 s VAL 132 N -0.18 2.99 -0.46 1.09 1.01 0.05 -0.90 120.40 124.01 3ic9 s VAL 132 Ca -0.00 -0.63 -0.20 0.00 0.00 0.00 0.00 61.98 61.14 3ic9 s VAL 132 Cb -0.11 -2.32 0.03 0.00 0.00 0.00 0.00 36.38 33.98 3ic9 s VAL 132 CO 0.02 0.47 0.62 -0.63 0.00 0.00 0.00 175.10 175.58 3ic9 s ILE 133 N 1.23 4.85 -0.14 2.22 -1.09 0.24 -1.36 121.20 127.15 3ic9 s ILE 133 Ca 0.03 -0.11 0.02 0.00 -2.23 0.00 0.00 60.65 58.35 3ic9 s ILE 133 Cb -0.14 -4.23 0.01 0.00 -1.58 0.00 0.00 42.46 36.52 3ic9 s ILE 133 CO -0.04 -0.66 -0.20 0.00 -1.23 0.00 0.00 174.94 172.81 3ic9 s ALA 134 N 2.73 2.15 0.22 9.38 0.00 0.12 -1.43 121.76 134.93 3ic9 s ALA 134 Ca 0.19 -1.04 -0.06 0.00 0.00 0.00 0.00 51.96 51.06 3ic9 s ALA 134 Cb -0.16 -0.98 0.19 0.00 0.00 0.00 0.00 23.12 22.17 3ic9 s ALA 134 CO 0.16 -0.07 1.71 0.87 0.00 0.00 0.00 175.76 178.43 3ic9 h LYS 135 N 7.41 0.98 -5.07 0.00 1.57 -1.48 -3.42 116.57 116.57 3ic9 h LYS 135 Ca -0.33 -0.27 -0.39 0.00 -1.87 0.00 0.00 60.65 57.78 3ic9 h LYS 135 Cb 1.18 -0.11 -0.24 0.00 0.08 0.00 0.00 32.23 33.14 3ic9 h LYS 135 CO 0.55 0.93 -0.78 1.03 -0.57 0.00 0.00 179.45 180.62 3ic9 s ARG 136 N -5.09 0.79 -0.05 3.15 3.00 0.57 -4.89 118.95 116.44 3ic9 s ARG 136 Ca -0.11 -0.72 0.01 0.00 0.00 0.00 0.00 55.73 54.91 3ic9 s ARG 136 Cb 0.14 -0.75 0.02 0.00 0.00 0.00 0.00 34.95 34.37 3ic9 s ARG 136 CO 0.84 0.18 -0.05 0.42 0.00 0.00 0.00 175.30 176.68 3ic9 s ILE 137 N -0.92 0.60 -0.23 1.52 1.01 -0.23 -1.23 121.20 121.71 3ic9 s ILE 137 Ca -0.01 -0.15 -0.06 0.00 0.00 0.00 0.00 60.65 60.43 3ic9 s ILE 137 Cb -0.08 -0.62 -0.02 0.00 0.01 0.00 0.00 42.46 41.75 3ic9 s ILE 137 CO 0.01 0.24 0.03 -0.69 0.00 0.00 0.00 174.94 174.53 3ic9 s VAL 138 N 0.95 4.00 -0.45 2.92 1.01 -0.06 -0.31 120.40 128.46 3ic9 s VAL 138 Ca -0.10 -0.28 -0.24 0.00 0.00 0.00 0.00 61.98 61.36 3ic9 s VAL 138 Cb -0.14 -2.85 0.03 0.00 0.00 0.00 0.00 36.38 33.41 3ic9 s VAL 138 CO 0.00 0.37 0.82 -0.63 0.00 0.00 0.00 175.10 175.66 3ic9 s ILE 139 N 1.49 4.61 -0.37 2.22 1.01 0.52 -0.93 121.20 129.75 3ic9 s ILE 139 Ca 0.06 0.52 0.13 0.00 0.00 0.00 0.00 60.65 61.35 3ic9 s ILE 139 Cb -0.15 -4.34 0.44 0.00 0.01 0.00 0.00 42.46 38.42 3ic9 s ILE 139 CO 0.01 -0.73 1.02 0.00 0.00 0.00 0.00 174.94 175.24 3ic9 n ALA 140 N 6.81 4.09 1.13 9.38 0.00 0.45 -0.67 120.51 141.70 3ic9 n ALA 140 Ca 0.03 -3.62 0.10 0.00 0.00 0.00 0.00 53.44 49.95 3ic9 n ALA 140 Cb 0.48 -0.78 0.33 0.00 0.00 0.00 0.00 19.45 19.48 3ic9 n ALA 140 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3ic9 n THR 141 N -0.23 0.27 -4.70 0.00 -2.24 -1.14 -4.31 114.28 101.92 3ic9 n THR 141 Ca 0.21 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 3ic9 n THR 141 Cb 0.76 0.35 0.00 0.00 -2.10 0.00 0.00 70.33 69.34 3ic9 n THR 141 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ic9 n GLY 142 N 1.12 -0.02 3.33 3.38 0.00 -1.26 -4.57 105.19 107.18 3ic9 n GLY 142 Ca 0.15 -1.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.01 3ic9 n GLY 142 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ic9 s SER 143 N -4.00 2.00 0.17 1.61 1.04 -1.26 -1.14 113.70 112.12 3ic9 s SER 143 Ca 0.00 -1.16 0.03 0.00 0.48 0.00 0.00 55.95 55.30 3ic9 s SER 143 Cb 0.00 -0.03 -0.05 0.00 0.10 0.00 0.00 66.02 66.05 3ic9 s SER 143 CO 0.00 -0.43 -0.04 0.00 0.98 0.00 0.00 173.24 173.75 3ic9 s ARG 144 N -3.81 1.13 0.45 4.02 1.70 -0.05 -4.90 118.95 117.50 3ic9 s ARG 144 Ca 0.26 -1.52 -0.25 0.00 -0.47 0.00 0.00 55.73 53.75 3ic9 s ARG 144 Cb 0.04 -0.48 -0.08 0.00 -0.57 0.00 0.00 34.95 33.87 3ic9 s ARG 144 CO 0.07 -0.04 1.35 -2.14 -1.08 0.00 0.00 175.30 173.47 3ic9 s PRO 145 N -3.83 3.71 0.01 3.89 0.02 -1.26 -0.88 135.00 136.65 3ic9 s PRO 145 Ca 0.21 2.24 0.01 0.00 0.02 0.00 0.00 61.00 63.48 3ic9 s PRO 145 Cb 0.05 -2.61 -0.01 0.00 0.02 0.00 0.00 34.50 31.94 3ic9 s PRO 145 CO 0.03 -0.74 -0.03 1.21 -0.33 0.00 0.00 177.00 177.14 3ic9 s ASN 146 N -0.73 0.33 0.01 2.53 2.47 -1.24 -4.69 114.94 113.62 3ic9 s ASN 146 Ca 0.61 -0.30 -0.26 0.00 0.42 0.00 0.00 52.86 53.34 3ic9 s ASN 146 Cb -0.40 0.03 0.06 0.00 -1.45 0.00 0.00 41.25 39.49 3ic9 s ASN 146 CO 0.51 -0.14 0.59 -0.72 -3.72 0.00 0.00 177.10 173.61 3ic9 s TYR 147 N -0.81 -0.53 0.85 0.43 -0.85 -1.26 -4.10 117.35 111.08 3ic9 s TYR 147 Ca -0.08 0.75 -0.11 0.00 -0.52 0.00 0.00 57.07 57.11 3ic9 s TYR 147 Cb -0.06 0.38 0.10 0.00 0.38 0.00 0.00 41.96 42.76 3ic9 s TYR 147 CO -0.00 -0.63 1.10 -1.25 -1.52 0.00 0.00 175.55 173.25 3ic9 s PRO 148 N -1.90 1.62 0.34 -3.49 0.04 -1.26 -4.92 135.00 125.43 3ic9 s PRO 148 Ca -0.08 1.11 0.03 0.00 0.04 0.00 0.00 61.00 62.10 3ic9 s PRO 148 Cb -0.01 -1.83 0.63 0.00 0.04 0.00 0.00 34.50 33.34 3ic9 s PRO 148 CO 0.03 -2.07 1.97 1.49 0.04 0.00 0.00 177.00 178.46 3ic9 h GLU 149 N -1.44 0.85 -0.51 4.56 4.57 -2.02 -2.42 114.58 118.18 3ic9 h GLU 149 Ca -0.46 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 57.67 3ic9 h GLU 149 Cb 1.26 -0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 29.63 3ic9 h GLU 149 CO 0.51 0.57 0.30 0.27 -1.18 0.00 0.00 179.01 179.47 3ic9 h PHE 150 N 0.88 0.66 -0.34 0.92 -5.15 -1.96 -1.44 116.94 110.51 3ic9 h PHE 150 Ca 0.30 0.00 -0.04 0.00 -0.20 0.00 0.00 57.97 58.04 3ic9 h PHE 150 Cb 0.08 -0.22 -0.02 0.00 0.22 0.00 0.00 35.95 36.02 3ic9 h PHE 150 CO -0.00 0.45 0.06 1.25 -2.00 0.00 0.00 178.31 178.07 3ic9 h LEU 151 N 0.70 0.46 -2.61 2.10 5.85 -1.72 -2.29 115.31 117.79 3ic9 h LEU 151 Ca 0.18 -0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 3ic9 h LEU 151 Cb -0.02 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 40.89 3ic9 h LEU 151 CO -0.03 0.49 -0.00 0.00 -0.34 0.00 0.00 178.44 178.55 3ic9 h ALA 152 N 1.58 1.35 0.00 1.25 0.00 -1.33 0.01 119.26 122.11 3ic9 h ALA 152 Ca 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3ic9 h ALA 152 Cb 0.23 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3ic9 h ALA 152 CO -0.00 0.01 0.00 0.00 0.00 0.00 0.00 179.25 179.26 3ic9 n ALA 153 N -2.24 1.51 0.88 0.00 0.00 -0.86 -1.83 120.51 117.97 3ic9 n ALA 153 Ca -0.03 -0.04 0.12 0.00 0.00 0.00 0.00 53.44 53.50 3ic9 n ALA 153 Cb 0.09 -1.13 0.55 0.00 0.00 0.00 0.00 19.45 18.95 3ic9 n ALA 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ic9 n ALA 154 N -1.34 2.18 -0.57 0.00 0.00 -0.01 -0.07 120.51 120.70 3ic9 n ALA 154 Ca 0.03 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3ic9 n ALA 154 Cb 0.07 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.10 3ic9 n ALA 154 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ic9 n GLY 155 N 1.16 3.18 0.00 0.00 0.00 -0.76 -0.75 105.19 108.02 3ic9 n GLY 155 Ca 0.06 -0.03 0.07 0.00 0.00 0.00 0.00 46.02 46.12 3ic9 n GLY 155 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ic9 n SER 156 N 3.45 0.00 -0.96 1.61 3.41 -1.26 -1.82 113.62 118.05 3ic9 n SER 156 Ca 0.00 -0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.68 3ic9 n SER 156 Cb 0.00 -0.23 0.23 0.00 -0.26 0.00 0.00 64.21 63.95 3ic9 n SER 156 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3ic9 n ARG 157 N -1.23 3.00 -2.89 4.33 1.74 0.07 -4.93 116.66 116.75 3ic9 n ARG 157 Ca 0.07 -2.41 -0.41 0.00 -0.77 0.00 0.00 57.85 54.33 3ic9 n ARG 157 Cb 0.10 -1.51 -0.04 0.00 -1.02 0.00 0.00 32.46 29.99 3ic9 n ARG 157 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3ic9 s LEU 158 N -1.40 4.23 -0.01 0.55 2.96 -0.76 -2.04 118.68 122.22 3ic9 s LEU 158 Ca 0.35 1.25 0.02 0.00 -0.22 0.00 0.00 54.13 55.53 3ic9 s LEU 158 Cb 0.21 -3.26 -0.03 0.00 0.50 0.00 0.00 46.19 43.60 3ic9 s LEU 158 CO 0.19 -0.33 -0.02 -0.76 -1.32 0.00 0.00 176.35 174.12 3ic9 s LEU 159 N 1.74 3.43 0.39 -0.68 1.02 0.18 -4.96 118.68 119.80 3ic9 s LEU 159 Ca 0.40 -0.03 0.04 0.00 0.02 0.00 0.00 54.13 54.57 3ic9 s LEU 159 Cb -0.17 -1.95 -0.03 0.00 0.02 0.00 0.00 46.19 44.06 3ic9 s LEU 159 CO 0.16 0.29 0.15 0.42 0.02 0.00 0.00 176.35 177.39 3ic9 s THR 160 N -1.04 0.48 0.64 5.49 -4.23 -1.26 -1.38 115.64 114.33 3ic9 s THR 160 Ca 0.18 -2.00 0.30 0.00 -1.18 0.00 0.00 61.69 58.99 3ic9 s THR 160 Cb -0.11 -2.39 0.33 0.00 1.34 0.00 0.00 72.50 71.67 3ic9 s THR 160 CO 0.09 0.00 1.95 -0.55 -0.54 0.00 0.00 174.62 175.57 3ic9 h ASN 161 N 1.88 0.00 0.98 3.99 -1.07 -1.88 -0.44 115.58 119.05 3ic9 h ASN 161 Ca -0.34 0.00 -0.03 0.00 0.07 0.00 0.00 56.30 56.00 3ic9 h ASN 161 Cb 1.26 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 37.51 3ic9 h ASN 161 CO 0.53 0.00 -0.15 0.44 0.07 0.00 0.00 177.43 178.32 3ic9 h ASP 162 N 0.00 0.00 0.00 6.14 3.32 -1.95 -3.35 116.42 120.58 3ic9 h ASP 162 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3ic9 h ASP 162 Cb 0.76 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.31 3ic9 h ASP 162 CO -0.00 0.15 0.00 -0.46 -1.72 0.00 0.00 179.24 177.21 3ic9 n ASN 163 N -3.30 0.07 -0.28 6.45 6.94 -0.84 -4.84 115.26 119.46 3ic9 n ASN 163 Ca 0.00 -0.34 -0.04 0.00 -0.02 0.00 0.00 54.58 54.19 3ic9 n ASN 163 Cb 0.39 0.35 0.08 0.00 -2.36 0.00 0.00 39.78 38.24 3ic9 n ASN 163 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 3ic9 h LEU 164 N 0.00 0.86 0.00 -4.53 5.85 -1.23 -2.32 115.31 113.94 3ic9 h LEU 164 Ca 0.00 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.70 3ic9 h LEU 164 Cb 0.05 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 40.87 3ic9 h LEU 164 CO 0.00 0.61 0.00 0.49 -0.34 0.00 0.00 178.44 179.20 3ic9 n PHE 165 N -4.57 0.00 1.00 1.25 3.72 -1.26 -2.81 117.46 114.79 3ic9 n PHE 165 Ca 0.08 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.58 3ic9 n PHE 165 Cb 0.04 -0.11 -0.03 0.00 -0.94 0.00 0.00 39.48 38.44 3ic9 n PHE 165 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3ic9 n GLU 166 N -1.11 0.05 -1.60 -1.08 -0.58 -0.87 -4.76 120.64 110.69 3ic9 n GLU 166 Ca 0.20 -0.04 -0.46 0.00 -0.42 0.00 0.00 57.16 56.44 3ic9 n GLU 166 Cb 0.16 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.50 3ic9 n GLU 166 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3ic9 n LEU 167 N -1.44 1.87 0.17 -4.62 4.77 -1.12 -4.90 117.00 111.73 3ic9 n LEU 167 Ca 0.05 1.16 0.13 0.00 -0.03 0.00 0.00 56.01 57.31 3ic9 n LEU 167 Cb 0.34 -1.28 0.31 0.00 -2.33 0.00 0.00 43.42 40.46 3ic9 n LEU 167 CO 0.40 -1.23 0.86 -0.55 -1.33 0.00 0.00 177.39 175.54 3ic9 h ASN 168 N 2.91 0.00 -5.14 -1.43 -1.07 -1.92 -3.46 115.58 105.46 3ic9 h ASN 168 Ca -0.42 0.00 -0.07 0.00 0.07 0.00 0.00 56.30 55.88 3ic9 h ASN 168 Cb 1.33 0.00 -0.13 0.00 -2.07 0.00 0.00 38.32 37.45 3ic9 h ASN 168 CO 0.67 0.00 -0.26 -0.62 0.07 0.00 0.00 177.43 177.29 3ic9 s ASP 169 N -5.40 -0.01 0.21 6.14 -1.08 -1.26 -4.25 116.67 111.02 3ic9 s ASP 169 Ca 0.08 -0.57 -0.30 0.00 -0.52 0.00 0.00 52.55 51.25 3ic9 s ASP 169 Cb 0.08 0.40 -0.09 0.00 -1.46 0.00 0.00 42.92 41.86 3ic9 s ASP 169 CO 0.62 -0.80 1.22 -0.76 0.52 0.00 0.00 175.17 175.98 3ic9 s LEU 170 N -2.86 4.45 0.74 -1.34 1.43 -1.25 -4.95 118.68 114.90 3ic9 s LEU 170 Ca 0.06 2.32 -0.12 0.00 -1.03 0.00 0.00 54.13 55.36 3ic9 s LEU 170 Cb 0.04 -3.61 0.04 0.00 0.03 0.00 0.00 46.19 42.68 3ic9 s LEU 170 CO -0.10 -0.40 1.11 -2.16 0.23 0.00 0.00 176.35 175.03 3ic9 s PRO 171 N -0.48 2.35 0.18 1.29 0.04 -1.26 -4.96 135.00 132.16 3ic9 s PRO 171 Ca 0.52 1.29 -0.06 0.00 0.04 0.00 0.00 61.00 62.80 3ic9 s PRO 171 Cb -0.34 -1.90 0.08 0.00 0.04 0.00 0.00 34.50 32.38 3ic9 s PRO 171 CO 0.39 -1.59 1.51 0.87 0.04 0.00 0.00 177.00 178.23 3ic9 h LYS 172 N -0.76 0.70 -2.35 4.56 1.79 -1.94 -3.42 116.57 115.15 3ic9 h LYS 172 Ca -0.45 -0.39 -0.08 0.00 -2.18 0.00 0.00 60.65 57.55 3ic9 h LYS 172 Cb 1.24 0.03 -0.20 0.00 -1.58 0.00 0.00 32.23 31.71 3ic9 h LYS 172 CO 0.51 1.01 0.01 -1.54 -1.08 0.00 0.00 179.45 178.37 3ic9 s SER 173 N -6.88 -0.53 -0.08 0.86 1.04 -1.26 -0.58 113.70 106.26 3ic9 s SER 173 Ca -0.09 0.73 -0.04 0.00 0.48 0.00 0.00 55.95 57.03 3ic9 s SER 173 Cb 0.11 0.71 0.04 0.00 0.10 0.00 0.00 66.02 66.98 3ic9 s SER 173 CO 0.85 -0.44 0.19 -0.69 0.98 0.00 0.00 173.24 174.13 3ic9 s VAL 174 N -0.73 -0.08 -0.17 5.02 1.01 0.23 -2.19 120.40 123.50 