#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 3.76 -0.00 0.58 1.01 -1.26 -0.87 120.40 123.62 3ic9 s VAL 3 Ca 0.00 -0.41 0.04 0.00 0.00 0.00 0.00 61.98 61.61 3ic9 s VAL 3 Cb 0.00 -2.63 -0.01 0.00 0.00 0.00 0.00 36.38 33.74 3ic9 s VAL 3 CO 0.00 0.51 -0.12 0.27 0.00 0.00 0.00 175.10 175.76 3ic9 s ILE 4 N 0.22 0.96 -0.19 2.22 -4.36 -0.32 -4.98 121.20 114.75 3ic9 s ILE 4 Ca -0.03 -0.59 -0.12 0.00 -0.26 0.00 0.00 60.65 59.65 3ic9 s ILE 4 Cb -0.14 -0.82 -0.05 0.00 1.25 0.00 0.00 42.46 42.70 3ic9 s ILE 4 CO 0.03 0.22 0.20 0.20 0.24 0.00 0.00 174.94 175.83 3ic9 s ASN 5 N -0.43 6.28 0.10 4.36 0.01 -1.26 -0.60 114.94 123.40 3ic9 s ASN 5 Ca 0.04 0.32 0.02 0.00 -0.71 0.00 0.00 52.86 52.54 3ic9 s ASN 5 Cb -0.05 -2.13 -0.04 0.00 0.41 0.00 0.00 41.25 39.44 3ic9 s ASN 5 CO -0.00 0.13 -0.08 0.68 -1.51 0.00 0.00 177.10 176.32 3ic9 s VAL 6 N 0.49 0.79 0.06 1.60 -7.23 -0.59 -4.98 120.40 110.53 3ic9 s VAL 6 Ca 0.11 -1.82 -0.15 0.00 -1.81 0.00 0.00 61.98 58.31 3ic9 s VAL 6 Cb -0.12 -1.55 -0.28 0.00 0.56 0.00 0.00 36.38 34.99 3ic9 s VAL 6 CO 0.01 -0.76 1.12 0.44 -0.31 0.00 0.00 175.10 175.60 3ic9 h ASP 7 N 3.18 0.89 -3.29 4.85 3.32 -1.58 -2.24 116.42 121.55 3ic9 h ASP 7 Ca -0.36 -0.80 -0.51 0.00 0.02 0.00 0.00 57.03 55.38 3ic9 h ASP 7 Cb 1.18 -0.28 -0.35 0.00 0.22 0.00 0.00 39.33 40.09 3ic9 h ASP 7 CO 0.60 1.59 -0.80 -0.69 -1.72 0.00 0.00 179.24 178.22 3ic9 s VAL 8 N -3.06 0.99 -0.16 -1.35 1.01 -0.75 -0.04 120.40 117.03 3ic9 s VAL 8 Ca -0.10 -0.32 -0.01 0.00 0.00 0.00 0.00 61.98 61.55 3ic9 s VAL 8 Cb 0.06 -0.97 -0.01 0.00 0.00 0.00 0.00 36.38 35.46 3ic9 s VAL 8 CO 0.93 0.34 -0.11 0.00 0.00 0.00 0.00 175.10 176.27 3ic9 s ALA 9 N 1.28 2.66 -0.28 5.51 0.00 -0.59 -1.20 121.76 129.12 3ic9 s ALA 9 Ca -0.03 -1.01 -0.05 0.00 0.00 0.00 0.00 51.96 50.86 3ic9 s ALA 9 Cb -0.14 -1.37 0.01 0.00 0.00 0.00 0.00 23.12 21.62 3ic9 s ALA 9 CO -0.03 -0.03 0.04 0.42 0.00 0.00 0.00 175.76 176.16 3ic9 s ILE 10 N 0.81 3.66 -0.49 0.00 1.01 -0.41 -0.33 121.20 125.44 3ic9 s ILE 10 Ca -0.04 -0.79 -0.24 0.00 0.00 0.00 0.00 60.65 59.59 3ic9 s ILE 10 Cb -0.15 -2.88 0.03 0.00 0.01 0.00 0.00 42.46 39.47 3ic9 s ILE 10 CO 0.01 0.11 0.85 -0.63 0.00 0.00 0.00 174.94 175.29 3ic9 s ILE 11 N 1.45 4.54 0.00 2.92 1.01 0.70 -1.25 121.20 130.57 3ic9 s ILE 11 Ca 0.02 0.35 0.00 0.00 0.00 0.00 0.00 60.65 61.02 3ic9 s ILE 11 Cb -0.17 -4.42 0.00 0.00 0.01 0.00 0.00 42.46 37.88 3ic9 s ILE 11 CO 0.01 -0.89 0.00 0.61 0.00 0.00 0.00 174.94 174.66 3ic9 n GLY 12 N 5.04 2.68 2.78 6.18 0.00 0.16 -0.24 105.19 121.80 3ic9 n GLY 12 Ca 0.02 -1.15 -0.37 0.00 0.00 0.00 0.00 46.02 44.52 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 1.14 3.74 -1.29 2.61 -1.04 -1.21 -4.04 114.28 114.18 3ic9 n THR 13 Ca 0.00 -4.79 0.00 0.00 -2.04 0.00 0.00 64.05 57.22 3ic9 n THR 13 Cb 0.00 -1.31 0.00 0.00 -1.82 0.00 0.00 70.33 67.20 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 -0.43 1.84 0.27 3.41 0.00 -1.26 -4.46 105.19 104.56 3ic9 n GLY 14 Ca 0.48 -1.93 -0.16 0.00 0.00 0.00 0.00 46.02 44.41 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 0.53 -0.65 2.61 2.02 -1.93 -3.03 112.91 112.47 3ic9 h THR 15 Ca 0.00 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.14 3ic9 h THR 15 Cb 0.00 0.56 -0.03 0.00 -1.74 0.00 0.00 68.15 66.93 3ic9 h THR 15 CO 0.00 0.01 0.42 0.00 0.37 0.00 0.00 175.52 176.32 3ic9 h ALA 16 N -0.14 0.83 0.00 6.16 0.00 -1.90 -1.89 119.26 122.31 3ic9 h ALA 16 Ca -0.07 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3ic9 