3ic9 s VAL 174 Ca -0.08 0.19 -0.13 0.00 0.00 0.00 0.00 61.98 61.95 3ic9 s VAL 174 Cb -0.03 -0.31 -0.05 0.00 0.00 0.00 0.00 36.38 36.00 3ic9 s VAL 174 CO 0.06 0.08 0.28 0.00 0.00 0.00 0.00 175.10 175.51 3ic9 s ALA 175 N 1.36 3.60 -0.09 5.51 0.00 -1.02 -2.88 121.76 128.23 3ic9 s ALA 175 Ca -0.08 -0.50 -0.04 0.00 0.00 0.00 0.00 51.96 51.34 3ic9 s ALA 175 Cb -0.11 -2.38 -0.04 0.00 0.00 0.00 0.00 23.12 20.59 3ic9 s ALA 175 CO -0.07 0.07 0.09 0.08 0.00 0.00 0.00 175.76 175.92 3ic9 s VAL 176 N 0.53 5.02 -0.04 0.00 1.01 -0.31 -0.27 120.40 126.33 3ic9 s VAL 176 Ca 0.15 -0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.12 3ic9 s VAL 176 Cb -0.13 -3.18 0.02 0.00 0.00 0.00 0.00 36.38 33.09 3ic9 s VAL 176 CO 0.03 0.58 -0.05 -0.36 0.00 0.00 0.00 175.10 175.30 3ic9 s PHE 177 N -1.01 0.75 0.00 5.22 0.08 0.01 -1.11 117.98 121.93 3ic9 s PHE 177 Ca 0.16 -0.20 0.00 0.00 0.12 0.00 0.00 56.93 57.00 3ic9 s PHE 177 Cb -0.12 -0.65 0.00 0.00 -0.57 0.00 0.00 43.02 41.68 3ic9 s PHE 177 CO 0.05 -0.18 0.00 0.41 -0.10 0.00 0.00 175.22 175.40 3ic9 n GLY 178 N 3.96 2.48 0.00 4.36 0.00 -0.37 0.87 105.19 116.50 3ic9 n GLY 178 Ca -0.25 -2.01 0.16 0.00 0.00 0.00 0.00 46.02 43.91 3ic9 n GLY 178 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3ic9 n PRO 179 N 0.23 0.93 -1.85 1.61 -0.04 -1.21 -4.19 135.00 130.48 3ic9 n PRO 179 Ca 0.00 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.04 3ic9 n PRO 179 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 3ic9 n PRO 179 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3ic9 s GLY 180 N -2.05 1.68 0.31 0.55 0.00 0.19 -4.69 107.32 103.31 3ic9 s GLY 180 Ca 0.45 1.48 0.04 0.00 0.00 0.00 0.00 44.72 46.70 3ic9 s GLY 180 CO 0.37 2.64 1.83 -2.08 0.00 0.00 0.00 173.10 175.87 3ic9 h VAL 181 N 3.74 0.86 -0.96 1.40 2.07 -1.91 0.24 116.25 121.70 3ic9 h VAL 181 Ca -0.44 -0.30 0.22 0.00 0.82 0.00 0.00 66.70 67.01 3ic9 h VAL 181 Cb 1.21 -0.09 -0.08 0.00 -1.52 0.00 0.00 31.29 30.82 3ic9 h VAL 181 CO 0.88 0.16 0.63 0.40 0.02 0.00 0.00 177.57 179.66 3ic9 h ILE 182 N 0.87 0.63 -0.98 4.57 2.04 -1.92 1.00 117.51 123.71 3ic9 h ILE 182 Ca 0.50 -0.14 0.06 0.00 1.00 0.00 0.00 64.86 66.28 3ic9 h ILE 182 Cb 0.63 0.18 -0.07 0.00 -0.74 0.00 0.00 36.82 36.83 3ic9 h ILE 182 CO -0.27 0.08 0.63 1.23 0.00 0.00 0.00 178.15 179.82 3ic9 h GLY 183 N 0.41 1.49 0.97 5.37 0.00 -0.80 -0.80 103.07 109.71 3ic9 h GLY 183 Ca 0.51 -0.47 -0.22 0.00 0.00 0.00 0.00 47.33 47.15 3ic9 h GLY 183 CO -0.22 0.34 -0.92 1.41 0.00 0.00 0.00 176.54 177.15 3ic9 h LEU 184 N 1.16 0.68 0.29 3.11 4.07 -0.92 -1.35 115.31 122.35 3ic9 h LEU 184 Ca 0.42 -0.82 -0.01 0.00 0.08 0.00 0.00 57.88 57.55 3ic9 h LEU 184 Cb 0.14 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 41.67 3ic9 h LEU 184 CO -0.17 1.43 -0.15 -0.33 -1.08 0.00 0.00 178.44 178.15 3ic9 h GLU 185 N 0.03 -0.39 0.03 1.13 5.08 -0.93 -1.46 114.58 118.07 3ic9 h GLU 185 Ca -0.14 0.03 -0.23 0.00 -1.00 0.00 0.00 59.36 58.02 3ic9 h GLU 185 Cb 1.64 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.97 3ic9 h GLU 185 CO 0.18 -0.26 -0.99 -0.07 -1.00 0.00 0.00 179.01 176.87 3ic9 h LEU 186 N -0.40 0.38 -0.26 1.33 4.07 -1.29 -2.49 115.31 116.66 3ic9 h LEU 186 Ca -0.04 -0.34 -0.04 0.00 0.08 0.00 0.00 57.88 57.55 3ic9 h LEU 186 Cb 0.32 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.93 3ic9 h LEU 186 CO 0.05 1.17 0.02 1.23 -1.08 0.00 0.00 178.44 179.83 3ic9 h GLY 187 N 1.61 0.47 0.87 0.83 0.00 -1.15 -0.03 103.07 105.67 3ic9 h GLY 187 Ca -0.08 -0.33 -0.03 0.00 0.00 0.00 0.00 47.33 46.89 3ic9 h GLY 187 CO 0.16 0.30 0.03 -1.61 0.00 0.00 0.00 176.54 175.43 3ic9 h GLN 188 N 0.23 0.44 -0.40 4.80 4.15 -1.32 -1.26 115.11 121.75 3ic9 h GLN 188 Ca 0.08 -0.12 0.06 0.00 0.77 0.00 0.00 58.65 59.43 3ic9 h GLN 188 Cb 0.37 -0.05 -0.05 0.00 0.21 0.00 0.00 27.48 27.96 3ic9 h GLN 188 CO 0.01 0.57 0.10 0.00 -1.93 0.00 0.00 178.83 177.58 3ic9 h ALA 189 N 0.85 0.44 -0.23 3.38 0.00 -1.33 0.24 119.26 122.61 3ic9 h ALA 189 Ca 0.08 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.07 3ic9 h ALA 189 Cb 0.35 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 3ic9 h ALA 189 CO 0.01 -0.30 0.12 -0.07 0.00 0.00 0.00 179.25 179.01 3ic9 h LEU 190 N 0.23 0.19 -0.64 0.00 3.38 -0.88 -1.93 115.31 115.67 3ic9 h LEU 190 Ca 0.19 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.23 3ic9 h LEU 190 Cb 0.21 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 40.87 3ic9 h LEU 190 CO -0.23 0.15 0.33 -1.28 0.09 0.00 0.00 178.44 177.49 3ic9 h SER 191 N 0.26 0.45 0.64 -0.43 0.87 -0.81 -0.71 113.55 113.82 3ic9 h SER 191 Ca 0.09 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.70 3ic9 h SER 191 Cb 0.01 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 61.93 3ic9 h SER 191 CO -0.06 0.29 0.00 0.03 -0.53 0.00 0.00 176.83 176.56 3ic9 h ARG 192 N 0.60 0.00 -0.43 2.24 3.08 0.19 -1.97 114.38 118.08 3ic9 h ARG 192 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.35 3ic9 h ARG 192 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.29 3ic9 h ARG 192 CO -0.21 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 179.97 3ic9 n LEU 193 N -2.48 3.22 0.00 3.04 7.99 -0.33 -4.15 117.00 124.28 3ic9 n LEU 193 Ca 0.01 -1.45 0.00 0.00 -0.01 0.00 0.00 56.01 54.56 3ic9 n LEU 193 Cb 0.21 -0.28 0.00 0.00 -0.11 0.00 0.00 43.42 43.24 3ic9 n LEU 193 CO 0.20 0.72 0.00 0.61 -1.51 0.00 0.00 177.39 177.41 3ic9 n GLY 194 N 1.46 0.59 3.74 -0.72 0.00 -0.74 -4.93 105.19 104.59 3ic9 n GLY 194 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 3ic9 n GLY 194 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ic9 s VAL 195 N -2.00 3.92 -0.28 1.61 1.01 -0.86 -4.96 120.40 118.85 3ic9 s VAL 195 Ca 0.00 1.67 -0.29 0.00 0.00 0.00 0.00 61.98 63.36 3ic9 s VAL 195 Cb 0.00 -4.06 0.00 0.00 0.00 0.00 0.00 36.38 32.32 3ic9 s VAL 195 CO 0.00 0.29 1.23 -0.63 0.00 0.00 0.00 175.10 175.99 3ic9 s ILE 196 N -0.26 4.27 0.01 2.22 1.01 0.26 -4.07 121.20 124.64 3ic9 s ILE 196 Ca 0.49 1.46 0.04 0.00 0.00 0.00 0.00 60.65 62.64 3ic9 s ILE 196 Cb -0.29 -4.19 -0.01 0.00 0.01 0.00 0.00 42.46 37.98 3ic9 s ILE 196 CO 0.34 -0.41 -0.13 0.68 0.00 0.00 0.00 174.94 175.43 3ic9 s VAL 197 N 4.01 1.04 -0.06 2.92 -7.23 -1.26 -0.60 120.40 119.22 3ic9 s VAL 197 Ca 0.53 -0.71 0.04 0.00 -1.81 0.00 0.00 61.98 60.03 3ic9 s VAL 197 Cb -0.16 -0.90 0.00 0.00 0.56 0.00 0.00 36.38 35.88 3ic9 s VAL 197 CO 0.19 0.18 -0.16 -0.54 -0.31 0.00 0.00 175.10 174.46 3ic9 s LYS 198 N -0.60 1.95 -0.30 4.82 1.02 -1.14 -4.21 119.74 121.28 3ic9 s LYS 198 Ca 0.04 -0.58 -0.09 0.00 0.02 0.00 0.00 55.97 55.35 3ic9 s LYS 198 Cb -0.06 -1.62 -0.01 0.00 -0.52 0.00 0.00 37.83 35.62 3ic9 s LYS 198 CO 0.00 0.16 0.13 0.08 -0.92 0.00 0.00 175.35 174.80 3ic9 s VAL 199 N 0.30 4.54 -0.64 3.17 1.01 -0.14 -1.16 120.40 127.49 3ic9 s VAL 199 Ca -0.10 -0.35 -0.08 0.00 0.00 0.00 0.00 61.98 61.45 3ic9 s VAL 199 Cb -0.14 -3.27 0.17 0.00 0.00 0.00 0.00 36.38 33.13 3ic9 s VAL 199 CO 0.04 0.13 0.51 -0.36 0.00 0.00 0.00 175.10 175.42 3ic9 s PHE 200 N 1.62 3.52 0.05 5.22 0.08 -0.26 -1.16 117.98 127.04 3ic9 s PHE 200 Ca 0.05 -2.26 -0.00 0.00 0.12 0.00 0.00 56.93 54.84 3ic9 s PHE 200 Cb -0.17 -3.47 0.01 0.00 -0.57 0.00 0.00 43.02 38.82 3ic9 s PHE 200 CO 0.06 -0.93 0.07 0.41 -0.10 0.00 0.00 175.22 174.73 3ic9 n GLY 201 N 4.05 0.63 3.00 4.36 0.00 -0.17 -1.23 105.19 115.83 3ic9 n GLY 201 Ca 0.05 -1.94 -0.14 0.00 0.00 0.00 0.00 46.02 43.99 3ic9 n GLY 201 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ic9 s ARG 202 N -2.62 0.44 -1.91 1.61 1.81 -0.84 -1.62 118.95 115.82 3ic9 s ARG 202 Ca 0.05 -0.46 0.00 0.00 -1.72 0.00 0.00 55.73 53.60 3ic9 s ARG 202 Cb -0.00 -0.31 0.00 0.00 -0.45 0.00 0.00 34.95 34.19 3ic9 s ARG 202 CO 0.03 0.07 0.00 -1.13 -0.68 0.00 0.00 175.30 173.59 3ic9 n SER 203 N 2.22 -5.36 0.00 0.23 3.41 -1.07 -2.38 113.62 110.67 3ic9 n SER 203 Ca -0.18 0.45 0.00 0.00 -0.26 0.00 0.00 58.87 58.88 3ic9 n SER 203 Cb 0.57 -4.45 0.00 0.00 -0.26 0.00 0.00 64.21 60.07 3ic9 n SER 203 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ic9 n GLY 204 N -0.51 1.56 3.69 5.00 0.00 -0.47 -4.99 105.19 109.48 3ic9 n GLY 204 Ca -0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.40 3ic9 n GLY 204 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3ic9 n SER 205 N 0.00 3.21 -3.57 1.61 7.64 -1.00 -4.96 113.62 116.55 3ic9 n SER 205 Ca 0.00 1.12 -0.28 0.00 1.01 0.00 0.00 58.87 60.72 3ic9 n SER 205 Cb 0.00 -1.48 -0.16 0.00 -1.01 0.00 0.00 64.21 61.56 3ic9 n SER 205 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3ic9 s VAL 206 N 0.29 -0.05 -1.65 0.44 1.01 -1.26 -4.78 120.40 114.39 3ic9 s VAL 206 Ca 0.70 -0.53 -0.16 0.00 0.00 0.00 0.00 61.98 62.00 3ic9 s VAL 206 Cb -0.61 -0.83 0.13 0.00 0.00 0.00 0.00 36.38 35.08 3ic9 s VAL 206 CO 0.45 -0.54 0.75 0.00 0.00 0.00 0.00 175.10 175.76 3ic9 n ALA 207 N 5.25 -1.36 -0.57 5.51 0.00 -1.26 -1.37 120.51 126.71 3ic9 n ALA 207 Ca -0.06 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3ic9 n ALA 207 Cb 0.45 -3.31 0.00 0.00 0.00 0.00 0.00 19.45 16.59 3ic9 n ALA 207 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3ic9 n ASN 208 N -2.72 0.00 -4.66 0.00 3.02 -1.26 -4.94 115.26 104.71 3ic9 n ASN 208 Ca 0.02 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.15 3ic9 n ASN 208 Cb 0.52 -1.73 0.01 0.00 -0.61 0.00 0.00 39.78 37.97 3ic9 n ASN 208 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3ic9 n LEU 209 N 0.00 3.20 -0.06 3.41 4.77 -0.47 -4.95 117.00 122.89 3ic9 n LEU 209 Ca 0.00 1.10 -0.06 0.00 -0.03 0.00 0.00 56.01 57.02 3ic9 n LEU 209 Cb 0.00 -1.42 -0.10 0.00 -2.33 0.00 0.00 43.42 39.57 3ic9 n LEU 209 CO 0.00 -1.01 -0.93 0.00 -1.33 0.00 0.00 177.39 174.12 3ic9 n GLN 210 N 0.22 1.84 -2.40 3.23 6.02 -1.26 -4.68 117.38 120.35 3ic9 n GLN 210 Ca 0.08 -0.01 -0.42 0.00 -0.01 0.00 0.00 57.00 56.64 3ic9 n GLN 210 Cb 0.38 -1.34 -0.03 0.00 1.02 0.00 0.00 30.24 30.28 3ic9 n GLN 210 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3ic9 s ASP 211 N -4.61 7.03 0.12 1.08 2.15 -1.26 -4.94 116.67 116.24 3ic9 s ASP 211 Ca -0.06 1.97 -0.21 0.00 0.43 0.00 0.00 52.55 54.68 3ic9 s ASP 211 Cb 0.04 -2.57 -0.07 0.00 -0.30 0.00 0.00 42.92 40.02 3ic9 s ASP 211 CO 0.54 -0.55 1.73 -0.08 -0.17 0.00 0.00 175.17 176.64 3ic9 h GLU 212 N 7.19 0.07 -0.31 4.34 4.57 -2.02 -1.52 114.58 126.90 3ic9 h GLU 212 Ca -0.38 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.79 3ic9 h GLU 212 Cb 1.19 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.76 3ic9 h GLU 212 CO 0.85 0.04 0.00 -1.91 -1.18 0.00 0.00 179.01 176.82 3ic9 n GLU 213 N -5.10 0.00 0.00 1.92 2.13 -1.26 -1.94 120.64 116.39 3ic9 n GLU 213 Ca -0.04 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.78 3ic9 n GLU 213 Cb 0.08 -0.92 0.00 0.00 0.27 0.00 0.00 31.44 30.87 3ic9 n GLU 213 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 3ic9 n LYS 215 N 0.44 0.00 -0.14 5.31 5.02 -0.57 -1.61 118.16 126.61 3ic9 n LYS 215 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 3ic9 n LYS 215 Cb 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.00 3ic9 n LYS 215 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ic9 h ARG 216 N 0.00 0.72 -0.57 1.97 2.47 -1.66 -1.14 114.38 116.17 3ic9 h ARG 216 Ca 0.00 -0.22 -0.00 0.00 -1.26 0.00 0.00 59.98 58.50 3ic9 h ARG 216 Cb 0.00 -0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 28.22 3ic9 h ARG 216 CO 0.00 0.79 0.35 -0.92 0.56 0.00 0.00 179.97 180.75 3ic9 h TYR 217 N 0.56 0.74 -0.67 3.04 3.20 -1.58 -1.14 116.97 121.12 3ic9 h TYR 217 Ca 0.12 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.95 3ic9 h TYR 217 Cb 0.45 -0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.45 3ic9 h TYR 217 CO 0.03 0.50 0.25 0.00 -1.64 0.00 0.00 178.16 177.31 3ic9 h ALA 218 N 1.18 0.88 -0.40 1.82 0.00 -1.78 0.62 119.26 121.57 3ic9 h ALA 218 Ca 0.20 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 3ic9 h ALA 218 Cb -0.03 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 3ic9 h ALA 218 CO -0.04 0.51 0.17 1.49 0.00 0.00 0.00 179.25 181.38 3ic9 h GLU 219 N 0.96 0.59 -0.42 0.00 4.81 -0.82 -0.66 114.58 119.03 3ic9 h GLU 219 Ca 0.22 -0.10 0.03 0.00 -0.13 0.00 0.00 59.36 59.38 3ic9 h GLU 219 Cb 0.23 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 3ic9 h GLU 219 CO -0.02 0.54 0.22 -0.22 -0.73 0.00 0.00 179.01 178.81 3ic9 h LYS 220 N 0.50 0.43 0.35 1.92 3.64 -1.02 -1.00 116.57 121.39 3ic9 h LYS 220 Ca 0.13 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.47 3ic9 h LYS 220 Cb 0.16 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 3ic9 h LYS 220 CO -0.01 0.29 -0.18 1.15 -2.27 0.00 0.00 179.45 178.42 3ic9 h THR 221 N 0.44 0.63 -0.97 1.00 2.02 -0.48 -2.13 112.91 113.42 3ic9 h THR 221 Ca 0.18 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.49 3ic9 h THR 221 Cb 0.07 0.63 -0.08 0.00 -1.74 0.00 0.00 68.15 67.03 3ic9 h THR 221 CO -0.12 0.00 0.62 -0.26 0.37 0.00 0.00 175.52 176.13 3ic9 h PHE 222 N -0.49 1.06 0.00 3.16 0.04 -1.02 -1.72 116.94 117.98 3ic9 h PHE 222 Ca -0.04 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.76 3ic9 h PHE 222 Cb 0.38 -0.34 0.00 0.00 2.20 0.00 0.00 35.95 38.20 3ic9 h PHE 222 CO -0.06 0.41 0.00 -0.91 -0.60 0.00 0.00 178.31 177.15 3ic9 h ASN 223 N 0.91 0.00 0.69 2.17 2.35 -0.51 -0.05 115.58 121.14 3ic9 h ASN 223 Ca 0.49 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.24 3ic9 h ASN 223 Cb 0.56 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.93 3ic9 h ASN 223 CO -0.25 0.00 0.00 -0.62 -1.65 0.00 0.00 177.43 174.91 3ic9 n GLU 224 N -2.30 0.07 -0.01 0.81 1.02 -0.65 -4.09 120.64 115.50 3ic9 n GLU 224 Ca 0.01 0.27 -0.02 0.00 -0.02 0.00 0.00 57.16 57.40 3ic9 n GLU 224 Cb 0.20 -1.63 -0.01 0.00 -0.02 0.00 0.00 31.44 29.98 3ic9 n GLU 224 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 3ic9 n GLU 225 N -1.77 0.05 -3.88 3.49 2.13 -0.34 -5.09 120.64 115.22 3ic9 n GLU 225 Ca 0.04 0.02 -0.10 0.00 0.66 0.00 0.00 57.16 57.77 3ic9 n GLU 225 Cb 0.23 -0.75 -0.09 0.00 0.27 0.00 0.00 31.44 31.09 3ic9 n GLU 225 CO 0.00 0.00 0.00 -0.59 -0.41 0.00 0.00 177.13 176.13 3ic9 s PHE 226 N -2.04 0.10 0.05 4.31 -0.12 -0.18 -5.07 117.98 115.02 3ic9 s PHE 226 Ca -0.03 -0.28 -0.31 0.00 -0.05 0.00 0.00 56.93 56.26 3ic9 s PHE 226 Cb 0.01 -0.07 -0.10 0.00 -0.63 0.00 0.00 43.02 42.23 3ic9 s PHE 226 CO 0.04 -0.34 1.94 0.98 -0.05 0.00 0.00 175.22 177.79 3ic9 n TYR 227 N 1.07 2.53 -3.59 3.49 9.36 -1.26 -3.76 117.16 125.00 3ic9 n TYR 227 Ca -0.21 -0.30 -0.14 0.00 3.32 0.00 0.00 57.90 60.57 3ic9 n TYR 227 Cb 0.57 -2.78 -0.13 0.00 -0.63 0.00 0.00 39.34 36.38 3ic9 n TYR 227 CO 0.00 0.00 0.00 0.12 0.22 0.00 0.00 176.86 177.20 3ic9 s PHE 228 N 4.01 -0.42 -0.33 2.98 5.36 -1.26 -0.97 117.98 127.36 3ic9 s PHE 228 Ca 0.88 0.78 -0.00 0.00 -0.96 0.00 0.00 56.93 57.62 3ic9 s PHE 228 Cb -0.46 -0.11 0.08 0.00 -0.34 0.00 0.00 43.02 42.18 3ic9 s PHE 228 CO 0.42 -0.45 0.04 0.34 -1.46 0.00 0.00 175.22 174.11 3ic9 s ASP 229 N 2.41 4.89 0.13 6.13 -1.08 -0.31 -4.88 116.67 123.95 3ic9 s ASP 229 Ca 0.04 -1.65 0.21 0.00 -0.52 0.00 0.00 52.55 50.63 3ic9 s ASP 229 Cb -0.13 -1.70 0.85 0.00 -1.46 0.00 0.00 42.92 40.48 3ic9 s ASP 229 CO -0.10 -0.34 1.65 0.00 0.52 0.00 0.00 175.17 176.90 3ic9 n ALA 230 N 4.51 1.80 -2.37 3.66 0.00 -1.26 -1.00 120.51 125.85 3ic9 n ALA 230 Ca -0.07 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.17 3ic9 n ALA 230 Cb 0.42 -1.35 0.02 0.00 0.00 0.00 0.00 19.45 18.54 3ic9 n ALA 230 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3ic9 n LYS 231 N -1.89 2.98 -2.40 0.00 5.02 -1.26 -1.37 118.16 119.25 3ic9 n LYS 231 Ca 0.04 -4.08 -0.39 0.00 -2.02 0.00 0.00 58.31 51.85 3ic9 n LYS 231 Cb 0.24 -2.05 -0.03 0.00 -0.02 0.00 0.00 35.03 33.17 3ic9 n LYS 231 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ic9 s ALA 232 N -3.55 3.31 -0.35 7.82 0.00 -0.64 -4.87 121.76 123.49 3ic9 s ALA 232 Ca 0.44 0.93 -0.04 0.00 0.00 0.00 0.00 51.96 53.29 3ic9 s ALA 232 Cb 0.40 -3.35 0.07 0.00 0.00 0.00 0.00 23.12 20.24 3ic9 s ALA 232 CO -0.05 -0.32 0.11 1.03 0.00 0.00 0.00 175.76 176.53 3ic9 s ARG 233 N -1.84 2.38 -0.09 0.00 0.52 -1.26 -4.81 118.95 113.84 3ic9 s ARG 233 Ca 0.50 -1.41 0.01 0.00 -0.52 0.00 0.00 55.73 54.31 3ic9 s ARG 233 Cb -0.31 -3.42 -0.02 0.00 0.52 0.00 0.00 34.95 31.72 3ic9 s ARG 233 CO 0.40 -0.79 -0.12 0.08 0.02 0.00 0.00 175.30 174.90 3ic9 s VAL 234 N 1.28 3.24 -0.17 3.52 1.01 -1.26 -1.74 120.40 126.27 3ic9 s VAL 234 Ca 0.00 -0.62 -0.14 0.00 0.00 0.00 0.00 61.98 61.22 3ic9 s VAL 234 Cb -0.21 -2.33 -0.09 0.00 0.00 0.00 0.00 36.38 33.75 3ic9 s VAL 234 CO -0.01 0.56 -0.08 -0.38 0.00 0.00 0.00 175.10 175.19 3ic9 n ILE 235 N 2.88 1.47 -3.51 2.22 5.41 0.09 -4.99 119.36 122.93 3ic9 n ILE 235 Ca -0.18 0.10 -0.15 0.00 1.00 0.00 0.00 62.75 63.52 3ic9 n ILE 235 Cb 0.53 -2.25 -0.05 0.00 -0.71 0.00 0.00 39.64 37.16 3ic9 n ILE 235 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 3ic9 s SER 236 N -6.21 -0.57 -0.37 4.38 1.04 -0.94 -4.99 113.70 106.04 3ic9 s SER 236 Ca -0.22 0.50 0.00 0.00 0.48 0.00 0.00 55.95 56.71 3ic9 s SER 236 Cb 0.04 0.49 0.13 0.00 0.10 0.00 0.00 66.02 66.78 3ic9 s SER 236 CO 0.37 -0.62 0.19 0.42 0.98 0.00 0.00 173.24 174.58 3ic9 s THR 237 N -1.71 0.84 -0.20 2.02 -4.23 -1.26 -0.98 115.64 110.12 3ic9 s THR 237 Ca -0.06 -1.92 -0.03 0.00 -1.18 0.00 0.00 61.69 58.50 3ic9 s THR 237 Cb -0.00 -1.61 -0.01 0.00 1.34 0.00 0.00 72.50 72.22 3ic9 s THR 237 CO 0.03 -0.85 -0.07 -0.63 -0.54 0.00 0.00 174.62 172.56 3ic9 s ILE 238 N 0.98 3.24 0.27 2.99 1.01 -0.52 -2.42 121.20 126.75 3ic9 s ILE 238 Ca 0.15 -0.55 -0.31 0.00 0.00 0.00 0.00 60.65 59.95 3ic9 s ILE 238 Cb -0.22 -2.45 -0.12 0.00 0.01 0.00 0.00 42.46 39.68 3ic9 s ILE 238 CO -0.08 0.45 1.59 1.21 0.00 0.00 0.00 174.94 178.10 3ic9 n GLU 239 N 4.53 2.59 0.00 2.79 2.13 0.90 -1.88 120.64 131.70 3ic9 n GLU 239 Ca -0.18 0.92 0.00 0.00 0.66 0.00 0.00 57.16 58.56 3ic9 n GLU 239 Cb 0.51 -2.70 0.00 0.00 0.27 0.00 0.00 31.44 29.53 3ic9 n GLU 239 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 3ic9 n LYS 240 N 2.47 3.98 -0.02 5.31 4.76 0.48 -4.89 118.16 130.25 3ic9 n LYS 240 Ca 0.11 0.00 -0.16 0.00 -2.87 0.00 0.00 58.31 55.39 3ic9 n LYS 240 Cb 0.35 0.00 -0.11 0.00 -1.84 0.00 0.00 35.03 33.43 3ic9 n LYS 240 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 3ic9 h GLU 241 N 0.00 0.27 0.00 1.97 4.57 -2.02 -3.38 114.58 115.98 3ic9 h GLU 241 Ca 0.00 -0.27 -0.01 0.00 -1.18 0.00 0.00 59.36 57.90 3ic9 h GLU 241 Cb 0.00 0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.63 3ic9 h GLU 241 CO 0.00 0.96 -0.37 -0.40 -1.18 0.00 0.00 179.01 178.02 3ic9 n ASP 242 N -4.42 0.91 -3.57 1.04 3.85 -1.26 -5.09 116.55 108.01 3ic9 n ASP 242 Ca -0.10 -2.44 -0.03 0.00 -0.71 0.00 0.00 54.79 51.52 3ic9 n ASP 242 Cb 0.54 -0.30 0.00 0.00 -1.35 0.00 0.00 41.12 40.02 3ic9 n ASP 242 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3ic9 s ALA 243 N -1.08 -1.70 -0.21 2.12 0.00 -1.26 -4.78 121.76 114.86 3ic9 s ALA 243 Ca 0.14 -0.01 -0.06 0.00 0.00 0.00 0.00 51.96 52.04 3ic9 s ALA 243 Cb 0.13 0.66 -0.03 0.00 0.00 0.00 0.00 23.12 23.89 3ic9 s ALA 243 CO -0.01 -1.06 0.01 0.08 0.00 0.00 0.00 175.76 174.79 3ic9 s VAL 244 N -2.70 4.07 -0.23 0.00 1.01 0.22 -0.39 120.40 122.38 3ic9 s VAL 244 Ca 0.17 -0.27 -0.29 0.00 0.00 0.00 0.00 61.98 61.59 3ic9 s VAL 244 Cb -0.01 -2.85 0.01 0.00 0.00 0.00 0.00 36.38 33.52 3ic9 s VAL 244 CO 0.03 0.42 1.09 -0.70 0.00 0.00 0.00 175.10 175.94 3ic9 s GLU 245 N 1.03 4.22 -0.22 2.72 2.12 -0.79 -1.01 118.70 126.77 3ic9 s GLU 245 Ca 0.02 1.38 -0.07 0.00 0.36 0.00 0.00 54.97 56.66 3ic9 s GLU 245 Cb -0.14 -3.68 -0.03 0.00 0.26 0.00 0.00 34.13 30.53 3ic9 s GLU 245 CO 0.02 -0.69 0.07 0.08 -0.54 0.00 0.00 175.26 174.19 3ic9 s VAL 246 N 3.34 4.48 -0.19 3.70 1.01 0.22 -1.44 120.40 131.52 3ic9 s VAL 246 Ca 0.46 -0.13 -0.03 0.00 0.00 0.00 0.00 61.98 62.29 3ic9 s VAL 246 Cb -0.16 -3.06 -0.01 0.00 0.00 0.00 0.00 36.38 33.15 3ic9 s VAL 246 CO 0.09 0.38 -0.07 -0.63 0.00 0.00 0.00 175.10 174.87 3ic9 s ILE 247 N 1.14 3.22 0.29 2.22 1.01 -0.15 -1.23 121.20 127.71 3ic9 s ILE 247 Ca 0.04 -0.56 -0.12 0.00 0.00 0.00 0.00 60.65 60.01 3ic9 s ILE 247 Cb -0.14 -2.43 0.01 0.00 0.01 0.00 0.00 42.46 39.90 3ic9 s ILE 247 CO 0.03 0.46 0.55 -0.72 0.00 0.00 0.00 174.94 175.27 3ic9 s TYR 248 N 1.14 0.39 -0.18 3.97 1.13 -0.47 -0.73 117.35 122.61 3ic9 s TYR 248 Ca 0.01 -0.78 -0.06 0.00 -1.41 0.00 0.00 57.07 54.83 3ic9 s TYR 248 Cb -0.14 0.30 -0.04 0.00 -1.10 0.00 0.00 41.96 40.98 3ic9 s TYR 248 CO -0.02 -1.14 0.03 -0.06 -2.51 0.00 0.00 175.55 171.86 3ic9 s PHE 249 N -3.58 3.19 0.32 -3.49 0.08 -0.71 0.12 117.98 113.91 3ic9 s PHE 249 Ca 0.21 -0.04 -0.05 0.00 0.12 0.00 0.00 56.93 57.17 3ic9 s PHE 249 Cb -0.02 -2.05 0.08 0.00 -0.57 0.00 0.00 43.02 40.46 3ic9 s PHE 249 CO 0.11 0.10 0.31 -0.40 -0.10 0.00 0.00 175.22 175.24 3ic9 n ASP 250 N 3.55 -1.11 0.04 1.36 3.85 -0.31 -4.51 116.55 119.42 3ic9 n ASP 250 Ca -0.17 -0.74 0.09 0.00 -0.71 0.00 0.00 54.79 53.26 3ic9 n ASP 250 Cb 0.52 -0.27 0.40 0.00 -1.35 0.00 0.00 41.12 40.41 3ic9 n ASP 250 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 3ic9 n LYS 251 N -2.32 0.07 -0.32 0.11 5.02 -1.26 -1.04 118.16 118.42 3ic9 n LYS 251 Ca 0.04 0.28 0.10 0.00 -2.02 0.00 0.00 58.31 56.71 3ic9 n LYS 251 Cb 0.16 -1.63 0.28 0.00 -0.02 0.00 0.00 35.03 33.83 3ic9 n LYS 251 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3ic9 n SER 252 N -1.76 3.70 -0.05 4.39 3.41 -1.26 -4.97 113.62 117.09 3ic9 n SER 252 Ca 0.03 -2.00 -0.01 0.00 -0.26 0.00 0.00 58.87 56.64 3ic9 n SER 252 Cb 0.21 -0.42 -0.00 0.00 -0.26 0.00 0.00 64.21 63.74 3ic9 n SER 252 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ic9 n GLY 253 N 1.38 0.44 3.75 5.00 0.00 -0.20 -5.04 105.19 110.53 3ic9 n GLY 253 Ca 0.21 -0.95 -0.37 0.00 0.00 0.00 0.00 46.02 44.91 3ic9 n GLY 253 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ic9 s GLN 254 N -1.85 4.19 0.11 1.61 -1.52 -1.26 -4.75 119.66 116.20 3ic9 s GLN 254 Ca 0.00 0.27 -0.31 0.00 -1.95 0.00 0.00 55.36 53.37 3ic9 s GLN 254 Cb 0.00 -3.38 -0.10 0.00 -0.22 0.00 0.00 33.01 29.31 3ic9 s GLN 254 CO 0.00 0.31 1.73 0.21 -0.25 0.00 0.00 175.29 177.29 3ic9 s LYS 255 N 0.18 4.17 -0.01 2.91 2.20 -1.26 -1.16 119.74 126.77 3ic9 s LYS 255 Ca 0.21 2.47 0.03 0.00 -0.36 0.00 0.00 55.97 58.31 3ic9 s LYS 255 Cb -0.14 -3.53 -0.01 0.00 -1.51 0.00 0.00 37.83 32.64 3ic9 s LYS 255 CO 0.08 -0.77 -0.08 0.99 -0.36 0.00 0.00 175.35 175.20 3ic9 s THR 256 N 2.47 0.67 -0.13 3.43 2.01 0.12 -4.95 115.64 119.27 3ic9 s THR 256 Ca 0.77 -0.36 -0.00 0.00 0.31 0.00 0.00 61.69 62.41 3ic9 s THR 256 Cb -0.43 -0.57 -0.01 0.00 0.01 0.00 0.00 72.50 71.49 3ic9 s THR 256 CO 0.34 0.19 -0.13 -0.89 -0.69 0.00 0.00 174.62 173.44 3ic9 s THR 257 N -0.14 3.03 -0.13 -0.82 2.01 -1.26 -1.37 115.64 116.96 3ic9 s THR 257 Ca 0.02 -0.67 -0.09 0.00 0.31 0.00 0.00 61.69 61.26 3ic9 s THR 257 Cb -0.04 -2.27 0.04 0.00 0.01 0.00 0.00 72.50 70.25 3ic9 s THR 257 CO -0.00 0.53 0.32 -0.70 -0.69 0.00 0.00 174.62 174.07 3ic9 s GLU 258 N 0.34 0.33 0.01 4.92 2.12 -0.36 -5.01 118.70 121.04 3ic9 s GLU 258 Ca -0.11 0.55 -0.20 0.00 0.36 0.00 0.00 54.97 55.56 3ic9 s GLU 258 Cb -0.16 0.05 -0.06 0.00 0.26 0.00 0.00 34.13 34.22 3ic9 s GLU 258 CO 0.06 -0.10 0.59 -1.12 -0.54 0.00 0.00 175.26 174.14 3ic9 s SER 259 N 0.77 6.98 0.03 -1.70 0.01 -1.26 -0.61 113.70 117.91 3ic9 s SER 259 Ca -0.05 1.17 0.05 0.00 1.31 0.00 0.00 55.95 58.43 3ic9 s SER 259 Cb -0.06 -2.36 -0.02 0.00 0.21 0.00 0.00 66.02 63.79 3ic9 s SER 259 CO -0.05 0.13 -0.14 -0.36 0.41 0.00 0.00 173.24 173.23 3ic9 s PHE 260 N -0.34 1.27 0.17 2.43 0.08 -0.18 -4.94 117.98 116.47 3ic9 s PHE 260 Ca 0.30 -0.32 -0.14 0.00 0.12 0.00 0.00 56.93 56.89 3ic9 s PHE 260 Cb -0.18 -0.77 0.06 0.00 -0.57 0.00 