h ALA 16 Cb 0.50 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3ic9 h ALA 16 CO 0.11 0.27 0.00 0.41 0.00 0.00 0.00 179.25 180.04 3ic9 n GLY 17 N -1.25 0.59 1.47 0.00 0.00 -1.14 -0.43 105.19 104.42 3ic9 n GLY 17 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 0.41 0.00 0.34 -0.02 0.00 -0.71 -1.26 105.19 103.95 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 1.22 0.13 4.61 0.00 -0.68 -2.35 119.26 122.19 3ic9 h ALA 20 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3ic9 h ALA 20 Cb 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.50 3ic9 h ALA 20 CO 0.00 0.39 -0.06 -0.92 0.00 0.00 0.00 179.25 178.66 3ic9 h TYR 21 N 1.09 -0.16 -0.75 0.00 3.20 -1.44 -0.39 116.97 118.52 3ic9 h TYR 21 Ca 0.38 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.26 3ic9 h TYR 21 Cb 0.08 0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.37 3ic9 h TYR 21 CO -0.02 -0.01 0.49 0.00 -1.64 0.00 0.00 178.16 176.98 3ic9 h ARG 22 N -0.29 0.95 -0.35 1.82 3.08 -1.81 -0.75 114.38 117.03 3ic9 h ARG 22 Ca -0.02 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 3ic9 h ARG 22 Cb 0.23 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 3ic9 h ARG 22 CO 0.03 0.63 0.13 0.00 -1.07 0.00 0.00 179.97 179.69 3ic9 h ALA 23 N 1.29 0.46 -0.10 0.04 0.00 -1.35 -3.22 119.26 116.37 3ic9 h ALA 23 Ca 0.28 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.92 3ic9 h ALA 23 Cb -0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3ic9 h ALA 23 CO -0.08 0.07 -0.53 0.00 0.00 0.00 0.00 179.25 178.71 3ic9 h ALA 24 N 0.98 0.92 0.00 0.00 0.00 -0.78 -2.88 119.26 117.49 3ic9 h ALA 24 Ca 0.12 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 3ic9 h ALA 24 Cb 0.20 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 3ic9 h ALA 24 CO -0.01 0.68 -0.09 0.87 0.00 0.00 0.00 179.25 180.70 3ic9 h LYS 25 N 0.22 0.00 0.00 0.00 1.79 -1.16 -1.50 116.57 115.92 3ic9 h LYS 25 Ca 0.01 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 3ic9 h LYS 25 Cb 1.00 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.65 3ic9 h LYS 25 CO 0.08 0.09 -0.10 0.87 -1.08 0.00 0.00 179.45 179.32 3ic9 h LYS 26 N 0.00 0.00 0.00 3.15 1.79 -1.52 -3.25 116.57 116.74 3ic9 h LYS 26 Ca -0.00 0.00 -0.28 0.00 -2.18 0.00 0.00 60.65 58.19 3ic9 h LYS 26 Cb 0.31 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 30.90 3ic9 h LYS 26 CO 0.01 0.10 -2.20 0.72 -1.08 0.00 0.00 179.45 177.00 3ic9 n HIS 27 N -3.28 0.00 -3.70 -1.35 8.25 -0.65 -5.00 115.22 109.49 3ic9 n HIS 27 Ca -0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.32 3ic9 n HIS 27 Cb 0.33 -0.83 -0.09 0.00 1.12 0.00 0.00 29.99 30.51 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 -2.62 0.00 0.18 1.59 -1.32 -0.66 -4.94 115.64 107.88 3ic9 s THR 28 Ca -0.09 -0.00 0.28 0.00 -1.21 0.00 0.00 61.69 60.67 3ic9 s THR 28 Cb 0.07 -0.70 0.30 0.00 -1.51 0.00 0.00 72.50 70.65 3ic9 s THR 28 CO 0.77 -0.00 1.93 0.44 -2.21 0.00 0.00 174.62 175.55 3ic9 h ASP 29 N 5.34 0.00 -2.43 8.08 3.32 -1.85 -3.34 116.42 125.54 3ic9 h ASP 29 Ca -0.28 0.00 -0.76 0.00 0.02 0.00 0.00 57.03 56.01 3ic9 h ASP 29 Cb 1.17 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.52 3ic9 h ASP 29 CO 0.19 0.14 1.22 0.29 -1.72 0.00 0.00 179.24 179.35 3ic9 n LYS 30 N -3.33 3.59 -4.36 3.56 5.02 -1.26 -4.93 118.16 116.44 3ic9 n LYS 30 Ca -0.00 -4.01 -0.22 0.00 -2.02 0.00 0.00 58.31 52.06 3ic9 n LYS 30 Cb 0.35 -2.84 -0.16 0.00 -0.02 0.00 0.00 35.03 32.36 3ic9 n LYS 30 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3ic9 s VAL 31 N 0.16 0.83 0.02 -0.18 1.01 -1.26 -1.53 120.40 119.45 3ic9 s VAL 31 Ca 0.38 -0.30 0.06 0.00 0.00 0.00 0.00 61.98 62.12 3ic9 s VAL 31 Cb -0.01 -0.80 -0.03 0.00 0.00 0.00 0.00 36.38 35.54 3ic9 s VAL 31 CO -0.01 0.29 -0.16 0.68 0.00 0.00 0.00 175.10 175.91 3ic9 s VAL 32 N 0.80 2.94 -0.19 2.92 -7.23 -0.34 -4.64 120.40 114.66 3ic9 s VAL 32 Ca -0.13 -1.03 -0.03 0.00 -1.81 0.00 0.00 61.98 58.98 3ic9 s VAL 32 Cb -0.15 -2.22 -0.01 0.00 0.56 0.00 0.00 36.38 34.56 3ic9 s VAL 32 CO 0.02 0.40 -0.05 -0.76 -0.31 0.00 0.00 175.10 174.40 3ic9 s LEU 33 N -1.27 2.98 -0.09 1.32 1.43 0.23 -1.29 118.68 121.98 3ic9 s LEU 33 Ca 0.14 -0.31 -0.01 0.00 -1.03 0.00 0.00 54.13 52.92 3ic9 s LEU 33 Cb -0.11 -1.74 -0.03 0.00 0.03 0.00 0.00 46.19 44.35 3ic9 s LEU 33 CO 0.04 0.05 -0.04 -0.63 0.23 0.00 0.00 176.35 176.01 3ic9 s ILE 34 N 1.04 3.91 -0.11 -0.59 1.01 -0.38 -0.66 121.20 125.42 3ic9 s ILE 34 Ca 0.01 -0.39 -0.04 0.00 0.00 0.00 0.00 60.65 60.23 3ic9 s ILE 34 Cb -0.15 -2.64 0.05 0.00 0.01 0.00 0.00 42.46 39.74 3ic9 s ILE 34 CO 0.00 0.58 0.16 -0.70 0.00 0.00 0.00 174.94 174.98 3ic9 s GLU 35 N -0.56 0.06 0.16 2.79 2.56 -0.65 -0.66 118.70 122.40 3ic9 s GLU 35 Ca 0.09 0.47 0.18 0.00 0.00 0.00 0.00 54.97 55.70 3ic9 s GLU 35 Cb -0.12 -0.51 -0.04 0.00 2.00 0.00 0.00 34.13 35.46 3ic9 s GLU 35 CO 0.02 -0.38 1.06 0.78 -0.56 0.00 0.00 175.26 176.18 3ic9 h GLY 36 N 8.36 0.00 0.00 -1.50 0.00 -1.72 -1.00 103.07 107.21 3ic9 h GLY 36 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.19 3ic9 h GLY 36 CO 0.17 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.32 3ic9 n GLY 37 N 1.30 4.39 3.75 4.60 0.00 -1.26 -4.65 105.19 113.31 3ic9 n GLY 37 Ca -0.04 -1.89 -0.40 0.00 0.00 0.00 0.00 46.02 43.69 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 -2.27 3.32 0.76 4.61 0.00 -1.26 -5.01 121.76 121.91 3ic9 s ALA 38 Ca 0.00 0.59 -0.11 0.00 0.00 0.00 0.00 51.96 52.44 3ic9 s ALA 38 Cb 0.00 -3.21 0.05 0.00 0.00 0.00 0.00 23.12 19.96 3ic9 s ALA 38 CO 0.00 0.15 1.09 0.71 0.00 0.00 0.00 175.76 177.71 3ic9 s TYR 39 N -0.83 2.63 0.00 0.00 4.12 -1.26 -4.56 117.35 117.45 3ic9 s TYR 39 Ca 0.42 1.54 0.00 0.00 0.02 0.00 0.00 57.07 59.06 3ic9 s TYR 39 Cb -0.25 -3.04 0.00 0.00 -1.52 0.00 0.00 41.96 37.15 3ic9 s TYR 39 CO 0.31 -1.74 0.00 0.41 0.02 0.00 0.00 175.55 174.55 3ic9 n GLY 40 N -1.25 1.16 0.63 0.71 0.00 -1.26 -4.91 105.19 100.26 3ic9 n GLY 40 Ca 0.09 0.00 0.00 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 -1.23 -0.14 2.61 -2.24 -1.26 -4.13 114.28 107.90 3ic9 n THR 41 Ca 0.00 0.60 -0.01 0.00 -2.27 0.00 0.00 64.05 62.36 3ic9 n THR 41 Cb 0.00 -0.98 0.23 0.00 -2.10 0.00 0.00 70.33 67.47 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 0.09 1.21 0.38 4.28 2.02 -1.93 -1.89 112.91 117.06 3ic9 h THR 42 Ca 0.00 -0.65 -0.00 0.00 0.77 0.00 0.00 66.41 66.53 3ic9 h THR 42 Cb 0.37 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.27 3ic9 h THR 42 CO 0.00 0.26 -0.39 0.00 0.37 0.00 0.00 175.52 175.75 3ic9 h ALA 44 N -0.40 0.93 0.18 0.00 0.00 -1.71 -2.37 119.26 115.89 3ic9 h ALA 44 Ca -0.03 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 3ic9 h ALA 44 Cb 0.72 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3ic9 h ALA 44 CO -0.08 0.70 -0.09 0.00 0.00 0.00 0.00 179.25 179.78 3ic9 h ARG 45 N 0.16 -0.23 0.00 0.00 3.08 -1.11 -3.41 114.38 112.87 3ic9 h ARG 45 Ca -0.00 0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 