0.00 43.02 41.56 3ic9 s PHE 260 CO 0.17 0.03 1.78 0.37 -0.10 0.00 0.00 175.22 177.47 3ic9 h GLN 261 N 5.15 0.74 -4.92 0.44 4.15 -1.74 0.62 115.11 119.55 3ic9 h GLN 261 Ca -0.37 -0.09 -0.38 0.00 0.77 0.00 0.00 58.65 58.58 3ic9 h GLN 261 Cb 1.17 -0.15 -0.14 0.00 0.21 0.00 0.00 27.48 28.58 3ic9 h GLN 261 CO 0.45 0.57 -0.60 0.71 -1.93 0.00 0.00 178.83 178.04 3ic9 s TYR 262 N -5.86 1.60 -0.01 3.99 2.02 -1.04 -4.25 117.35 113.80 3ic9 s TYR 262 Ca -0.13 -1.21 0.05 0.00 -0.37 0.00 0.00 57.07 55.41 3ic9 s TYR 262 Cb 0.12 -0.94 -0.01 0.00 -0.40 0.00 0.00 41.96 40.73 3ic9 s TYR 262 CO 0.76 -0.34 -0.15 0.08 -1.57 0.00 0.00 175.55 174.33 3ic9 s VAL 263 N -3.66 1.17 -0.20 0.71 1.01 -0.86 -2.44 120.40 116.13 3ic9 s VAL 263 Ca 0.37 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 61.73 3ic9 s VAL 263 Cb 0.07 -0.98 0.03 0.00 0.00 0.00 0.00 36.38 35.50 3ic9 s VAL 263 CO 0.15 0.33 -0.18 -0.22 0.00 0.00 0.00 175.10 175.18 3ic9 s LEU 264 N -0.33 2.41 -0.14 3.92 2.96 0.62 0.51 118.68 128.64 3ic9 s LEU 264 Ca 0.05 -0.78 -0.29 0.00 -0.22 0.00 0.00 54.13 52.89 3ic9 s LEU 264 Cb -0.06 -1.50 -0.02 0.00 0.50 0.00 0.00 46.19 45.10 3ic9 s LEU 264 CO -0.00 -0.04 1.33 0.00 -1.32 0.00 0.00 176.35 176.32 3ic9 s ALA 265 N 1.26 3.65 -0.32 5.97 0.00 -0.48 -0.81 121.76 131.04 3ic9 s ALA 265 Ca 0.02 0.56 0.11 0.00 0.00 0.00 0.00 51.96 52.66 3ic9 s ALA 265 Cb -0.14 -3.64 0.46 0.00 0.00 0.00 0.00 23.12 19.80 3ic9 s ALA 265 CO -0.11 -1.19 1.13 0.00 0.00 0.00 0.00 175.76 175.59 3ic9 n ALA 266 N 6.62 4.29 -1.26 0.00 0.00 0.25 -4.78 120.51 125.63 3ic9 n ALA 266 Ca 0.14 -3.59 -0.21 0.00 0.00 0.00 0.00 53.44 49.79 3ic9 n ALA 266 Cb 0.44 -0.56 0.19 0.00 0.00 0.00 0.00 19.45 19.52 3ic9 n ALA 266 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3ic9 n THR 267 N -0.57 3.11 -0.20 0.00 -2.24 -1.17 0.56 114.28 113.76 3ic9 n THR 267 Ca 0.31 -2.04 0.00 0.00 -2.27 0.00 0.00 64.05 60.05 3ic9 n THR 267 Cb 0.85 -0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.64 3ic9 n THR 267 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ic9 n GLY 268 N -1.11 -1.83 3.82 3.38 0.00 -1.26 -4.67 105.19 103.52 3ic9 n GLY 268 Ca 0.55 -1.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.26 3ic9 n GLY 268 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ic9 s ARG 269 N -3.53 3.15 -0.16 1.61 0.52 -1.26 -3.68 118.95 115.60 3ic9 s ARG 269 Ca 0.00 1.04 -0.02 0.00 -0.52 0.00 0.00 55.73 56.23 3ic9 s ARG 269 Cb 0.00 -2.02 -0.01 0.00 0.52 0.00 0.00 34.95 33.44 3ic9 s ARG 269 CO 0.00 -0.93 -0.09 0.21 0.02 0.00 0.00 175.30 174.51 3ic9 s LYS 270 N -4.64 3.44 0.29 3.54 2.20 -0.06 -4.86 119.74 119.65 3ic9 s LYS 270 Ca 0.60 -0.64 -0.30 0.00 -0.36 0.00 0.00 55.97 55.28 3ic9 s LYS 270 Cb -0.14 -2.79 -0.10 0.00 -1.51 0.00 0.00 37.83 33.28 3ic9 s LYS 270 CO 0.47 0.10 1.46 0.00 -0.36 0.00 0.00 175.35 177.01 3ic9 s ALA 271 N 0.68 3.62 -1.38 3.13 0.00 -1.26 -0.87 121.76 125.69 3ic9 s ALA 271 Ca -0.05 1.40 -0.14 0.00 0.00 0.00 0.00 51.96 53.18 3ic9 s ALA 271 Cb -0.15 -3.57 0.08 0.00 0.00 0.00 0.00 23.12 19.48 3ic9 s ALA 271 CO 0.02 -0.81 2.02 0.09 0.00 0.00 0.00 175.76 177.07 3ic9 n ASN 272 N 1.83 4.42 0.00 0.00 5.03 -0.29 -4.26 115.26 121.98 3ic9 n ASN 272 Ca 0.05 -2.92 0.00 0.00 0.87 0.00 0.00 54.58 52.58 3ic9 n ASN 272 Cb 0.40 -1.63 0.00 0.00 -1.02 0.00 0.00 39.78 37.53 3ic9 n ASN 272 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.26 176.76 3ic9 n VAL 273 N 4.88 0.29 0.57 2.41 0.24 -1.26 -4.74 118.33 120.71 3ic9 n VAL 273 Ca 0.48 -0.34 0.11 0.00 -2.04 0.00 0.00 64.34 62.55 3ic9 n VAL 273 Cb 0.40 1.00 -0.00 0.00 -1.47 0.00 0.00 33.84 33.76 3ic9 n VAL 273 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 3ic9 n ASP 274 N -0.15 0.60 -0.36 -1.34 5.75 -1.26 -4.35 116.55 115.44 3ic9 n ASP 274 Ca 0.00 -0.27 0.08 0.00 -0.01 0.00 0.00 54.79 54.59 3ic9 n ASP 274 Cb 0.35 0.90 0.18 0.00 -1.03 0.00 0.00 41.12 41.51 3ic9 n ASP 274 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3ic9 n LYS 275 N -1.94 1.49 -0.03 0.11 4.01 -1.26 -4.70 118.16 115.85 3ic9 n LYS 275 Ca 0.02 -2.90 0.12 0.00 -0.51 0.00 0.00 58.31 55.04 3ic9 n LYS 275 Cb 0.44 -1.58 0.24 0.00 -0.51 0.00 0.00 35.03 33.62 3ic9 n LYS 275 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 3ic9 n LEU 276 N -1.26 2.60 -2.68 -0.35 4.77 -1.26 -4.85 117.00 113.97 3ic9 n LEU 276 Ca 0.18 -0.92 -0.17 0.00 -0.03 0.00 0.00 56.01 55.08 3ic9 n LEU 276 Cb 0.69 -0.04 0.06 0.00 -2.33 0.00 0.00 43.42 41.80 3ic9 n LEU 276 CO 0.00 0.46 0.17 0.61 -1.33 0.00 0.00 177.39 177.30 3ic9 n GLY 277 N 1.31 -0.11 0.18 -0.72 0.00 -1.26 0.58 105.19 105.17 3ic9 n GLY 277 Ca 0.16 -0.02 0.14 0.00 0.00 0.00 0.00 46.02 46.30 3ic9 n GLY 277 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3ic9 h LEU 278 N -1.89 0.00 -1.43 0.99 3.38 -1.86 -2.43 115.31 112.07 3ic9 h LEU 278 Ca -0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.57 3ic9 h LEU 278 Cb 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 3ic9 h LEU 278 CO 0.40 0.00 0.00 -0.33 0.09 0.00 0.00 178.44 178.60 3ic9 h GLU 279 N 0.00 0.00 -0.46 1.13 3.07 -1.92 -1.70 114.58 114.71 3ic9 h GLU 279 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3ic9 h GLU 279 Cb 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 3ic9 h GLU 279 CO 0.00 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.70 3ic9 n ASN 280 N -2.56 2.33 -4.34 1.42 3.02 -0.92 -4.87 115.26 109.35 3ic9 n ASN 280 Ca -0.00 -2.08 -0.18 0.00 -0.03 0.00 0.00 54.58 52.30 3ic9 n ASN 280 Cb 0.17 -0.32 -0.10 0.00 -0.61 0.00 0.00 39.78 38.92 3ic9 n ASN 280 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3ic9 s THR 281 N -1.54 1.03 -1.41 3.41 -4.23 -0.64 -4.07 115.64 108.19 3ic9 s THR 281 Ca 0.27 -2.03 0.11 0.00 -1.18 0.00 0.00 61.69 58.85 3ic9 s THR 281 Cb 0.15 -2.41 0.40 0.00 1.34 0.00 0.00 72.50 71.98 3ic9 s THR 281 CO 0.17 -0.27 1.26 -1.54 -0.54 0.00 0.00 174.62 173.69 3ic9 n SER 282 N -0.45 2.79 -4.68 3.99 3.41 -1.26 -4.95 113.62 112.48 3ic9 n SER 282 Ca -0.04 -2.21 -0.46 0.00 -0.26 0.00 0.00 58.87 55.90 3ic9 n SER 282 Cb 0.64 -0.41 -0.04 0.00 -0.26 0.00 0.00 64.21 64.14 3ic9 n SER 282 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3ic9 n ILE 283 N 0.56 0.58 -2.37 -1.33 5.41 -1.26 -4.82 119.36 116.12 3ic9 n ILE 283 Ca 0.14 -0.10 -0.41 0.00 1.00 0.00 0.00 62.75 63.38 3ic9 n ILE 283 Cb 0.52 -2.02 -0.03 0.00 -0.71 0.00 0.00 39.64 37.40 3ic9 n ILE 283 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 3ic9 s GLU 284 N 3.86 4.48 0.14 0.38 2.02 -1.26 -4.97 118.70 123.35 3ic9 s GLU 284 Ca 0.90 1.87 0.09 0.00 0.02 0.00 0.00 54.97 57.85 3ic9 s GLU 284 Cb -0.59 -3.25 -0.04 0.00 0.10 0.00 0.00 34.13 30.35 3ic9 s GLU 284 CO 0.46 -0.13 -0.17 -0.51 0.02 0.00 0.00 175.26 174.94 3ic9 s LEU 285 N -0.02 2.74 0.87 1.80 1.02 -1.26 -0.65 118.68 123.17 3ic9 s LEU 285 Ca 0.54 -0.61 -0.10 0.00 0.02 0.00 0.00 54.13 53.98 3ic9 s LEU 285 Cb -0.32 -1.52 0.17 0.00 0.02 0.00 0.00 46.19 44.53 3ic9 s LEU 285 CO 0.35 0.15 1.19 1.51 0.02 0.00 0.00 176.35 179.58 3ic9 s ASP 286 N -2.40 3.62 0.53 2.29 1.47 0.30 -4.83 116.67 117.65 3ic9 s ASP 286 Ca 0.20 0.05 0.36 0.00 1.18 0.00 0.00 52.55 54.33 3ic9 s ASP 286 Cb -0.10 -0.23 1.92 0.00 -0.34 0.00 0.00 42.92 44.17 3ic9 s ASP 286 CO 0.11 -2.38 2.09 0.07 0.68 0.00 0.00 175.17 175.75 3ic9 h LYS 287 N -1.21 0.00 -0.48 2.11 2.10 -2.01 0.21 116.57 117.30 3ic9 h LYS 287 Ca -0.41 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.22 3ic9 h LYS 287 Cb 1.25 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.57 3ic9 h LYS 287 CO 0.40 0.00 0.02 1.63 -2.00 0.00 0.00 179.45 179.49 3ic9 n LYS 288 N -2.76 4.13 -1.76 0.07 4.01 -1.26 -4.96 118.16 115.63 3ic9 n LYS 288 Ca -0.02 -3.06 -0.21 0.00 -0.51 0.00 0.00 58.31 54.51 3ic9 n LYS 288 Cb 0.07 -2.12 -0.07 0.00 -0.51 0.00 0.00 35.03 32.39 3ic9 n LYS 288 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 3ic9 n ASN 289 N 0.16 -5.60 -4.72 4.39 5.03 0.74 -4.99 115.26 110.27 3ic9 n ASN 289 Ca 0.27 0.41 -0.41 0.00 0.87 0.00 0.00 54.58 55.71 3ic9 n ASN 289 Cb 1.11 -4.87 -0.04 0.00 -1.02 0.00 0.00 39.78 34.96 3ic9 n ASN 289 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 3ic9 s SER 290 N -2.64 7.40 0.24 6.41 0.01 -1.26 -4.77 113.70 119.10 3ic9 s SER 290 Ca 0.00 1.68 -0.31 0.00 1.31 0.00 0.00 55.95 58.63 3ic9 s SER 290 Cb 0.00 -2.56 -0.11 0.00 0.21 0.00 0.00 66.02 63.56 3ic9 s SER 290 CO 0.00 -0.12 1.62 -2.84 0.41 0.00 0.00 173.24 172.30 3ic9 s PRO 291 N 0.36 4.15 0.41 12.44 0.02 -1.26 -0.54 135.00 150.58 3ic9 s PRO 291 Ca 0.47 2.53 -0.24 0.00 0.02 0.00 0.00 61.00 63.78 3ic9 s PRO 291 Cb -0.22 -3.07 -0.08 0.00 0.02 0.00 0.00 34.50 31.15 3ic9 s PRO 291 CO 0.28 -0.65 1.15 -0.51 -0.33 0.00 0.00 177.00 176.95 3ic9 s LEU 292 N 0.27 4.14 0.03 -5.54 1.43 0.18 -4.85 118.68 114.34 3ic9 s LEU 292 Ca 0.67 2.30 -0.24 0.00 -1.03 0.00 0.00 54.13 55.83 3ic9 s LEU 292 Cb -0.47 -4.09 0.06 0.00 0.03 0.00 0.00 46.19 41.71 3ic9 s LEU 292 CO 0.40 -0.72 0.55 0.72 0.23 0.00 0.00 176.35 177.54 3ic9 s PHE 293 N -1.47 -0.48 -0.26 0.29 -0.12 -1.26 -3.94 117.98 110.74 3ic9 s PHE 293 Ca 0.59 0.62 -0.29 0.00 -0.05 0.00 0.00 56.93 57.79 3ic9 s PHE 293 Cb -0.29 0.36 0.01 0.00 -0.63 0.00 0.00 43.02 42.47 3ic9 s PHE 293 CO 0.36 -0.63 1.11 0.34 -0.05 0.00 0.00 175.22 176.35 3ic9 s ASP 294 N -1.79 6.97 0.59 1.98 -1.08 0.69 -4.91 116.67 119.12 3ic9 s ASP 294 Ca -0.07 1.28 0.37 0.00 -0.52 0.00 0.00 52.55 53.61 3ic9 s ASP 294 Cb -0.01 -2.54 1.69 0.00 -1.46 0.00 0.00 42.92 40.60 3ic9 s ASP 294 CO 0.01 -0.81 2.10 -0.33 0.52 0.00 0.00 175.17 176.66 3ic9 h GLU 295 N 8.01 0.00 0.11 4.34 5.08 -1.95 0.65 114.58 130.81 3ic9 h GLU 295 Ca -0.21 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 57.79 3ic9 h GLU 295 Cb 1.07 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.30 3ic9 h GLU 295 CO 1.01 0.00 -1.95 1.28 -1.00 0.00 0.00 179.01 178.34 3ic9 n LEU 296 N -3.09 2.58 0.00 1.33 4.77 -1.26 -4.48 117.00 116.85 3ic9 n LEU 296 Ca -0.01 0.22 0.11 0.00 -0.03 0.00 0.00 56.01 56.30 3ic9 n LEU 296 Cb 0.23 -1.10 -0.10 0.00 -2.33 0.00 0.00 43.42 40.13 3ic9 n LEU 296 CO 0.25 0.80 -0.31 0.35 -1.33 0.00 0.00 177.39 177.15 3ic9 n THR 297 N -3.57 0.05 -1.07 -5.08 -2.24 -1.14 -1.57 114.28 99.66 3ic9 n THR 297 Ca -0.33 -0.26 -0.02 0.00 -2.27 0.00 0.00 64.05 61.17 3ic9 n THR 297 Cb 1.01 0.40 -0.01 0.00 -2.10 0.00 0.00 70.33 69.63 3ic9 n THR 297 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3ic9 n LEU 298 N -1.92 0.48 -4.75 3.22 4.77 0.22 -4.67 117.00 114.35 3ic9 n LEU 298 Ca 0.00 0.06 -0.41 0.00 -0.03 0.00 0.00 56.01 55.63 3ic9 n LEU 298 Cb 0.45 -2.04 -0.04 0.00 -2.33 0.00 0.00 43.42 39.46 3ic9 n LEU 298 CO 0.43 -0.76 0.84 -1.10 -1.33 0.00 0.00 177.39 175.47 3ic9 s GLN 299 N -1.76 4.55 0.41 3.23 -0.21 -1.25 -1.14 119.66 123.50 3ic9 s GLN 299 Ca 0.00 1.85 -0.07 0.00 0.02 0.00 0.00 55.36 57.16 3ic9 s GLN 299 Cb 0.00 -3.22 0.10 0.00 1.00 0.00 0.00 33.01 30.89 3ic9 s GLN 299 CO 0.00 0.04 0.47 0.25 -2.12 0.00 0.00 175.29 173.93 3ic9 n THR 300 N 1.89 0.00 0.25 -0.19 -2.24 -0.18 -0.22 114.28 113.60 3ic9 n THR 300 Ca 0.02 -0.29 0.14 0.00 -2.27 0.00 0.00 64.05 61.65 3ic9 n THR 300 Cb 0.45 -1.50 0.82 0.00 -2.10 0.00 0.00 70.33 68.00 3ic9 n THR 300 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3ic9 h SER 301 N -1.10 0.00 -3.53 3.42 4.64 -1.87 -3.36 113.55 111.74 3ic9 h SER 301 Ca -0.16 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.54 3ic9 h SER 301 Cb 0.46 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.43 3ic9 h SER 301 CO 0.11 0.00 0.16 -0.69 -0.87 0.00 0.00 176.83 175.54 3ic9 s VAL 302 N -4.76 4.92 -0.92 0.95 1.01 -1.26 -4.96 120.40 115.39 3ic9 s VAL 302 Ca -0.05 0.83 0.24 0.00 0.00 0.00 0.00 61.98 63.00 3ic9 s VAL 302 Cb 0.16 -4.02 0.21 0.00 0.00 0.00 0.00 36.38 32.73 3ic9 s VAL 302 CO 0.59 -0.17 1.75 -0.90 0.00 0.00 0.00 175.10 176.36 3ic9 n ASP 