3ic9 h ARG 45 Cb 1.03 0.05 -0.04 0.00 0.08 0.00 0.00 29.97 31.09 3ic9 h ARG 45 CO 0.08 0.11 -0.40 1.33 -1.07 0.00 0.00 179.97 180.02 3ic9 n VAL 46 N -4.92 0.00 0.00 2.04 0.24 -0.25 -4.77 118.33 110.66 3ic9 n VAL 46 Ca -0.06 -0.10 0.00 0.00 -2.04 0.00 0.00 64.34 62.14 3ic9 n VAL 46 Cb 0.22 0.41 0.00 0.00 -1.47 0.00 0.00 33.84 33.00 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 0.05 1.92 0.05 7.63 0.00 0.59 -4.71 105.19 110.73 3ic9 n GLY 47 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.16 0.00 0.01 0.00 -0.04 -1.26 -0.87 135.00 132.68 3ic9 n PRO 50 Ca 0.00 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.35 3ic9 n PRO 50 Cb 0.00 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.40 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 0.07 -0.23 3.54 4.64 -1.78 0.14 113.55 119.93 3ic9 h SER 51 Ca 0.00 -0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 61.29 3ic9 h SER 51 Cb 0.00 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 3ic9 h SER 51 CO 0.00 0.08 0.14 0.11 -0.87 0.00 0.00 176.83 176.30 3ic9 h LYS 52 N 0.05 0.32 -0.44 4.77 6.56 -1.24 -1.15 116.57 125.44 3ic9 h LYS 52 Ca 0.02 -0.02 -0.07 0.00 -1.06 0.00 0.00 60.65 59.52 3ic9 h LYS 52 Cb 0.02 -0.07 -0.02 0.00 -0.57 0.00 0.00 32.23 31.60 3ic9 h LYS 52 CO -0.00 0.22 -0.00 -0.07 -2.06 0.00 0.00 179.45 177.53 3ic9 h LEU 53 N 0.32 0.77 -0.24 2.94 3.38 -1.60 -0.92 115.31 119.97 3ic9 h LEU 53 Ca 0.09 -0.31 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 3ic9 h LEU 53 Cb -0.01 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 3ic9 h LEU 53 CO -0.02 0.89 0.14 0.25 0.09 0.00 0.00 178.44 179.80 3ic9 h LEU 54 N 0.62 0.29 -0.56 1.67 6.46 -0.33 -2.58 115.31 120.89 3ic9 h LEU 54 Ca 0.12 -0.06 0.02 0.00 -0.12 0.00 0.00 57.88 57.85 3ic9 h LEU 54 Cb 0.50 -0.07 -0.04 0.00 -0.73 0.00 0.00 40.66 40.32 3ic9 h LEU 54 CO 0.02 0.26 0.34 0.40 -0.62 0.00 0.00 178.44 178.84 3ic9 h ILE 55 N 0.30 1.06 -0.98 4.05 2.04 -1.07 -0.92 117.51 121.99 3ic9 h ILE 55 Ca 0.09 -0.23 0.06 0.00 1.00 0.00 0.00 64.86 65.77 3ic9 h ILE 55 Cb 0.03 0.34 -0.06 0.00 -0.74 0.00 0.00 36.82 36.38 3ic9 h ILE 55 CO -0.02 0.12 0.63 0.00 0.00 0.00 0.00 178.15 178.89 3ic9 h ALA 56 N 1.24 1.34 -0.32 1.87 0.00 -0.93 0.23 119.26 122.70 3ic9 h ALA 56 Ca 0.22 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 3ic9 h ALA 56 Cb 0.02 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 3ic9 h ALA 56 CO -0.10 0.45 -0.08 0.00 0.00 0.00 0.00 179.25 179.52 3ic9 h ALA 57 N 1.43 0.44 -0.51 0.00 0.00 -1.07 -2.25 119.26 117.30 3ic9 h ALA 57 Ca 0.41 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3ic9 h ALA 57 Cb 0.12 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3ic9 h ALA 57 CO -0.16 0.27 0.27 0.00 0.00 0.00 0.00 179.25 179.64 3ic9 h ALA 58 N 0.80 0.65 -0.65 0.00 0.00 -0.52 -1.08 119.26 118.47 3ic9 h ALA 58 Ca 0.08 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 3ic9 h ALA 58 Cb 0.58 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3ic9 h ALA 58 CO 0.03 0.18 0.07 -0.44 0.00 0.00 0.00 179.25 179.09 3ic9 h ASP 59 N 0.67 1.06 -0.50 0.00 5.19 -0.53 0.11 116.42 122.42 3ic9 h ASP 59 Ca 0.18 -0.27 0.00 0.00 -0.62 0.00 0.00 57.03 56.32 3ic9 h ASP 59 Cb 0.06 -0.28 -0.02 0.00 0.18 0.00 0.00 39.33 39.27 3ic9 h ASP 59 CO -0.03 1.07 0.32 0.00 -3.12 0.00 0.00 179.24 177.47 3ic9 h ALA 60 N 1.05 0.63 -0.03 3.45 0.00 -1.12 -0.13 119.26 123.11 3ic9 h ALA 60 Ca 0.19 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3ic9 h ALA 60 Cb 0.48 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 3ic9 h ALA 60 CO 0.02 0.10 -0.00 1.03 0.00 0.00 0.00 179.25 180.39 3ic9 h SER 61 N 0.67 0.05 -0.12 0.00 0.87 -0.94 -2.80 113.55 111.29 3ic9 h SER 61 Ca 0.18 -0.35 -0.01 0.00 -1.23 0.00 0.00 61.79 60.39 3ic9 h SER 61 Cb -0.05 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 3ic9 h SER 61 CO -0.04 0.39 0.05 0.22 -0.53 0.00 0.00 176.83 176.92 3ic9 h TYR 62 N -0.28 0.18 0.00 2.24 3.20 -0.74 -2.47 116.97 119.09 3ic9 h TYR 62 Ca 0.01 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 3ic9 h TYR 62 Cb 0.36 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.58 3ic9 h TYR 62 CO 0.04 0.26 -0.08 0.45 -1.64 0.00 0.00 178.16 177.19 3ic9 h HIS 63 N 0.05 0.00 0.00 -3.82 3.86 -1.09 -0.72 115.15 113.43 3ic9 h HIS 63 Ca 0.04 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.20 3ic9 h HIS 63 Cb 0.15 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.62 3ic9 h HIS 63 CO -0.02 0.08 -0.25 0.00 0.86 0.00 0.00 177.93 178.60 3ic9 h ALA 64 N 1.92 1.30 -0.01 2.45 0.00 -1.16 -1.77 119.26 121.99 3ic9 h ALA 64 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3ic9 h ALA 64 Cb 0.17 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3ic9 h ALA 64 CO 0.01 0.31 -0.08 -1.13 0.00 0.00 0.00 179.25 178.36 3ic9 n SER 65 N -3.83 0.96 -0.83 0.00 3.41 -0.29 -4.16 113.62 108.89 3ic9 n SER 65 Ca -0.02 -1.09 0.04 0.00 -0.26 0.00 0.00 58.87 57.54 3ic9 n SER 65 Cb 0.34 0.01 0.21 0.00 -0.26 0.00 0.00 64.21 64.52 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 -0.41 2.13 0.00 4.33 1.13 -0.67 -4.70 117.38 119.19 3ic9 n GLN 66 Ca 0.17 -2.96 0.13 0.00 -1.94 0.00 0.00 57.00 52.40 3ic9 n GLN 66 Cb 0.30 -1.76 0.46 0.00 0.11 0.00 0.00 30.24 29.36 3ic9 n GLN 66 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 3ic9 n THR 67 N -0.95 0.00 -0.25 5.09 -2.24 -1.25 -4.19 114.28 110.49 3ic9 n THR 67 Ca 0.25 -0.01 0.04 0.00 -2.27 0.00 0.00 64.05 62.07 3ic9 n THR 67 Cb 0.89 -0.14 0.17 0.00 -2.10 0.00 0.00 70.33 69.15 3ic9 n THR 67 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 3ic9 h ASP 68 N 0.06 0.23 -0.98 3.42 3.58 -1.80 -0.35 116.42 120.58 3ic9 h ASP 68 Ca 0.00 0.11 0.22 0.00 0.42 0.00 0.00 57.03 57.78 3ic9 h ASP 68 Cb 0.48 0.10 -0.09 0.00 1.72 0.00 0.00 39.33 41.55 3ic9 h ASP 68 CO 0.00 0.08 0.63 0.25 -2.88 0.00 0.00 179.24 177.32 3ic9 h LEU 69 N 0.41 0.54 0.00 2.28 5.85 -1.87 -0.55 115.31 121.97 3ic9 h LEU 69 Ca 0.40 0.07 0.00 0.00 0.84 0.00 0.00 57.88 59.19 3ic9 h LEU 69 Cb 0.60 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.61 3ic9 h LEU 69 CO -0.41 0.17 -0.27 0.49 -0.34 0.00 0.00 178.44 178.08 3ic9 n PHE 70 N -4.63 0.31 0.00 1.25 3.01 -0.16 -4.90 117.46 112.34 3ic9 n PHE 70 Ca 0.23 0.09 0.00 0.00 1.01 0.00 0.00 57.45 58.78 3ic9 n PHE 70 Cb 0.72 -0.56 0.00 0.00 -0.01 0.00 0.00 39.48 39.64 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 1.43 1.10 3.31 1.37 0.00 -0.21 -5.10 105.19 107.07 3ic9 n GLY 71 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 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 2.13 -0.12 -0.61 1.01 -1.12 -5.02 121.20 115.47 3ic9 s ILE 72 Ca 0.00 -1.06 -0.00 0.00 0.00 0.00 0.00 60.65 59.58 3ic9 s ILE 72 Cb 0.00 -1.75 -0.02 0.00 0.01 0.00 0.00 42.46 40.70 3ic9 s ILE 72 CO 0.00 0.58 -0.11 -1.58 0.00 0.00 0.00 174.94 173.83 3ic9 s GLN 73 N -0.45 3.34 -0.16 2.79 0.74 -1.26 -2.77 119.66 121.89 3ic9 s GLN 73 Ca 0.05 -0.65 -0.02 