303 N 5.92 0.16 -0.98 3.32 5.75 -1.26 -1.80 116.55 127.65 3ic9 n ASP 303 Ca -0.01 0.52 0.09 0.00 -0.01 0.00 0.00 54.79 55.39 3ic9 n ASP 303 Cb 0.49 -0.56 0.21 0.00 -1.03 0.00 0.00 41.12 40.23 3ic9 n ASP 303 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3ic9 n HIS 304 N -1.66 0.59 -4.32 2.11 1.44 -1.26 -4.87 115.22 107.25 3ic9 n HIS 304 Ca 0.05 -0.39 -0.32 0.00 -2.01 0.00 0.00 57.72 55.05 3ic9 n HIS 304 Cb 0.29 -0.01 -0.16 0.00 0.12 0.00 0.00 29.99 30.23 3ic9 n HIS 304 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 3ic9 s ILE 305 N -1.11 2.00 0.25 0.61 1.01 -0.75 -1.07 121.20 122.14 3ic9 s ILE 305 Ca 0.34 -0.92 0.09 0.00 0.00 0.00 0.00 60.65 60.17 3ic9 s ILE 305 Cb 0.19 -1.79 -0.04 0.00 0.01 0.00 0.00 42.46 40.82 3ic9 s ILE 305 CO 0.25 0.53 0.00 -0.36 0.00 0.00 0.00 174.94 175.37 3ic9 s PHE 306 N 1.12 2.73 -0.06 3.97 0.08 0.58 -1.01 117.98 125.40 3ic9 s PHE 306 Ca 0.00 -0.21 -0.00 0.00 0.12 0.00 0.00 56.93 56.84 3ic9 s PHE 306 Cb -0.14 -1.23 0.03 0.00 -0.57 0.00 0.00 43.02 41.11 3ic9 s PHE 306 CO -0.08 0.60 -0.02 0.54 -0.10 0.00 0.00 175.22 176.16 3ic9 s VAL 307 N -2.22 0.44 0.01 -0.44 0.11 -0.29 -0.35 120.40 117.66 3ic9 s VAL 307 Ca 0.31 0.01 0.02 0.00 -2.93 0.00 0.00 61.98 59.38 3ic9 s VAL 307 Cb -0.07 -0.54 -0.01 0.00 -1.53 0.00 0.00 36.38 34.24 3ic9 s VAL 307 CO 0.20 0.24 -0.05 0.00 -3.33 0.00 0.00 175.10 172.15 3ic9 s ALA 308 N 1.45 0.43 0.00 1.54 0.00 0.16 -4.71 121.76 120.62 3ic9 s ALA 308 Ca -0.03 -0.38 0.00 0.00 0.00 0.00 0.00 51.96 51.55 3ic9 s ALA 308 Cb -0.13 -0.05 0.00 0.00 0.00 0.00 0.00 23.12 22.94 3ic9 s ALA 308 CO -0.03 0.05 0.00 0.41 0.00 0.00 0.00 175.76 176.19 3ic9 n GLY 309 N 2.47 -0.35 0.28 0.00 0.00 -1.26 -3.81 105.19 102.51 3ic9 n GLY 309 Ca -0.16 -1.22 0.16 0.00 0.00 0.00 0.00 46.02 44.80 3ic9 n GLY 309 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3ic9 h ASP 310 N 6.88 0.00 -0.94 1.61 5.19 -1.86 -2.92 116.42 124.38 3ic9 h ASP 310 Ca 0.00 0.00 0.21 0.00 -0.62 0.00 0.00 57.03 56.62 3ic9 h ASP 310 Cb 0.00 0.00 -0.08 0.00 0.18 0.00 0.00 39.33 39.43 3ic9 h ASP 310 CO 0.00 0.08 0.61 0.00 -3.12 0.00 0.00 179.24 176.81 3ic9 h ALA 311 N 1.92 2.12 -0.30 3.45 0.00 -1.66 0.20 119.26 125.00 3ic9 h ALA 311 Ca -0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3ic9 h ALA 311 Cb 0.35 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3ic9 h ALA 311 CO 0.01 -0.43 0.00 0.27 0.00 0.00 0.00 179.25 179.10 3ic9 n ASN 312 N -4.56 1.74 -2.26 0.00 0.23 -1.10 -4.68 115.26 104.62 3ic9 n ASN 312 Ca 0.21 -1.94 -0.16 0.00 -0.53 0.00 0.00 54.58 52.15 3ic9 n ASN 312 Cb 0.69 -0.20 -0.02 0.00 -2.08 0.00 0.00 39.78 38.18 3ic9 n ASN 312 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 3ic9 n ASN 313 N 0.43 -4.70 -3.97 0.53 5.15 0.69 -4.94 115.26 108.45 3ic9 n ASN 313 Ca 0.12 0.15 -0.13 0.00 -0.60 0.00 0.00 54.58 54.12 3ic9 n ASN 313 Cb 0.29 -4.00 -0.13 0.00 -0.53 0.00 0.00 39.78 35.41 3ic9 n ASN 313 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 3ic9 s THR 314 N -2.73 0.30 -1.04 -0.44 2.01 -1.26 -4.87 115.64 107.61 3ic9 s THR 314 Ca 0.00 -0.52 -0.26 0.00 0.31 0.00 0.00 61.69 61.22 3ic9 s THR 314 Cb 0.00 -0.32 0.04 0.00 0.01 0.00 0.00 72.50 72.22 3ic9 s THR 314 CO 0.00 -0.15 0.60 0.18 -0.69 0.00 0.00 174.62 174.56 3ic9 n LEU 315 N 2.34 -0.41 -3.80 4.42 4.77 -1.26 -4.75 117.00 118.31 3ic9 n LEU 315 Ca -0.17 -1.14 -0.42 0.00 -0.03 0.00 0.00 56.01 54.24 3ic9 n LEU 315 Cb 0.57 -1.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.22 3ic9 n LEU 315 CO 0.23 0.69 2.25 0.35 -1.33 0.00 0.00 177.39 179.58 3ic9 n THR 316 N -4.27 4.00 -4.10 -5.08 -2.24 -1.26 -4.37 114.28 96.95 3ic9 n THR 316 Ca -0.14 -3.84 -0.11 0.00 -2.27 0.00 0.00 64.05 57.68 3ic9 n THR 316 Cb 0.54 -2.46 -0.11 0.00 -2.10 0.00 0.00 70.33 66.21 3ic9 n THR 316 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3ic9 s LEU 317 N 0.76 2.39 0.07 3.22 1.02 -1.26 -5.04 118.68 119.84 3ic9 s LEU 317 Ca 0.43 -0.79 -0.33 0.00 0.02 0.00 0.00 54.13 53.46 3ic9 s LEU 317 Cb 0.11 -0.06 -0.18 0.00 0.02 0.00 0.00 46.19 46.08 3ic9 s LEU 317 CO -0.03 -0.37 1.62 0.25 0.02 0.00 0.00 176.35 177.84 3ic9 h LEU 318 N 3.72 -0.80 -1.80 1.79 7.12 -1.99 -0.04 115.31 123.32 3ic9 h LEU 318 Ca -0.35 0.03 -0.03 0.00 0.13 0.00 0.00 57.88 57.66 3ic9 h LEU 318 Cb 1.18 0.21 -0.00 0.00 -0.53 0.00 0.00 40.66 41.52 3ic9 h LEU 318 CO 0.54 -0.55 -0.15 1.12 -0.13 0.00 0.00 178.44 179.26 3ic9 h HIS 319 N -0.91 0.00 -0.18 1.25 2.07 -1.98 -1.06 115.15 114.35 3ic9 h HIS 319 Ca -0.09 0.00 -0.21 0.00 -2.85 0.00 0.00 60.37 57.22 3ic9 h HIS 319 Cb 0.70 0.00 0.01 0.00 2.57 0.00 0.00 27.41 30.69 3ic9 h HIS 319 CO -0.04 0.15 -0.73 0.93 -3.07 0.00 0.00 177.93 175.17 3ic9 h GLU 320 N 0.00 0.78 -0.98 5.12 4.39 -1.77 -2.54 114.58 119.58 3ic9 h GLU 320 Ca -0.00 -0.61 0.10 0.00 0.34 0.00 0.00 59.36 59.19 3ic9 h GLU 320 Cb 0.30 0.12 -0.07 0.00 -0.10 0.00 0.00 28.75 28.99 3ic9 h GLU 320 CO 0.02 1.22 0.63 0.00 -1.16 0.00 0.00 179.01 179.72 3ic9 h ALA 321 N 0.62 1.51 -0.08 3.43 0.00 -0.35 0.19 119.26 124.57 3ic9 h ALA 321 Ca -0.04 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.88 3ic9 h ALA 321 Cb 1.35 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 3ic9 h ALA 321 CO 0.15 0.29 0.03 0.00 0.00 0.00 0.00 179.25 179.72 3ic9 h ALA 322 N 1.52 0.09 -0.82 0.00 0.00 -1.08 -0.74 119.26 118.22 3ic9 h ALA 322 Ca 0.46 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.35 3ic9 h ALA 322 Cb 0.37 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 3ic9 h ALA 322 CO -0.22 -0.43 0.43 -0.44 0.00 0.00 0.00 179.25 178.59 3ic9 h ASP 323 N 0.08 1.05 -0.57 0.00 3.32 -1.03 -1.65 116.42 117.62 3ic9 h ASP 323 Ca 0.03 -0.11 0.10 0.00 0.02 0.00 0.00 57.03 57.07 3ic9 h ASP 323 Cb 0.01 -0.27 -0.08 0.00 0.22 0.00 0.00 39.33 39.22 3ic9 h ASP 323 CO -0.03 0.86 0.15 0.44 -1.72 0.00 0.00 179.24 178.94 3ic9 h ASP 324 N 1.15 0.07 -0.59 6.45 5.19 -0.47 0.53 116.42 128.74 3ic9 h ASP 324 Ca 0.29 0.10 -0.02 0.00 -0.62 0.00 0.00 57.03 56.77 3ic9 h ASP 324 Cb 0.07 0.12 -0.03 0.00 0.18 0.00 0.00 39.33 39.67 3ic9 h ASP 324 CO -0.04 0.05 0.28 1.23 -3.12 0.00 0.00 179.24 177.64 3ic9 h GLY 325 N 0.29 0.92 0.77 2.75 0.00 -0.46 0.58 103.07 107.93 3ic9 h GLY 325 Ca 0.29 -0.46 0.03 0.00 0.00 0.00 0.00 47.33 47.19 3ic9 h GLY 325 CO -0.35 0.44 0.14 1.70 0.00 0.00 0.00 176.54 178.46 3ic9 h LYS 326 N 0.81 0.29 -0.07 4.80 1.63 -0.92 0.22 116.57 123.33 3ic9 h LYS 326 Ca 0.20 -0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 59.97 3ic9 h LYS 326 Cb 0.12 -0.07 -0.00 0.00 -0.60 0.00 0.00 32.23 31.69 3ic9 h LYS 326 CO -0.03 0.19 -0.01 0.28 -3.45 0.00 0.00 179.45 176.44 3ic9 h VAL 327 N 0.30 1.27 -0.38 2.00 2.07 -0.43 -2.12 116.25 118.95 3ic9 h VAL 327 Ca 0.15 -0.84 -0.07 0.00 0.82 0.00 0.00 66.70 66.76 3ic9 h VAL 327 Cb 0.09 1.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 3ic9 h VAL 327 CO -0.13 0.23 -0.04 0.00 0.02 0.00 0.00 177.57 177.66 3ic9 h ALA 328 N 0.70 0.52 -0.75 1.67 0.00 -0.88 -1.83 119.26 118.69 3ic9 h ALA 328 Ca 0.02 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 3ic9 h ALA 328 Cb 0.37 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 3ic9 h ALA 328 CO 0.00 0.33 0.42 0.78 0.00 0.00 0.00 179.25 180.79 3ic9 h GLY 329 N 0.51 1.12 0.84 0.00 0.00 -1.00 0.20 103.07 104.74 3ic9 h GLY 329 Ca 0.10 -0.50 -0.03 0.00 0.00 0.00 0.00 47.33 46.91 3ic9 h GLY 329 CO 0.03 0.48 0.03 -0.84 0.00 0.00 0.00 176.54 176.23 3ic9 h THR 330 N 1.04 1.23 -0.24 4.70 2.02 -1.23 0.24 112.91 120.68 3ic9 h THR 330 Ca 0.27 -0.78 -0.16 0.00 0.77 0.00 0.00 66.41 66.51 3ic9 h THR 330 Cb 0.02 1.33 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 3ic9 h THR 330 CO -0.04 0.24 -0.47 0.78 0.37 0.00 0.00 175.52 176.40 3ic9 h ASN 331 N 0.15 0.82 -0.42 4.18 2.35 -1.23 0.14 115.58 121.57 3ic9 h ASN 331 Ca 0.06 -0.54 -0.03 0.00 -0.55 0.00 0.00 56.30 55.24 3ic9 h ASN 331 Cb 0.34 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.45 3ic9 h ASN 331 CO 0.01 1.21 0.15 0.00 -1.65 0.00 0.00 177.43 177.14 3ic9 h ALA 332 N 0.63 0.55 -0.55 -0.83 0.00 -0.61 -0.22 119.26 118.23 3ic9 h ALA 332 Ca 0.01 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3ic9 h ALA 332 Cb 1.07 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 3ic9 h ALA 332 CO 0.10 0.18 0.32 0.78 0.00 0.00 0.00 179.25 180.63 3ic9 h GLY 333 N 0.53 0.80 -1.76 0.00 0.00 -0.37 -3.25 103.07 99.03 3ic9 h GLY 333 Ca 0.14 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.12 3ic9 h GLY 333 CO -0.01 0.33 0.00 0.00 0.00 0.00 0.00 176.54 176.87 3ic9 n ALA 334 N -2.28 2.47 -1.54 3.60 0.00 0.48 -4.62 120.51 118.61 3ic9 n ALA 334 Ca 0.03 -0.73 -0.49 0.00 0.00 0.00 0.00 53.44 52.25 3ic9 n ALA 334 Cb 0.07 -0.89 -0.04 0.00 0.00 0.00 0.00 19.45 18.58 3ic9 n ALA 334 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 3ic9 n TYR 335 N 1.16 0.92 1.57 0.00 9.36 -0.10 -1.25 117.16 128.82 3ic9 n TYR 335 Ca 0.16 0.77 0.11 0.00 3.32 0.00 0.00 57.90 62.26 3ic9 n TYR 335 Cb 0.55 -2.20 0.49 0.00 -0.63 0.00 0.00 39.34 37.55 3ic9 n TYR 335 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 3ic9 n PRO 336 N 1.42 1.43 -2.41 2.98 -0.04 -1.26 -5.06 135.00 132.05 3ic9 n PRO 336 Ca 0.15 -0.64 -0.43 0.00 -0.04 0.00 0.00 63.50 62.54 3ic9 n PRO 336 Cb 0.24 -1.37 -0.02 0.00 -0.04 0.00 0.00 33.50 32.31 3ic9 n PRO 336 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3ic9 s VAL 337 N -1.90 4.01 -0.05 0.52 1.01 -0.38 -4.99 120.40 118.62 3ic9 s VAL 337 Ca 0.32 1.05 0.05 0.00 0.00 0.00 0.00 61.98 63.40 3ic9 s VAL 337 Cb 0.16 -4.27 -0.02 0.00 0.00 0.00 0.00 36.38 32.25 3ic9 s VAL 337 CO 0.26 -0.75 -0.19 -0.63 0.00 0.00 0.00 175.10 173.80 3ic9 s ILE 338 N 5.04 2.67 0.18 2.22 -1.09 -1.26 -4.62 121.20 124.34 3ic9 s ILE 338 Ca 0.58 -0.86 0.08 0.00 -2.23 0.00 0.00 60.65 58.21 3ic9 s ILE 338 Cb -0.13 -2.02 -0.04 0.00 -1.58 0.00 0.00 42.46 38.69 3ic9 s ILE 338 CO 0.30 0.58 -0.17 0.00 -1.23 0.00 0.00 174.94 174.43 3ic9 s ALA 339 N -0.57 1.97 -0.24 9.38 0.00 -1.26 -5.13 121.76 125.92 3ic9 s ALA 339 Ca 0.08 -1.53 -0.12 0.00 0.00 0.00 0.00 51.96 50.39 3ic9 s ALA 339 Cb -0.11 -0.14 -0.05 0.00 0.00 0.00 0.00 23.12 22.82 3ic9 s ALA 339 CO 0.01 0.17 0.21 -0.65 0.00 0.00 0.00 175.76 175.49 3ic9 s GLN 340 N -3.08 4.07 0.30 0.00 -0.21 -1.26 -4.45 119.66 115.02 3ic9 s GLN 340 Ca 0.18 -0.19 -0.29 0.00 0.02 0.00 0.00 55.36 55.07 3ic9 s GLN 340 Cb -0.04 -3.56 -0.10 0.00 1.00 0.00 0.00 33.01 30.31 3ic9 s GLN 340 CO 0.06 -0.00 1.39 0.20 -2.12 0.00 0.00 175.29 174.82 3ic9 s GLY 341 N 1.18 2.68 -0.50 3.09 0.00 -0.61 -4.99 107.32 108.17 3ic9 s GLY 341 Ca 0.10 1.33 -0.15 0.00 0.00 0.00 0.00 44.72 45.99 3ic9 s GLY 341 CO 0.06 2.13 0.44 1.62 0.00 0.00 0.00 173.10 177.35 3ic9 s GLN 342 N -1.16 2.95 0.49 2.90 0.74 -1.26 -4.86 119.66 119.46 3ic9 s GLN 342 Ca 0.54 -1.55 -0.21 0.00 0.05 0.00 0.00 55.36 54.19 3ic9 s GLN 342 Cb -0.41 -4.19 -0.07 0.00 1.10 0.00 0.00 33.01 29.44 3ic9 s GLN 342 CO 0.50 -1.18 1.13 1.03 -0.55 0.00 0.00 175.29 176.22 3ic9 s ARG 343 N 1.60 3.62 0.71 1.67 1.81 -1.26 -5.01 118.95 122.09 3ic9 s ARG 343 Ca 0.04 1.66 -0.14 0.00 -1.72 0.00 0.00 55.73 55.57 3ic9 s ARG 343 Cb -0.27 -2.23 0.03 0.00 -0.45 0.00 0.00 34.95 32.03 3ic9 s ARG 343 CO 0.04 -0.64 1.13 1.03 -0.68 0.00 0.00 175.30 176.18 3ic9 s ARG 344 N -2.96 2.45 0.16 3.54 0.52 -1.26 -4.95 118.95 116.45 3ic9 s ARG 344 Ca 0.67 1.43 -0.34 0.00 -0.52 0.00 0.00 55.73 56.97 3ic9 s ARG 344 Cb -0.25 -1.90 -0.14 0.00 0.52 0.00 0.00 34.95 33.17 3ic9 s ARG 344 CO 0.30 -1.53 1.53 0.00 0.02 0.00 0.00 175.30 175.62 3ic9 n ALA 345 N -2.81 1.02 -1.64 2.13 0.00 -1.26 -4.87 120.51 113.09 3ic9 n ALA 345 Ca 0.11 0.45 -0.45 0.00 0.00 0.00 0.00 53.44 53.55 3ic9 n ALA 345 Cb 0.52 -2.31 -0.02 0.00 0.00 0.00 0.00 19.45 17.64 3ic9 n ALA 345 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3ic9 n PRO 346 N 3.16 1.72 -3.67 0.00 -0.02 -1.26 -4.78 135.00 130.15 3ic9 n PRO 346 Ca 0.17 0.61 -0.13 0.00 -2.02 0.00 0.00 63.50 62.13 3ic9 n PRO 346 Cb 0.28 -2.17 -0.13 0.00 -0.02 0.00 0.00 33.50 31.46 3ic9 n PRO 346 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3ic9 s LEU 347 N 0.14 -0.24 0.04 2.45 2.96 -1.26 -0.84 118.68 121.94 3ic9 s LEU 347 Ca 0.66 0.65 0.03 0.00 -0.22 0.00 0.00 54.13 55.25 3ic9 s LEU 347 Cb -0.70 0.82 -0.02 0.00 0.50 0.00 0.00 46.19 46.80 3ic9 s LEU 347 CO 0.54 -0.23 -0.10 -0.94 -1.32 0.00 0.00 176.35 174.30 3ic9 s SER 348 N 2.24 1.18 -0.01 3.68 1.04 -0.56 -5.01 113.70 116.26 3ic9 s SER 348 Ca -0.01 -0.50 0.03 0.00 0.48 0.00 0.00 55.95 55.95 3ic9 s SER 348 Cb -0.12 -0.02 -0.00 0.00 0.10 0.00 0.00 66.02 65.98 3ic9 s SER 348 CO -0.09 -0.10 -0.09 -0.69 0.98 0.00 0.00 173.24 173.25 3ic9 s VAL 349 N -1.11 0.71 -0.16 5.02 1.01 -1.26 -1.47 120.40 123.14 3ic9 s VAL 349 Ca -0.05 -0.36 -0.02 0.00 0.00 0.00 0.00 61.98 61.56 3ic9 s VAL 349 Cb -0.09 -0.62 -0.01 0.00 0.00 0.00 0.00 36.38 35.66 3ic9 s VAL 349 CO 0.01 0.21 -0.09 -0.69 0.00 0.00 0.00 175.10 174.54 3ic9 s VAL 350 N -0.04 3.29 -0.58 2.92 1.01 0.13 -4.97 120.40 122.17 3ic9 s VAL 350 Ca 0.01 -0.56 -0.03 0.00 0.00 0.00 0.00 61.98 61.40 3ic9 s VAL 350 Cb -0.05 -2.43 0.19 0.00 0.00 0.00 0.00 36.38 34.08 3ic9 s VAL 350 CO -0.00 0.49 2.44 0.49 0.00 0.00 0.00 175.10 178.52 3ic9 n PHE 351 N 3.89 2.12 -2.29 5.22 3.72 -1.26 -1.51 117.46 127.35 3ic9 n PHE 351 Ca -0.18 -2.13 -0.26 0.00 -0.05 0.00 0.00 57.45 54.83 3ic9 n PHE 351 Cb 0.52 -1.29 0.15 0.00 -0.94 0.00 0.00 39.48 37.91 3ic9 n PHE 351 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3ic9 s THR 352 N -3.28 2.06 -0.15 4.37 -4.23 -1.26 -4.91 115.64 108.24 3ic9 s THR 352 Ca 0.55 -0.32 0.01 0.00 -1.18 0.00 0.00 61.69 60.74 3ic9 s THR 352 Cb 0.40 -2.74 0.02 0.00 1.34 0.00 0.00 72.50 71.52 3ic9 s THR 352 CO -0.25 0.00 -0.16 -0.70 -0.54 0.00 0.00 174.62 172.97 3ic9 s GLU 353 N -5.50 2.50 0.95 3.99 2.12 -1.26 -2.46 118.70 119.04 3ic9 s GLU 353 Ca 0.70 -0.64 -0.11 0.00 0.36 0.00 0.00 54.97 55.28 3ic9 s GLU 353 Cb -0.04 -2.22 0.17 0.00 0.26 0.00 0.00 34.13 32.29 3ic9 s GLU 353 CO 0.48 -0.21 1.12 -2.14 -0.54 0.00 0.00 175.26 173.97 3ic9 s PRO 354 N 1.37 0.74 0.62 4.30 0.02 -1.26 -4.94 135.00 135.85 3ic9 s PRO 354 Ca 0.04 1.36 -0.10 0.00 0.02 0.00 0.00 61.00 62.32 3ic9 s PRO 354 Cb -0.13 -1.71 -0.02 0.00 0.02 0.00 0.00 34.50 32.66 3ic9 s PRO 354 CO -0.10 -2.76 1.00 -0.65 -0.33 0.00 0.00 177.00 174.16 3ic9 s GLN 355 N -4.64 3.33 -0.08 5.54 -0.21 -0.96 -4.73 119.66 117.91 3ic9 s GLN 355 Ca 0.67 0.52 0.02 0.00 0.02 0.00 0.00 55.36 56.59 3ic9 s GLN 355 Cb -0.23 -2.13 -0.02 0.00 1.00 0.00 0.00 33.01 31.63 3ic9 s GLN 355 CO 0.59 -0.65 -0.14 0.08 -2.12 0.00 0.00 175.29 173.06 3ic9 s VAL 356 N -3.14 3.09 -0.01 1.09 1.01 -0.57 -1.42 120.40 120.44 3ic9 s VAL 356 Ca 0.55 -0.69 0.02 0.00 0.00 0.00 0.00 61.98 61.86 3ic9 s VAL 356 Cb -0.11 -2.24 -0.00 0.00 0.00 0.00 0.00 36.38 34.03 3ic9 s VAL 356 CO 0.51 0.57 -0.08 0.00 0.00 0.00 0.00 175.10 176.10 3ic9 s ALA 357 N -0.37 0.73 -0.04 5.51 0.00 -1.26 -0.70 121.76 125.63 3ic9 s ALA 357 Ca 0.04 -0.32 0.07 0.00 0.00 0.00 0.00 51.96 51.75 3ic9 s ALA 357 Cb -0.12 -0.24 -0.01 0.00 0.00 0.00 0.00 23.12 22.75 3ic9 s ALA 357 CO 0.02 0.14 -0.24 -1.12 0.00 0.00 0.00 175.76 174.57 3ic9 s SER 358 N 0.02 2.90 -0.01 0.00 0.01 -0.54 -4.32 113.70 111.75 3ic9 s SER 358 Ca 0.00 -0.47 0.01 0.00 1.31 0.00 0.00 55.95 56.81 3ic9 s SER 358 Cb -0.06 -0.60 0.00 0.00 0.21 0.00 0.00 66.02 65.58 3ic9 s SER 358 CO -0.00 0.26 -0.05 -0.69 0.41 0.00 0.00 173.24 173.17 3ic9 s VAL 359 N -0.32 0.40 0.00 3.43 1.01 -0.73 -1.50 120.40 122.69 3ic9 s VAL 359 Ca 0.02 -0.18 0.00 0.00 0.00 0.00 0.00 61.98 61.82 3ic9 s VAL 359 Cb -0.12 -0.37 0.00 0.00 0.00 0.00 0.00 36.38 35.89 3ic9 s VAL 359 CO 0.02 0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.86 3ic9 n GLY 360 N 3.23 1.18 3.76 4.51 0.00 -0.02 -1.02 105.19 116.84 3ic9 n GLY 360 Ca -0.16 -0.66 -0.41 0.00 0.00 0.00 0.00 46.02 44.78 3ic9 n GLY 360 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ic9 s LEU 361 N 0.00 4.39 0.83 0.99 1.43 -0.49 -4.55 118.68 121.29 3ic9 s LEU 361 Ca 0.00 2.72 -0.11 0.00 -1.03 0.00 0.00 54.13 55.70 3ic9 s LEU 361 Cb 0.00 -3.64 0.09 0.00 0.03 0.00 0.00 46.19 42.67 3ic9 s LEU 361 CO 0.00 -0.65 1.09 -0.94 0.23 0.00 0.00 176.35 176.08 3ic9 s SER 362 N -0.03 4.10 0.22 2.29 1.04 -1.26 -4.34 113.70 115.72 3ic9 s SER 362 Ca 0.54 1.49 -0.07 0.00 0.48 0.00 0.00 55.95 58.39 3ic9 s SER 362 Cb -0.41 -2.21 0.34 0.00 0.10 0.00 0.00 66.02 63.84 3ic9 s SER 362 CO 0.49 -2.24 1.75 0.25 0.98 0.00 0.00 173.24 174.47 3ic9 h LEU 363 N -1.28 0.29 -0.89 2.42 5.85 -1.94 -0.86 115.31 118.90 3ic9 h LEU 363 Ca -0.47 0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.37 3ic9 h LEU 363 Cb 1.27 0.05 -0.06 0.00 0.37 0.00 0.00 40.66 42.29 3ic9 h LEU 363 CO 0.56 0.15 0.57 0.03 -0.34 0.00 0.00 178.44 179.41 3ic9 h ARG 364 N 0.46 1.05 0.00 1.25 3.08 -1.96 -0.63 114.38 117.62 3ic9 h ARG 364 Ca 0.35 -0.06 -0.09 0.00 0.07 0.00 0.00 59.98 60.25 3ic9 h ARG 364 Cb 0.44 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 3ic9 h ARG 364 CO -0.33 0.69 -0.42 1.96 -1.07 0.00 0.00 179.97 180.81 3ic9 h GLN 365 N 1.08 0.00 -0.02 0.04 4.20 -1.75 -1.10 115.11 117.56 3ic9 h GLN 365 Ca 0.37 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.97 3ic9 h GLN 365 Cb 0.07 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.86 3ic9 h GLN 365 CO -0.14 0.42 -0.40 0.82 -0.67 0.00 0.00 178.83 178.86 3ic9 h ILE 366 N 0.00 1.48 -0.53 2.54 2.04 -0.46 -2.24 117.51 120.33 3ic9 h ILE 366 Ca -0.00 -1.95 -0.02 0.00 1.00 0.00 0.00 64.86 63.88 3ic9 h ILE 366 Cb 0.85 2.61 -0.03 0.00 -0.74 0.00 0.00 36.82 39.52 3ic9 h ILE 366 CO 0.05 0.55 0.23 -0.33 0.00 0.00 0.00 178.15 178.66 3ic9 h GLU 367 N -0.28 0.75 0.15 2.37 5.08 -0.98 -1.98 114.58 119.70 3ic9 h GLU 367 Ca -0.05 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 3ic9 h GLU 367 Cb 1.12 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.23 3ic9 h GLU 367 CO 0.08 0.60 -0.07 -0.44 -1.00 0.00 0.00 179.01 178.18 3ic9 h ASP 368 N 0.75 -0.17 -0.79 1.42 3.45 -1.25 -3.24 116.42 116.59 3ic9 h ASP 368 Ca 0.18 -0.12 0.22 0.00 0.43 0.00 0.00 57.03 57.75 3ic9 h ASP 368 Cb 0.12 0.04 -0.04 0.00 -0.56 0.00 0.00 39.33 38.89 3ic9 h ASP 368 CO -0.02 0.01 0.56 0.25 -1.57 0.00 0.00 179.24 178.47 3ic9 h LEU 369 N -0.34 0.07 -8.64 1.55 6.46 -0.72 -3.39 115.31 110.31 3ic9 h LEU 369 Ca -0.02 0.01 -0.66 0.00 -0.12 0.00 0.00 57.88 57.08 3ic9 h LEU 369 Cb 0.27 -0.01 -0.16 0.00 -0.73 0.00 0.00 40.66 40.03 3ic9 h LEU 369 CO 0.03 0.03 -0.07 -0.31 -0.62 0.00 0.00 178.44 177.50 3ic9 s TYR 370 N -5.07 3.15 0.24 1.25 2.02 -1.14 -4.94 117.35 112.86 3ic9 s TYR 370 Ca -0.06 -0.08 -0.07 0.00 -0.37 0.00 0.00 57.07 56.49 3ic9 s TYR 370 Cb 0.21 -3.01 0.41 0.00 -0.40 0.00 0.00 41.96 39.17 3ic9 s TYR 370 CO 0.76 -0.68 1.65 0.00 -1.57 0.00 0.00 175.55 175.72 3ic9 h ALA 371 N 8.66 0.79 -2.90 3.71 0.00 -1.87 -3.23 119.26 124.42 3ic9 h ALA 371 Ca -0.27 0.21 -0.71 0.00 0.00 0.00 0.00 54.91 54.14 3ic9 h ALA 371 Cb 1.11 0.34 -0.34 0.00 0.00 0.00 0.00 17.79 18.90 3ic9 h ALA 371 CO 0.81 -0.40 -0.11 0.16 0.00 0.00 0.00 179.25 179.71 3ic9 s ASP 372 N -5.21 5.96 0.52 0.00 3.84 -1.26 -4.92 116.67 115.60 3ic9 s ASP 372 Ca -0.13 -3.48 0.35 0.00 -0.00 0.00 0.00 52.55 49.29 3ic9 s ASP 372 Cb 0.21 -1.93 1.88 0.00 -1.38 0.00 0.00 42.92 41.70 3ic9 s ASP 372 CO 0.75 -0.25 2.07 1.56 -0.00 0.00 0.00 175.17 179.30 3ic9 h GLN 373 N 6.35 0.00 0.40 2.11 1.08 -1.87 -2.18 115.11 121.00 3ic9 h GLN 373 Ca 0.12 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.30 3ic9 h GLN 373 Cb 0.86 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.29 3ic9 h GLN 373 CO 0.83 0.00 -0.19 -0.44 -0.95 0.00 0.00 178.83 178.07 3ic9 h ASP 374 N 0.00 -0.46 0.00 1.46 3.45 -1.92 -3.31 116.42 115.64 3ic9 h ASP 374 Ca 0.00 -0.09 0.00 0.00 0.43 0.00 0.00 57.03 57.37 3ic9 h ASP 374 Cb 0.04 0.12 0.00 0.00 -0.56 0.00 0.00 39.33 38.92 3ic9 h ASP 374 CO 0.00 -0.03 0.04 0.00 -1.57 0.00 0.00 179.24 177.68 3ic9 n ALA 375 N -2.65 1.06 -3.25 3.45 0.00 -0.82 -4.87 120.51 113.43 3ic9 n ALA 375 Ca -0.09 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.18 3ic9 n ALA 375 Cb 0.27 -0.82 0.02 0.00 0.00 0.00 0.00 19.45 18.92 3ic9 n ALA 375 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ic9 n ALA 376 N -1.12 -2.34 -0.40 0.00 0.00 -1.22 -4.90 120.51 110.53 3ic9 n ALA 376 Ca 0.00 0.28 0.07 0.00 0.00 0.00 0.00 53.44 53.79 3ic9 n ALA 376 Cb 0.04 -1.54 0.21 0.00 0.00 0.00 0.00 19.45 18.16 3ic9 n ALA 376 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3ic9 n ASN 377 N 0.50 3.42 -4.22 0.00 3.02 -1.26 -4.92 115.26 111.80 3ic9 n ASN 377 Ca -0.03 -2.24 -0.16 0.00 -0.03 0.00 0.00 54.58 52.12 3ic9 n ASN 377 Cb 0.53 -0.35 -0.11 0.00 -0.61 0.00 0.00 39.78 39.24 3ic9 n ASN 377 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 3ic9 s TYR 378 N -1.44 1.27 0.30 3.10 -0.85 -1.26 -0.64 117.35 117.82 3ic9 s TYR 378 Ca 0.32 -0.62 0.11 0.00 -0.52 0.00 0.00 57.07 56.37 3ic9 s TYR 378 Cb 0.20 -0.67 -0.05 0.00 0.38 0.00 0.00 41.96 41.82 3ic9 s TYR 378 CO 0.17 0.09 -0.17 0.14 -1.52 0.00 0.00 175.55 174.26 3ic9 s VAL 379 N -2.46 2.44 -0.15 -3.49 -7.23 0.86 -4.77 120.40 105.59 3ic9 s VAL 379 Ca 0.09 -2.35 0.01 0.00 -1.81 0.00 0.00 61.98 57.92 3ic9 s VAL 379 Cb -0.03 -2.40 0.02 0.00 0.56 0.00 0.00 36.38 34.54 3ic9 s VAL 379 CO 0.02 -0.35 -0.17 -0.69 -0.31 0.00 0.00 175.10 173.59 3ic9 s VAL 380 N -2.53 1.78 -0.14 1.32 1.01 -1.26 -2.09 120.40 118.49 3ic9 s VAL 380 Ca 0.31 -0.77 -0.10 0.00 0.00 0.00 0.00 61.98 61.41 3ic9 s VAL 380 Cb -0.03 -1.63 -0.05 0.00 0.00 0.00 0.00 36.38 34.67 3ic9 s VAL 380 CO 0.15 0.49 0.20 -0.83 0.00 0.00 0.00 175.10 175.12 3ic9 s GLY 381 N 1.28 2.17 0.06 4.51 0.00 -0.64 -4.43 107.32 110.27 3ic9 s GLY 381 Ca 0.02 -0.57 0.05 0.00 0.00 0.00 0.00 44.72 44.22 3ic9 s GLY 381 CO -0.09 0.00 -0.14 1.20 0.00 0.00 0.00 173.10 174.07 3ic9 s GLN 382 N -0.32 0.86 -0.01 2.90 -0.21 -1.25 -1.00 119.66 120.64 3ic9 s GLN 382 Ca 0.14 -0.89 -0.04 0.00 0.02 0.00 0.00 55.36 54.60 3ic9 s GLN 382 Cb -0.12 -0.87 -0.00 0.00 1.00 0.00 0.00 33.01 33.01 3ic9 s GLN 382 CO 0.03 0.20 0.07 0.54 -2.12 0.00 0.00 175.29 174.02 3ic9 s VAL 383 N -1.12 0.06 -0.17 1.09 0.11 -0.84 -4.17 120.40 115.37 3ic9 s VAL 383 Ca -0.01 -0.48 -0.07 0.00 -2.93 0.00 0.00 61.98 58.50 3ic9 s VAL 383 Cb -0.09 -0.27 -0.04 0.00 -1.53 0.00 0.00 36.38 34.45 3ic9 s VAL 383 CO 0.02 -0.26 0.06 -0.55 -3.33 0.00 0.00 175.10 171.03 3ic9 s SER 384 N -0.84 5.62 0.00 3.54 0.15 -1.26 -1.66 113.70 119.24 3ic9 s SER 384 Ca -0.09 0.10 0.28 0.00 0.70 0.00 0.00 55.95 56.94 3ic9 s SER 384 Cb -0.06 -1.93 1.60 0.00 -1.71 0.00 0.00 66.02 63.93 3ic9 s SER 384 CO 0.00 0.21 2.00 0.49 1.20 0.00 0.00 173.24 177.13 3ic9 n PHE 385 N 3.33 0.00 0.06 3.44 3.72 -0.26 -3.76 117.46 124.00 3ic9 n PHE 385 Ca -0.17 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.20 3ic9 n PHE 385 Cb 0.52 -0.07 0.20 0.00 -0.94 0.00 0.00 39.48 39.20 3ic9 n PHE 385 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 3ic9 h GLU 386 N 0.00 0.34 -0.50 -1.08 5.08 -1.75 -3.00 114.58 113.67 3ic9 h GLU 386 Ca 0.00 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 3ic9 h GLU 386 Cb 0.06 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.30 3ic9 h GLU 386 CO 0.00 0.67 0.00 0.41 -1.00 0.00 0.00 179.01 179.09 3ic9 n GLY 387 N -0.19 2.76 3.65 -3.84 0.00 -1.25 -4.86 105.19 101.46 3ic9 n GLY 387 Ca -0.01 -0.60 -0.43 0.00 0.00 0.00 0.00 46.02 44.98 3ic9 n GLY 387 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3ic9 s GLN 388 N -1.19 4.19 0.09 1.61 -0.44 -1.13 -4.97 119.66 117.83 3ic9 s GLN 388 Ca 0.35 1.15 -0.29 0.00 -2.50 0.00 0.00 55.36 54.07 3ic9 s GLN 388 Cb 0.20 -3.66 -0.12 0.00 -1.64 0.00 0.00 33.01 27.79 3ic9 