0.00 0.05 0.00 0.00 55.36 54.80 3ic9 s GLN 73 Cb -0.11 -2.66 -0.01 0.00 1.10 0.00 0.00 33.01 31.32 3ic9 s GLN 73 CO 0.01 0.28 -0.09 0.08 -0.55 0.00 0.00 175.29 175.01 3ic9 s VAL 74 N 0.20 3.26 -0.17 1.34 1.01 -1.26 -5.10 120.40 119.68 3ic9 s VAL 74 Ca -0.07 -0.57 -0.08 0.00 0.00 0.00 0.00 61.98 61.26 3ic9 s VAL 74 Cb -0.15 -2.41 -0.04 0.00 0.00 0.00 0.00 36.38 33.77 3ic9 s VAL 74 CO 0.05 0.49 0.12 -1.81 0.00 0.00 0.00 175.10 173.95 3ic9 s ASP 75 N 0.66 6.14 -0.67 3.32 1.01 -1.26 -4.77 116.67 121.10 3ic9 s ASP 75 Ca -0.05 0.28 -0.12 0.00 0.71 0.00 0.00 52.55 53.37 3ic9 s ASP 75 Cb -0.15 -2.04 0.02 0.00 1.01 0.00 0.00 42.92 41.76 3ic9 s ASP 75 CO 0.02 0.26 0.64 -1.14 0.21 0.00 0.00 175.17 175.16 3ic9 n ARG 76 N 3.01 -1.70 -2.24 8.23 0.63 -1.26 -4.91 116.66 118.41 3ic9 n ARG 76 Ca -0.17 1.24 -0.43 0.00 -0.92 0.00 0.00 57.85 57.57 3ic9 n ARG 76 Cb 0.53 -3.34 -0.02 0.00 0.45 0.00 0.00 32.46 30.07 3ic9 n ARG 76 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 3ic9 s ILE 77 N -2.56 3.95 -0.13 5.15 1.01 -1.26 -4.99 121.20 122.36 3ic9 s ILE 77 Ca 0.13 1.12 0.02 0.00 0.00 0.00 0.00 60.65 61.92 3ic9 s ILE 77 Cb -0.02 -3.80 0.01 0.00 0.01 0.00 0.00 42.46 38.67 3ic9 s ILE 77 CO 0.85 -0.18 -0.18 -0.55 0.00 0.00 0.00 174.94 174.88 3ic9 s SER 78 N 2.90 2.77 -0.38 3.58 0.15 -1.26 -5.10 113.70 116.37 3ic9 s SER 78 Ca 0.64 -0.52 -0.22 0.00 0.70 0.00 0.00 55.95 56.55 3ic9 s SER 78 Cb -0.25 -1.26 0.01 0.00 -1.71 0.00 0.00 66.02 62.81 3ic9 s SER 78 CO 0.23 0.03 0.71 -0.69 1.20 0.00 0.00 173.24 174.71 3ic9 s VAL 79 N 1.01 4.80 -0.80 4.45 1.01 -1.26 -5.00 120.40 124.62 3ic9 s VAL 79 Ca -0.04 0.63 -0.22 0.00 0.00 0.00 0.00 61.98 62.35 3ic9 s VAL 79 Cb -0.15 -4.16 0.08 0.00 0.00 0.00 0.00 36.38 32.15 3ic9 s VAL 79 CO -0.04 -0.43 1.11 0.21 0.00 0.00 0.00 175.10 175.96 3ic9 s ASN 80 N 1.87 6.35 0.27 3.32 3.84 -1.26 -4.90 114.94 124.43 3ic9 s ASN 80 Ca 0.27 -1.30 -0.00 0.00 0.21 0.00 0.00 52.86 52.04 3ic9 s ASN 80 Cb -0.14 -2.45 0.52 0.00 -0.55 0.00 0.00 41.25 38.63 3ic9 s ASN 80 CO 0.17 -1.38 1.81 1.23 -2.79 0.00 0.00 177.10 176.14 3ic9 h GLY 81 N 11.46 1.51 0.97 1.21 0.00 -1.94 0.83 103.07 117.10 3ic9 h GLY 81 Ca -0.09 -0.36 -0.00 0.00 0.00 0.00 0.00 47.33 46.87 3ic9 h GLY 81 CO 1.20 0.10 0.18 0.50 0.00 0.00 0.00 176.54 178.52 3ic9 h LYS 82 N 0.86 0.42 -0.27 4.80 1.57 -1.91 -3.05 116.57 118.99 3ic9 h LYS 82 Ca 0.47 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 59.20 3ic9 h LYS 82 Cb 0.51 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 3ic9 h LYS 82 CO -0.29 0.34 0.15 0.00 -0.57 0.00 0.00 179.45 179.08 3ic9 h ALA 83 N 1.06 0.34 0.00 3.86 0.00 -1.71 -0.14 119.26 122.67 3ic9 h ALA 83 Ca 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3ic9 h ALA 83 Cb 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3ic9 h ALA 83 CO -0.02 -0.13 0.00 0.28 0.00 0.00 0.00 179.25 179.38 3ic9 n VAL 84 N -4.84 0.00 0.00 0.00 0.31 0.22 -1.24 118.33 112.78 3ic9 n VAL 84 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 3ic9 n VAL 84 Cb 0.07 -0.21 0.00 0.00 -0.91 0.00 0.00 33.84 32.79 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 0.05 0.00 -0.14 5.55 3.00 -0.07 -2.52 118.16 124.04 3ic9 n LYS 86 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 58.31 58.23 3ic9 n LYS 86 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 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 0.58 -0.13 1.64 2.43 -1.43 -0.55 114.38 116.93 3ic9 h ARG 87 Ca 0.00 -0.06 0.03 0.00 -0.81 0.00 0.00 59.98 59.14 3ic9 h ARG 87 Cb 0.00 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.40 3ic9 h ARG 87 CO 0.00 0.46 -0.08 0.82 -1.51 0.00 0.00 179.97 179.66 3ic9 h ILE 88 N 0.54 0.75 -0.27 1.20 2.04 -1.75 -1.29 117.51 118.74 3ic9 h ILE 88 Ca 0.15 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.00 3ic9 h ILE 88 Cb 0.04 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 36.86 3ic9 h ILE 88 CO -0.02 0.00 0.16 1.56 0.00 0.00 0.00 178.15 179.84 3ic9 h GLN 89 N -0.08 0.38 -0.33 2.37 4.20 -1.77 0.15 115.11 120.03 3ic9 h GLN 89 Ca 0.08 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.71 3ic9 h GLN 89 Cb 0.19 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 3ic9 h GLN 89 CO -0.18 0.32 0.06 1.79 -0.67 0.00 0.00 178.83 180.15 3ic9 h THR 90 N 0.34 1.23 -0.77 -0.54 1.35 -1.01 0.05 112.91 113.56 3ic9 h THR 90 Ca 0.10 -0.80 -0.02 0.00 -0.55 0.00 0.00 66.41 65.14 3ic9 h THR 90 Cb 0.04 1.11 -0.04 0.00 -1.73 0.00 0.00 68.15 67.54 3ic9 h THR 90 CO -0.02 0.27 0.39 -0.33 -0.25 0.00 0.00 175.52 175.58 3ic9 h GLU 91 N 0.38 1.10 -0.11 4.72 4.39 -1.15 -1.44 114.58 122.47 3ic9 h GLU 91 Ca 0.10 -0.15 0.01 0.00 0.34 0.00 0.00 59.36 59.66 3ic9 h GLU 91 Cb 0.33 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 3ic9 h GLU 91 CO 0.00 0.84 0.04 -0.09 -1.16 0.00 0.00 179.01 178.64 3ic9 h ARG 92 N 1.08 0.09 -0.85 2.33 1.12 -0.78 -1.52 114.38 115.85 3ic9 h ARG 92 Ca 0.27 -0.01 0.10 0.00 -1.11 0.00 0.00 59.98 59.23 3ic9 h ARG 92 Cb 0.09 -0.02 -0.08 0.00 -0.01 0.00 0.00 29.97 29.95 3ic9 h ARG 92 CO -0.04 0.06 0.49 -0.44 -3.11 0.00 0.00 179.97 176.94 3ic9 h ASP 93 N 0.10 0.71 -0.44 -3.80 3.45 -0.74 -1.60 116.42 114.10 3ic9 h ASP 93 Ca 0.04 0.05 0.02 0.00 0.43 0.00 0.00 57.03 57.58 3ic9 h ASP 93 Cb 0.02 -0.09 -0.03 0.00 -0.56 0.00 0.00 39.33 38.67 3ic9 h ASP 93 CO -0.04 0.40 0.25 -0.09 -1.57 0.00 0.00 179.24 178.19 3ic9 h ARG 94 N 0.82 0.49 -0.29 3.56 2.43 -0.43 -0.66 114.38 120.29 3ic9 h ARG 94 Ca 0.41 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.55 3ic9 h ARG 94 Cb 0.39 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 3ic9 h ARG 94 CO -0.25 0.32 0.15 0.74 -1.51 0.00 0.00 179.97 179.42 3ic9 h PHE 95 N 0.50 0.41 -0.95 2.20 0.04 -0.67 -2.70 116.94 115.78 3ic9 h PHE 95 Ca 0.18 -0.01 0.06 0.00 2.80 0.00 0.00 57.97 60.99 3ic9 h PHE 95 Cb 0.03 -0.13 -0.06 0.00 2.20 0.00 0.00 35.95 37.99 3ic9 h PHE 95 CO -0.08 0.35 0.61 0.28 -0.60 0.00 0.00 178.31 178.86 3ic9 h VAL 96 N 0.35 1.09 -0.93 -0.55 2.07 -1.14 -2.47 116.25 114.67 3ic9 h VAL 96 Ca 0.10 -0.38 0.11 0.00 0.82 0.00 0.00 66.70 67.35 3ic9 h VAL 96 Cb 0.08 -0.13 -0.07 0.00 -1.52 0.00 0.00 31.29 29.65 3ic9 h VAL 96 CO -0.02 0.20 0.60 1.23 0.02 0.00 0.00 177.57 179.60 3ic9 h GLY 97 N 1.12 1.38 1.19 2.17 0.00 -0.79 0.06 103.07 108.20 3ic9 h GLY 97 Ca 0.40 -0.38 -0.06 0.00 0.00 0.00 0.00 47.33 47.30 3ic9 h GLY 97 CO -0.16 0.19 0.18 0.74 0.00 0.00 0.00 176.54 177.48 3ic9 h PHE 98 N 0.91 1.05 -0.19 5.60 0.05 -1.28 -1.39 116.94 121.70 3ic9 h PHE 98 Ca 0.44 -0.11 -0.10 0.00 3.82 0.00 0.00 57.97 62.03 3ic9 h PHE 98 Cb 0.45 -0.30 -0.00 0.00 2.00 0.00 0.00 35.95 38.10 3ic9 h PHE 98 CO -0.00 0.85 -0.27 0.28 -0.18 0.00 0.00 178.31 179.00 3ic9 h VAL 99 N 0.97 1.34 -1.00 -0.55 2.07 -1.17 -2.63 116.25 115.28 3ic9 h VAL 99 Ca 0.21 -1.47 0.07 0.00 0.82 0.00 0.00 66.70 66.33 3ic9 h VAL 99 Cb 0.32 1.84 -0.07 0.00 -1.52 0.00 0.00 31.29 31.86 3ic9 h VAL 99 CO -0.00 0.45 0.65 0.58 0.02 0.00 