s GLN 388 CO 0.22 -0.64 1.47 0.78 0.50 0.00 0.00 175.29 177.62 3ic9 h GLY 389 N 9.46 -1.17 0.78 2.59 0.00 -1.93 0.01 103.07 112.81 3ic9 h GLY 389 Ca -0.21 0.66 0.04 0.00 0.00 0.00 0.00 47.33 47.82 3ic9 h GLY 389 CO 0.95 -0.27 0.31 -0.09 0.00 0.00 0.00 176.54 177.43 3ic9 h ARG 390 N -0.56 0.58 -0.79 4.80 9.65 -1.87 0.03 114.38 126.22 3ic9 h ARG 390 Ca 0.01 -0.03 0.08 0.00 -1.10 0.00 0.00 59.98 58.94 3ic9 h ARG 390 Cb 0.61 -0.13 -0.07 0.00 -1.39 0.00 0.00 29.97 28.99 3ic9 h ARG 390 CO -0.32 0.38 0.45 0.77 2.80 0.00 0.00 179.97 184.06 3ic9 h SER 391 N 0.60 0.65 -0.26 -3.80 0.02 -1.75 -2.34 113.55 106.66 3ic9 h SER 391 Ca 0.24 0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 61.21 3ic9 h SER 391 Cb 0.10 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 3ic9 h SER 391 CO -0.14 0.39 0.09 -0.09 -1.14 0.00 0.00 176.83 175.94 3ic9 h ARG 392 N 0.77 0.40 0.00 3.45 2.43 -0.08 0.15 114.38 121.50 3ic9 h ARG 392 Ca 0.37 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.46 3ic9 h ARG 392 Cb 0.31 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 3ic9 h ARG 392 CO -0.23 0.45 0.00 0.28 -1.51 0.00 0.00 179.97 178.96 3ic9 n VAL 393 N -4.76 0.00 -1.89 0.20 0.31 -0.09 -4.48 118.33 107.63 3ic9 n VAL 393 Ca -0.03 0.00 -0.04 0.00 -0.01 0.00 0.00 64.34 64.26 3ic9 n VAL 393 Cb 0.14 -0.02 -0.04 0.00 -0.91 0.00 0.00 33.84 33.01 3ic9 n VAL 393 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3ic9 n GLY 395 N 0.21 0.48 0.60 2.92 0.00 -0.71 -5.10 105.19 103.59 3ic9 n GLY 395 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 3ic9 n GLY 395 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ic9 n LYS 396 N 0.00 1.72 -2.17 1.61 4.76 0.45 -4.95 118.16 119.58 3ic9 n LYS 396 Ca -0.16 -3.00 -0.42 0.00 -2.87 0.00 0.00 58.31 51.86 3ic9 n LYS 396 Cb 0.56 -1.66 0.00 0.00 -1.84 0.00 0.00 35.03 32.09 3ic9 n LYS 396 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 3ic9 n ASN 397 N -1.14 5.03 -4.01 4.39 6.94 -1.15 -4.50 115.26 120.82 3ic9 n ASN 397 Ca 0.21 -3.05 -0.14 0.00 -0.02 0.00 0.00 54.58 51.59 3ic9 n ASN 397 Cb 0.78 -1.51 -0.13 0.00 -2.36 0.00 0.00 39.78 36.56 3ic9 n ASN 397 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 3ic9 s LYS 398 N 0.91 0.46 0.00 -3.83 1.02 -1.25 -3.88 119.74 113.17 3ic9 s LYS 398 Ca 0.42 -0.47 0.00 0.00 0.02 0.00 0.00 55.97 55.94 3ic9 s LYS 398 Cb 0.11 -0.32 0.00 0.00 -0.52 0.00 0.00 37.83 37.10 3ic9 s LYS 398 CO -0.02 0.07 0.00 0.41 -0.92 0.00 0.00 175.35 174.89 3ic9 n GLY 399 N 2.18 1.56 3.24 -3.33 0.00 -1.26 -4.25 105.19 103.34 3ic9 n GLY 399 Ca -0.18 -2.04 -0.10 0.00 0.00 0.00 0.00 46.02 43.70 3ic9 n GLY 399 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ic9 s LEU 400 N 0.00 1.01 -0.10 0.99 1.43 0.11 -1.10 118.68 121.03 3ic9 s LEU 400 Ca 0.00 -0.37 -0.04 0.00 -1.03 0.00 0.00 54.13 52.69 3ic9 s LEU 400 Cb 0.00 1.30 0.05 0.00 0.03 0.00 0.00 46.19 47.57 3ic9 s LEU 400 CO 0.00 -0.68 0.21 -0.22 0.23 0.00 0.00 176.35 175.88 3ic9 s LEU 401 N -2.43 0.17 -0.14 1.79 2.96 -0.66 -0.72 118.68 119.65 3ic9 s LEU 401 Ca -0.01 0.45 -0.03 0.00 -0.22 0.00 0.00 54.13 54.32 3ic9 s LEU 401 Cb 0.01 0.53 -0.03 0.00 0.50 0.00 0.00 46.19 47.20 3ic9 s LEU 401 CO -0.07 -0.20 -0.03 0.20 -1.32 0.00 0.00 176.35 174.93 3ic9 s ASN 402 N 1.80 4.89 -0.04 3.68 0.01 -0.02 -1.98 114.94 123.28 3ic9 s ASN 402 Ca -0.03 -0.07 0.04 0.00 -0.71 0.00 0.00 52.86 52.09 3ic9 s ASN 402 Cb -0.11 -1.69 -0.03 0.00 0.41 0.00 0.00 41.25 39.83 3ic9 s ASN 402 CO -0.07 0.22 -0.14 0.68 -1.51 0.00 0.00 177.10 176.27 3ic9 s VAL 403 N 0.06 3.07 -0.06 1.60 -7.23 -0.17 -1.52 120.40 116.15 3ic9 s VAL 403 Ca 0.00 -0.75 0.02 0.00 -1.81 0.00 0.00 61.98 59.44 3ic9 s VAL 403 Cb -0.13 -2.21 -0.03 0.00 0.56 0.00 0.00 36.38 34.57 3ic9 s VAL 403 CO 0.03 0.57 -0.09 -0.31 -0.31 0.00 0.00 175.10 174.99 3ic9 s TYR 404 N -0.75 2.87 -0.05 2.82 2.02 0.12 -1.62 117.35 122.76 3ic9 s TYR 404 Ca 0.12 -0.03 -0.08 0.00 -0.37 0.00 0.00 57.07 56.71 3ic9 s TYR 404 Cb -0.11 -1.69 0.01 0.00 -0.40 0.00 0.00 41.96 39.78 3ic9 s TYR 404 CO 0.01 0.29 0.19 0.00 -1.57 0.00 0.00 175.55 174.47 3ic9 s ALA 405 N -0.78 -0.46 0.21 3.71 0.00 -0.89 0.11 121.76 123.66 3ic9 s ALA 405 Ca 0.12 0.35 -0.30 0.00 0.00 0.00 0.00 51.96 52.12 3ic9 s ALA 405 Cb -0.11 -0.17 -0.10 0.00 0.00 0.00 0.00 23.12 22.74 3ic9 s ALA 405 CO 0.01 -0.14 1.44 0.34 0.00 0.00 0.00 175.76 177.41 3ic9 s ASP 406 N -0.42 6.69 0.28 0.00 -1.08 0.02 -0.10 116.67 122.06 3ic9 s ASP 406 Ca -0.05 2.58 0.03 0.00 -0.52 0.00 0.00 52.55 54.59 3ic9 s ASP 406 Cb -0.03 -2.61 0.41 0.00 -1.46 0.00 0.00 42.92 39.22 3ic9 s ASP 406 CO 0.01 -0.69 1.72 -0.09 0.52 0.00 0.00 175.17 176.63 3ic9 h ARG 407 N 5.58 0.47 0.06 4.34 2.43 -1.18 0.15 114.38 126.22 3ic9 h ARG 407 Ca -0.45 -0.18 -0.15 0.00 -0.81 0.00 0.00 59.98 58.40 3ic9 h ARG 407 Cb 1.21 -0.03 0.01 0.00 -0.42 0.00 0.00 29.97 30.75 3ic9 h ARG 407 CO 0.81 0.70 -0.61 1.15 -1.51 0.00 0.00 179.97 180.51 3ic9 h THR 408 N 0.41 1.51 0.00 0.20 2.02 -1.92 -1.90 112.91 113.23 3ic9 h THR 408 Ca 0.06 -2.28 -0.11 0.00 0.77 0.00 0.00 66.41 64.85 3ic9 h THR 408 Cb 0.69 2.94 -0.02 0.00 -1.74 0.00 0.00 68.15 70.01 3ic9 h THR 408 CO 0.05 0.64 -2.07 -1.54 0.37 0.00 0.00 175.52 172.97 3ic9 n SER 409 N -4.24 0.21 -0.15 4.18 3.41 -1.23 -4.45 113.62 111.34 3ic9 n SER 409 Ca -0.12 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.47 3ic9 n SER 409 Cb 0.70 1.66 -0.01 0.00 -0.26 0.00 0.00 64.21 66.31 3ic9 n SER 409 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ic9 n GLY 410 N 1.46 0.49 3.67 5.00 0.00 0.53 -4.87 105.19 111.47 3ic9 n GLY 410 Ca -0.12 -0.18 -0.47 0.00 0.00 0.00 0.00 46.02 45.25 3ic9 n GLY 410 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3ic9 n GLU 411 N -1.87 2.15 -2.37 1.61 2.13 -1.25 -0.45 120.64 120.59 3ic9 n GLU 411 Ca -0.02 0.78 -0.43 0.00 0.66 0.00 0.00 57.16 58.16 3ic9 n GLU 411 Cb 0.20 -2.58 -0.02 0.00 0.27 0.00 0.00 31.44 29.31 3ic9 n GLU 411 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 3ic9 s PHE 412 N 2.01 2.85 -0.22 4.31 5.36 -1.26 -0.80 117.98 130.23 3ic9 s PHE 412 Ca 0.84 0.96 -0.02 0.00 -0.96 0.00 0.00 56.93 57.75 3ic9 s PHE 412 Cb -0.69 -3.54 -0.19 0.00 -0.34 0.00 0.00 43.02 38.26 3ic9 s PHE 412 CO 0.43 -1.88 -0.06 1.28 -1.46 0.00 0.00 175.22 173.53 3ic9 n LEU 413 N 6.21 2.81 0.00 6.12 4.32 0.12 -4.86 117.00 131.72 3ic9 n LEU 413 Ca 0.13 -0.01 0.00 0.00 -0.02 0.00 0.00 56.01 56.12 3ic9 n LEU 413 Cb 0.45 -0.97 0.00 0.00 -1.62 0.00 0.00 43.42 41.28 3ic9 n LEU 413 CO 0.57 0.89 0.00 0.61 -1.22 0.00 0.00 177.39 178.23 3ic9 n GLY 414 N 2.12 0.36 3.29 -0.72 0.00 -1.21 -1.39 105.19 107.63 3ic9 n GLY 414 Ca -0.42 -1.05 -0.11 0.00 0.00 0.00 0.00 46.02 44.44 3ic9 n GLY 414 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ic9 s ALA 415 N -2.00 -0.79 0.35 4.61 0.00 -0.19 0.14 121.76 123.88 3ic9 s ALA 415 Ca 0.00 -0.05 0.04 0.00 0.00 0.00 0.00 51.96 51.94 3ic9 s ALA 415 Cb 0.00 0.52 -0.04 0.00 0.00 0.00 0.00 23.12 23.60 3ic9 s ALA 415 CO 0.00 -0.54 0.14 -1.21 0.00 0.00 0.00 175.76 174.15 3ic9 s GLU 416 N -3.30 1.73 -0.30 0.00 2.02 -0.58 -1.78 118.70 116.50 3ic9 s GLU 416 Ca 0.00 -2.01 -0.06 0.00 0.02 0.00 0.00 54.97 52.92 3ic9 s GLU 416 Cb 0.01 -0.39 0.19 0.00 0.10 0.00 0.00 34.13 34.04 3ic9 s GLU 416 CO -0.08 -0.43 0.84 0.12 0.02 0.00 0.00 175.26 175.72 3ic9 s PHE 418 N -3.41 -1.08 -0.07 1.61 5.36 0.10 -0.84 117.98 119.66 3ic9 s PHE 418 Ca 0.31 0.92 -0.32 0.00 -0.96 0.00 0.00 56.93 56.88 3ic9 s PHE 418 Cb 0.04 0.29 0.14 0.00 -0.34 0.00 0.00 43.02 43.15 3ic9 s PHE 418 CO 0.16 -0.61 1.38 0.20 -1.46 0.00 0.00 175.22 174.90 3ic9 s GLY 419 N 2.90 -0.46 0.42 13.12 0.00 -0.51 0.06 107.32 122.86 3ic9 s GLY 419 Ca 0.13 0.82 -0.26 0.00 0.00 0.00 0.00 44.72 45.41 3ic9 s GLY 419 CO -0.19 0.55 1.43 -1.55 0.00 0.00 0.00 173.10 173.33 3ic9 n PRO 420 N -0.53 2.33 -2.22 2.90 -0.04 -1.26 -2.26 135.00 133.93 3ic9 n PRO 420 Ca -0.09 0.83 -0.19 0.00 -0.04 0.00 0.00 63.50 64.02 3ic9 n PRO 420 Cb 0.63 -2.60 -0.02 0.00 -0.04 0.00 0.00 33.50 31.47 3ic9 n PRO 420 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3ic9 n ALA 421 N -0.00 -0.58 -0.00 0.55 0.00 -1.26 -4.86 120.51 114.35 3ic9 n ALA 421 Ca 0.04 0.18 0.10 0.00 0.00 0.00 0.00 53.44 53.77 3ic9 n ALA 421 Cb 0.40 -1.97 0.52 0.00 0.00 0.00 0.00 19.45 18.40 3ic9 n ALA 421 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ic9 h ALA 422 N 0.83 2.00 -0.83 0.00 0.00 -1.83 -1.29 119.26 118.13 3ic9 h ALA 422 Ca -0.43 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.53 3ic9 h ALA 422 Cb 1.30 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.96 3ic9 h ALA 422 CO 0.53 -0.08 0.54 1.05 0.00 0.00 0.00 179.25 181.29 3ic9 h GLU 423 N 0.34 0.90 0.17 0.00 4.11 -1.89 0.61 114.58 118.83 3ic9 h GLU 423 Ca 0.20 -0.05 -0.30 0.00 0.07 0.00 0.00 59.36 59.28 3ic9 h GLU 423 Cb 0.37 -0.20 0.01 0.00 0.50 0.00 0.00 28.75 29.44 3ic9 h GLU 423 CO -0.05 0.60 -1.43 0.45 0.07 0.00 0.00 179.01 178.65 3ic9 h HIS 424 N 0.93 0.67 -0.47 2.06 3.86 -1.67 -2.93 115.15 117.60 3ic9 h HIS 424 Ca 0.36 -0.49 -0.07 0.00 -1.16 0.00 0.00 60.37 59.01 3ic9 h HIS 424 Cb 0.21 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 28.63 3ic9 h HIS 424 CO -0.00 1.56 0.02 0.82 0.86 0.00 0.00 177.93 181.18 3ic9 h ILE 425 N -0.09 1.23 -0.77 2.45 1.08 -1.19 -2.55 117.51 117.68 3ic9 h ILE 425 Ca -0.28 -0.95 0.09 0.00 -0.39 0.00 0.00 64.86 63.33 3ic9 h ILE 425 Cb 1.94 0.86 -0.07 0.00 -3.07 0.00 0.00 36.82 36.47 3ic9 h ILE 425 CO 0.16 0.34 0.42 1.23 -0.69 0.00 0.00 178.15 179.60 3ic9 h GLY 426 N 0.96 1.18 0.96 5.37 0.00 0.21 0.51 103.07 112.26 3ic9 h GLY 426 Ca 0.14 -0.27 -0.04 0.00 0.00 0.00 0.00 47.33 47.16 3ic9 h GLY 426 CO 0.02 0.10 0.15 0.45 0.00 0.00 0.00 176.54 177.25 3ic9 h HIS 427 N 0.71 0.76 -0.33 5.60 3.86 -1.27 0.03 115.15 124.50 3ic9 h HIS 427 Ca 0.37 -0.08 -0.01 0.00 -1.16 0.00 0.00 60.37 59.50 3ic9 h HIS 427 Cb 0.36 -0.22 -0.02 0.00 1.06 0.00 0.00 27.41 28.59 3ic9 h HIS 427 CO -0.08 0.67 0.18 1.25 0.86 0.00 0.00 177.93 180.81 3ic9 h LEU 428 N 0.63 0.41 -0.73 2.43 5.85 -0.99 -0.58 115.31 122.32 3ic9 h LEU 428 Ca 0.15 -0.08 -0.08 0.00 0.84 0.00 0.00 57.88 58.71 3ic9 h LEU 428 Cb 0.27 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 3ic9 h LEU 428 CO -0.00 0.37 0.09 -0.07 -0.34 0.00 0.00 178.44 178.49 3ic9 h LEU 429 N 0.41 1.02 -0.50 2.25 3.38 -0.84 -2.11 115.31 118.91 3ic9 h LEU 429 Ca 0.12 -0.24 -0.15 0.00 0.09 0.00 0.00 57.88 57.70 3ic9 h LEU 429 Cb 0.05 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 3ic9 h LEU 429 CO -0.02 1.02 -0.36 0.00 0.09 0.00 0.00 178.44 179.17 3ic9 h ALA 430 N 1.10 0.69 -0.88 1.53 0.00 -0.64 -0.55 119.26 120.50 3ic9 h ALA 430 Ca 0.20 -0.44 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 3ic9 h ALA 430 Cb 0.44 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 3ic9 h ALA 430 CO 0.01 0.67 0.48 -1.49 0.00 0.00 0.00 179.25 178.92 3ic9 h TRP 431 N 0.69 1.20 -0.58 0.00 4.06 -1.07 -1.20 115.95 119.05 3ic9 h TRP 431 Ca 0.07 -0.03 -0.06 0.00 2.06 0.00 0.00 58.89 60.92 3ic9 h TRP 431 Cb 0.92 -0.38 -0.02 0.00 -1.00 0.00 0.00 29.16 28.67 3ic9 h TRP 431 CO 0.05 0.83 0.11 0.00 -3.56 0.00 0.00 178.44 175.87 3ic9 h ALA 432 N 1.31 0.77 0.09 1.49 0.00 -0.92 -1.92 119.26 120.08 3ic9 h ALA 432 Ca 0.31 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 3ic9 h ALA 432 Cb 0.02 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.59 3ic9 h ALA 432 CO -0.05 0.50 -0.04 -0.09 0.00 0.00 0.00 179.25 179.57 3ic9 h ARG 433 N 0.85 -0.11 -0.64 0.00 9.65 -0.97 -2.45 114.38 120.70 3ic9 h ARG 433 Ca 0.18 0.01 0.04 0.00 -1.10 0.00 0.00 59.98 59.11 3ic9 h ARG 433 Cb 0.40 0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 28.96 3ic9 h ARG 433 CO 0.01 0.03 0.43 0.37 2.80 0.00 0.00 179.97 183.61 3ic9 h GLN 434 N -0.24 0.70 -0.05 0.20 4.15 -1.11 0.57 115.11 119.33 3ic9 h GLN 434 Ca -0.01 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.37 3ic9 h GLN 434 Cb 0.20 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 27.73 3ic9 h GLN 434 CO 0.02 0.46 0.00 1.04 -1.93 0.00 0.00 178.83 178.42 3ic9 n GLN 435 N -4.47 1.12 -2.44 1.69 6.02 -0.73 -5.02 117.38 113.54 3ic9 n GLN 435 Ca 0.08 -0.18 -0.02 0.00 -0.01 0.00 0.00 57.00 56.88 3ic9 n GLN 435 Cb 0.17 -1.05 -0.02 0.00 1.02 0.00 0.00 30.24 30.36 3ic9 n GLN 435 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3ic9 n GLN 436 N -0.36 -4.99 -4.31 -1.09 6.02 0.19 -5.05 117.38 107.78 3ic9 n GLN 436 Ca 0.02 3.66 -0.16 0.00 -0.01 0.00 0.00 57.00 60.51 3ic9 n GLN 436 Cb 0.04 -4.82 -0.10 0.00 1.02 0.00 0.00 30.24 26.38 3ic9 n GLN 436 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 3ic9 s THR 438 N -0.62 1.27 0.23 5.09 -4.23 -1.26 -4.86 115.64 111.27 3ic9 s THR 438 Ca -0.10 -2.09 -0.05 0.00 -1.18 0.00 0.00 61.69 58.27 3ic9 s THR 438 Cb 0.01 -2.08 0.15 0.00 1.34 0.00 0.00 72.50 71.91 3ic9 s THR 438 CO 0.26 -0.56 1.78 0.58 -0.54 0.00 0.00 174.62 176.15 3ic9 h VAL 439 N 2.60 1.25 -0.33 2.29 2.07 -1.08 -2.96 116.25 120.09 3ic9 h VAL 439 Ca -0.38 -0.87 0.05 0.00 0.82 0.00 0.00 66.70 66.33 3ic9 h VAL 439 Cb 1.21 0.51 -0.05 0.00 -1.52 0.00 0.00 31.29 31.44 3ic9 h VAL 439 CO 0.64 0.34 0.03 1.56 0.02 0.00 0.00 177.57 180.16 3ic9 h GLN 440 N 1.01 0.14 -1.76 1.57 7.50 -1.93 -1.81 115.11 119.84 3ic9 h GLN 440 Ca 0.22 -0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.36 3ic9 h GLN 440 Cb 0.29 -0.03 0.00 0.00 0.05 0.00 0.00 27.48 27.79 3ic9 h GLN 440 CO -0.01 0.09 0.00 0.00 -1.50 0.00 0.00 178.83 177.41 3ic9 n ALA 441 N -2.43 1.96 0.00 3.87 0.00 -1.12 -3.24 120.51 119.54 3ic9 n ALA 441 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 3ic9 n ALA 441 Cb 0.16 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.44 3ic9 n ALA 441 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3ic9 n LEU 443 N 1.10 0.00 -1.81 0.00 4.77 -0.68 -5.02 117.00 115.36 3ic9 n LEU 443 Ca 0.00 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.91 3ic9 n LEU 443 Cb 0.16 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.15 3ic9 n LEU 443 CO 0.00 0.00 1.35 0.35 -1.33 0.00 0.00 177.39 177.76 3ic9 n THR 444 N 0.00 2.55 -4.32 -5.08 -2.24 -1.20 -4.81 114.28 99.19 3ic9 n THR 444 Ca 0.00 -1.08 -0.35 0.00 -2.27 0.00 0.00 64.05 60.35 3ic9 n THR 444 Cb 0.00 -1.79 -0.10 0.00 -2.10 0.00 0.00 70.33 66.34 3ic9 n THR 444 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3ic9 s PRO 446 N 0.64 3.34 -0.21 -0.78 0.04 -1.26 -4.95 135.00 131.81 3ic9 s PRO 446 Ca 0.40 -0.42 0.00 0.00 0.04 0.00 0.00 61.00 61.01 3ic9 s PRO 446 Cb 0.19 -2.90 0.06 0.00 0.04 0.00 0.00 34.50 31.89 3ic9 s PRO 446 CO 0.00 0.51 -0.05 -0.06 0.04 0.00 0.00 177.00 177.44 3ic9 s PHE 447 N -0.35 2.11 1.04 0.56 0.08 -1.26 -5.12 117.98 115.05 3ic9 s PHE 447 Ca 0.07 -1.52 -0.15 0.00 0.12 0.00 0.00 56.93 55.45 3ic9 s PHE 447 Cb -0.12 -1.47 0.21 0.00 -0.57 0.00 0.00 43.02 41.07 3ic9 s PHE 447 CO 0.02 -0.73 1.14 -0.47 -0.10 0.00 0.00 175.22 175.09 3ic9 s TYR 448 N 1.49 1.61 -0.01 0.36 5.04 -1.26 -5.03 117.35 119.55 3ic9 s TYR 448 Ca -0.04 0.69 0.01 0.00 -2.44 0.00 0.00 57.07 55.29 3ic9 s TYR 448 Cb -0.18 -3.48 0.01 0.00 0.35 0.00 0.00 41.96 38.66 3ic9 s TYR 448 CO -0.07 -3.05 -0.03 -1.58 -1.34 0.00 0.00 175.55 169.48 3ic9 s HIS 449 N -3.20 0.38 -0.27 4.97 5.65 -1.26 -4.14 115.29 117.43 3ic9 s HIS 449 Ca 0.68 -0.06 -0.12 0.00 0.25 0.00 0.00 55.06 55.81 3ic9 s HIS 449 Cb -0.12 -0.33 -0.05 0.00 -1.18 0.00 0.00 32.58 30.90 3ic9 s HIS 449 CO 0.55 -0.06 0.24 -1.25 -0.65 0.00 0.00 174.74 173.57 3ic9 s PRO 450 N 0.33 3.99 0.08 2.88 0.04 -1.26 -5.19 135.00 135.87 3ic9 s PRO 450 Ca -0.03 -0.20 -0.00 0.00 0.04 0.00 0.00 61.00 60.80 3ic9 s PRO 450 Cb -0.06 -3.64 -0.04 0.00 0.04 0.00 0.00 34.50 30.79 3ic9 s PRO 450 CO -0.01 -0.17 -0.02 0.14 0.04 0.00 0.00 177.00 176.98 3ic9 s VAL 451 N 1.74 0.31 0.38 -0.36 -7.23 -1.26 -4.79 120.40 109.20 3ic9 s VAL 451 Ca 0.10 -1.86 0.05 0.00 -1.81 0.00 0.00 61.98 58.45 3ic9 s VAL 451 Cb -0.16 -1.67 0.26 0.00 0.56 0.00 0.00 36.38 35.38 3ic9 s VAL 451 CO 0.10 -0.86 2.03 0.40 -0.31 0.00 0.00 175.10 176.47 3ic9 h ILE 452 N 3.04 1.13 0.00 -0.62 2.04 -1.94 -2.09 117.51 119.08 3ic9 h ILE 452 Ca -0.35 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.27 3ic9 h ILE 452 Cb 1.16 0.37 0.00 0.00 -0.74 0.00 0.00 36.82 37.61 3ic9 h ILE 452 CO 0.64 0.13 0.00 -1.84 0.00 0.00 0.00 178.15 177.08 3ic9 n GLU 453 N -4.46 0.08 0.22 2.37 0.00 -1.26 -0.79 120.64 116.81 3ic9 n GLU 453 Ca 0.05 0.46 0.07 0.00 0.00 0.00 0.00 57.16 57.73 3ic9 n GLU 453 Cb 0.05 -1.70 0.53 0.00 0.00 0.00 0.00 31.44 30.31 3ic9 n GLU 453 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 3ic9 h GLU 454 N 0.00 0.00 -0.67 3.44 5.08 -1.66 -2.09 114.58 118.68 3ic9 h GLU 454 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 3ic9 h GLU 454 Cb 0.14 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 3ic9 h GLU 454 CO 0.00 0.22 0.28 0.78 -1.00 0.00 0.00 179.01 179.29 3ic9 h GLY 455 N 0.83 1.05 1.16 -3.84 0.00 -1.14 -2.17 103.07 98.96 3ic9 h GLY 455 Ca -0.00 -0.54 -0.04 0.00 0.00 0.00 0.00 47.33 46.76 3ic9 h GLY 455 CO 0.03 0.51 0.32 -2.00 0.00 0.00 0.00 176.54 175.39 3ic9 h LEU 456 N 0.96 0.98 -0.80 3.11 5.85 -1.51 -1.76 115.31 122.15 3ic9 h LEU 456 Ca 0.23 -0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.84 3ic9 h LEU 456 Cb 0.17 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 40.90 3ic9 h LEU 456 CO -0.02 0.86 0.52 -0.09 -0.34 0.00 0.00 178.44 179.36 3ic9 h ARG 457 N 1.06 1.00 -0.22 1.25 2.43 -0.84 0.29 114.38 119.35 3ic9 h ARG 457 Ca 0.25 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.36 3ic9 h ARG 457 Cb 0.16 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 3ic9 h ARG 457 CO -0.03 0.66 0.13 1.15 -1.51 0.00 0.00 179.97 180.38 3ic9 h THR 458 N 1.03 1.09 -0.78 0.20 2.02 -0.92 -0.34 112.91 115.20 3ic9 h THR 458 Ca 0.31 -0.21 -0.03 0.00 0.77 0.00 0.00 66.41 67.25 3ic9 h THR 458 Cb -0.04 0.82 -0.04 0.00 -1.74 0.00 0.00 68.15 67.16 3ic9 h THR 458 CO -0.10 0.08 0.38 0.00 0.37 0.00 0.00 175.52 176.25 3ic9 h ALA 459 N 1.04 1.19 -0.38 6.16 0.00 -0.85 -1.62 119.26 124.79 3ic9 h ALA 459 Ca 0.08 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 3ic9 h ALA 459 Cb 0.02 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 3ic9 h ALA 459 CO -0.02 0.62 -0.15 -0.07 0.00 0.00 0.00 179.25 179.63 3ic9 h LEU 460 N 1.11 0.79 -0.98 0.00 3.38 -0.57 -1.90 115.31 117.14 3ic9 h LEU 460 Ca 0.27 -0.39 0.07 0.00 0.09 0.00 0.00 57.88 57.92 3ic9 h LEU 460 Cb 0.11 -0.22 -0.07 0.00 0.09 0.00 0.00 40.66 40.58 3ic9 h LEU 460 CO -0.03 1.00 0.63 0.03 0.09 0.00 0.00 178.44 180.16 3ic9 h ARG 461 N 0.57 1.10 -0.60 1.13 3.08 -0.89 0.44 114.38 119.22 3ic9 h ARG 461 Ca 0.09 -0.07 -0.07 0.00 0.07 0.00 0.00 59.98 60.00 3ic9 h ARG 461 Cb 0.69 -0.25 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 3ic9 h ARG 461 CO 0.05 0.73 0.10 0.22 -1.07 0.00 0.00 179.97 180.00 3ic9 h ASP 462 N 1.13 0.95 -0.22 7.04 3.58 -0.90 -0.28 116.42 127.72 3ic9 h ASP 462 Ca 0.43 -0.26 -0.02 0.00 0.42 0.00 0.00 57.03 57.60 3ic9 h ASP 462 Cb 0.18 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 40.97 3ic9 h ASP 462 CO -0.18 0.97 0.07 0.00 -2.88 0.00 0.00 179.24 177.22 3ic9 h ALA 463 N 1.02 0.29 -0.57 -0.78 0.00 -1.14 -3.28 119.26 114.81 3ic9 h ALA 463 Ca 0.18 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3ic9 h ALA 463 Cb 0.42 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 3ic9 h ALA 463 CO 0.01 -0.08 0.31 0.37 0.00 0.00 0.00 179.25 179.86 3ic9 h GLN 464 N 0.19 0.80 -0.21 0.00 4.15 -0.44 -1.19 115.11 118.41 3ic9 h GLN 464 Ca 0.07 -0.10 0.06 0.00 0.77 0.00 0.00 58.65 59.46 3ic9 h GLN 464 Cb 0.24 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.77 3ic9 h GLN 464 CO -0.00 0.62 0.23 -0.56 -1.93 0.00 0.00 178.83 177.19 3ic9 h GLN 465 N 0.77 0.00 -0.00 1.69 3.07 -1.14 -0.81 115.11 118.68 3ic9 h GLN 465 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.94 3ic9 h GLN 465 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.61 3ic9 h GLN 465 CO -0.03 0.00 -0.37 1.63 0.09 0.00 0.00 178.83 180.15 3ic9 n LYS 466 N -3.80 0.43 -1.34 0.06 5.02 -0.46 -4.95 118.16 113.12 3ic9 n LYS 466 Ca 0.02 -0.25 -0.31 0.00 -2.02 0.00 0.00 58.31 55.76 3ic9 n LYS 466 Cb 0.36 -1.49 0.09 0.00 -0.02 0.00 0.00 35.03 33.97 3ic9 n LYS 466 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3ic9 s LEU 467 N -2.74 2.94 -0.03 -0.35 1.43 -0.31 -4.97 118.68 114.65 3ic9 s LEU 467 Ca 0.18 1.71 0.16 0.00 -1.03 0.00 0.00 54.13 55.14 3ic9 s LEU 467 Cb 0.18 -4.41 0.50 0.00 0.03 0.00 0.00 46.19 42.50 3ic9 s LEU 467 CO 0.60 -1.97 1.40 0.00 0.23 0.00 0.00 176.35 176.62 3ic9 n ALA 468 N -3.47 2.60 -1.61 4.21 0.00 -0.71 -4.93 120.51 116.59 3ic9 n ALA 468 Ca 0.08 -1.03 -0.31 0.00 0.00 0.00 0.00 53.44 52.18 3ic9 n ALA 468 Cb 0.54 -0.98 0.04 0.00 0.00 0.00 0.00 19.45 19.04 3ic9 n ALA 468 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3ic9 s ILE 469 N -1.44 4.04 0.00 0.00 -1.09 -1.26 -4.96 121.20 116.49 3ic9 s ILE 469 Ca 0.37 0.73 -0.30 0.00 -2.23 0.00 0.00 60.65 59.22 3ic9 s ILE 469 Cb 0.21 -3.43 -0.09 0.00 -1.58 0.00 0.00 42.46 37.57 3ic9 s ILE 469 CO 0.23 -0.80 2.00 1.21 -1.23 0.00 0.00 174.94 176.35 3ic9 n GLU 470 N -2.83 2.74 -0.29 2.79 4.07 -1.26 -4.88 120.64 120.98 3ic9 n GLU 470 Ca 0.08 0.98 0.11 0.00 -0.06 0.00 0.00 57.16 58.27 3ic9 n GLU 470 Cb 0.53 -3.02 0.27 0.00 -0.06 0.00 0.00 31.44 29.16 3ic9 n GLU 470 CO 0.00 0.00 0.00 1.57 -0.06 0.00 0.00 177.13 178.64 3ic9 h LYS 471 N 11.08 0.34 -0.75 5.31 2.10 -1.93 0.15 116.57 132.87 3ic9 h LYS 471 Ca -0.49 -0.02 -0.51 0.00 -2.00 0.00 0.00 60.65 57.64 3ic9 h LYS 471 Cb 1.24 -0.08 -0.30 0.00 -0.90 0.00 0.00 32.23 32.19 3ic9 h LYS 471 CO 0.94 0.22 -0.01 0.72 -2.00 0.00 0.00 179.45 179.33 3ic9 n HIS 472 N -5.10 2.54 -3.56 0.07 8.25 -1.26 -4.92 115.22 111.24 3ic9 n HIS 472 Ca 0.20 -2.34 -0.27 0.00 -0.26 0.00 0.00 57.72 55.05 3ic9 n HIS 472 Cb 0.60 -0.78 -0.10 0.00 1.12 0.00 0.00 29.99 30.83 3ic9 n HIS 472 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 3ic9 n ASP 473 N -0.90 2.21 -3.63 0.41 8.00 0.53 -5.20 116.55 117.97 3ic9 n ASP 473 Ca 0.49 -3.06 -0.04 0.00 0.71 0.00 0.00 54.79 52.89 3ic9 n ASP 473 Cb 0.92 -0.68 -0.04 0.00 -0.02 0.00 0.00 41.12 41.30 3ic9 n ASP 473 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 3ic9 s ASN 475 N -1.47 -0.10 0.30 -2.24 0.01 -1.26 -4.84 114.94 105.33 3ic9 s ASN 475 Ca 0.32 0.09 0.23 0.00 -0.71 0.00 0.00 52.86 52.80 3ic9 s ASN 475 Cb 0.06 0.09 0.27 0.00 0.41 0.00 0.00 41.25 42.08 3ic9 s ASN 475 CO -0.12 -0.11 1.39 -0.33 -1.51 0.00 0.00 177.10 176.42 3ic9 h GLU 476 N 2.13 0.00 -4.34 -0.60 5.08 -1.91 -3.45 114.58 111.49 3ic9 h GLU 476 Ca -0.09 0.00 -0.46 0.00 -1.00 0.00 0.00 59.36 57.80 3ic9 h GLU 476 Cb 1.18 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 30.09 3ic9 h GLU 476 CO 0.23 0.00 -0.79 0.12 -1.00 0.00 0.00 179.01 177.57 3ic9 s PHE 477 N -3.25 1.12 0.64 4.33 5.36 -1.26 -3.82 117.98 121.10 3ic9 s PHE 477 Ca 0.05 -0.37 0.07 0.00 -0.96 0.00 0.00 56.93 55.72 3ic9 s PHE 477 Cb 0.08 -0.87 0.11 0.00 -0.34 0.00 0.00 43.02 42.01 3ic9 s PHE 477 CO 0.71 -0.22 0.88 0.42 -1.46 0.00 0.00 175.22 175.55 3ic9 s ILE 478 N 0.71 2.01 -0.08 3.12 1.01 -1.26 -5.16 121.20 121.54 3ic9 s ILE 478 Ca -0.13 -0.91 -0.30 0.00 0.00 0.00 0.00 60.65 59.32 3ic9 s ILE 478 Cb -0.15 -2.10 0.09 0.00 0.01 0.00 0.00 42.46 40.32 3ic9 s ILE 478 CO 0.02 0.00 0.81 0.42 0.00 0.00 0.00 174.94 176.19 3ic9 s THR 480 N -2.84 0.00 0.00 2.92 -4.23 -1.26 -5.23 115.64 105.00 3ic9 s THR 480 Ca 0.64 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 61.15 3ic9 s THR 480 Cb -0.05 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.79 3ic9 s THR 480 CO 0.41 0.00 0.00 0.00 -0.54 0.00 0.00 174.62 174.49