0.00 177.57 179.26 3ic9 h VAL 100 N 0.18 1.08 -0.69 2.57 2.07 -0.94 0.71 116.25 121.22 3ic9 h VAL 100 Ca 0.02 -0.40 -0.05 0.00 0.82 0.00 0.00 66.70 67.09 3ic9 h VAL 100 Cb 0.84 -0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 30.38 3ic9 h VAL 100 CO 0.06 0.21 0.22 1.05 0.02 0.00 0.00 177.57 179.14 3ic9 h GLU 101 N 1.17 1.06 0.04 1.57 4.11 -1.13 0.15 114.58 121.56 3ic9 h GLU 101 Ca 0.44 -0.21 -0.00 0.00 0.07 0.00 0.00 59.36 59.65 3ic9 h GLU 101 Cb 0.18 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3ic9 h GLU 101 CO -0.18 0.90 -0.02 0.77 0.07 0.00 0.00 179.01 180.55 3ic9 h SER 102 N 1.02 -0.05 -0.75 3.06 0.02 -0.91 -1.56 113.55 114.39 3ic9 h SER 102 Ca 0.23 -0.09 0.11 0.00 -0.84 0.00 0.00 61.79 61.20 3ic9 h SER 102 Cb 0.28 0.01 -0.08 0.00 0.14 0.00 0.00 62.40 62.76 3ic9 h SER 102 CO -0.01 0.05 0.37 0.58 -1.14 0.00 0.00 176.83 176.69 3ic9 h VAL 103 N -0.15 0.82 -0.06 2.27 2.07 -0.67 -1.51 116.25 119.02 3ic9 h VAL 103 Ca -0.01 -0.21 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 3ic9 h VAL 103 Cb 0.13 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.05 3ic9 h VAL 103 CO 0.01 0.11 -0.10 -0.08 0.02 0.00 0.00 177.57 177.53 3ic9 h GLU 104 N 0.61 0.08 0.00 1.57 4.57 -0.38 -2.34 114.58 118.69 3ic9 h GLU 104 Ca 0.38 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.54 3ic9 h GLU 104 Cb 0.44 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.01 3ic9 h GLU 104 CO -0.29 0.19 0.00 0.66 -1.18 0.00 0.00 179.01 178.38 3ic9 h SER 105 N 0.08 0.00 -4.02 1.04 4.64 -0.25 -3.45 113.55 111.59 3ic9 h SER 105 Ca 0.02 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.84 3ic9 h SER 105 Cb 0.23 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.37 3ic9 h SER 105 CO 0.01 0.00 0.46 -0.36 -0.87 0.00 0.00 176.83 176.07 3ic9 s PHE 106 N -3.40 2.89 0.11 4.77 0.08 -0.88 -4.94 117.98 116.60 3ic9 s PHE 106 Ca 0.05 1.55 -0.36 0.00 0.12 0.00 0.00 56.93 58.29 3ic9 s PHE 106 Cb 0.09 -3.31 -0.16 0.00 -0.57 0.00 0.00 43.02 39.07 3ic9 s PHE 106 CO 0.54 -1.36 1.35 -0.25 -0.10 0.00 0.00 175.22 175.40 3ic9 n ASP 107 N -0.64 1.81 -0.10 1.36 10.43 -1.26 -4.87 116.55 123.28 3ic9 n ASP 107 Ca 0.08 1.12 0.07 0.00 2.57 0.00 0.00 54.79 58.63 3ic9 n ASP 107 Cb 0.49 -1.23 0.42 0.00 1.84 0.00 0.00 41.12 42.65 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 4.60 0.58 0.00 -1.24 4.39 -1.92 -0.77 114.58 120.22 3ic9 h GLU 108 Ca -0.47 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.20 3ic9 h GLU 108 Cb 1.33 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.85 3ic9 h GLU 108 CO 0.78 0.38 0.00 0.00 -1.16 0.00 0.00 179.01 179.01 3ic9 n GLN 109 N -4.47 0.10 0.00 2.33 10.64 -1.26 -2.56 117.38 122.15 3ic9 n GLN 109 Ca 0.08 0.18 0.13 0.00 -1.83 0.00 0.00 57.00 55.56 3ic9 n GLN 109 Cb 0.22 -1.50 0.26 0.00 -0.86 0.00 0.00 30.24 28.37 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 -1.41 2.17 -4.17 2.61 8.00 -0.30 -4.87 116.55 118.58 3ic9 n ASP 110 Ca 0.06 -1.66 -0.32 0.00 0.71 0.00 0.00 54.79 53.57 3ic9 n ASP 110 Cb 0.17 0.07 -0.17 0.00 -0.02 0.00 0.00 41.12 41.17 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 -2.10 2.92 -0.09 -1.24 1.02 -1.06 0.75 119.74 119.93 3ic9 s LYS 111 Ca 0.30 -0.82 0.04 0.00 0.02 0.00 0.00 55.97 55.51 3ic9 s LYS 111 Cb 0.20 -2.31 0.00 0.00 -0.52 0.00 0.00 37.83 35.20 3ic9 s LYS 111 CO 0.37 0.05 -0.22 0.42 -0.92 0.00 0.00 175.35 175.04 3ic9 s ILE 112 N 0.67 1.92 -0.06 2.17 1.01 0.16 -4.95 121.20 122.13 3ic9 s ILE 112 Ca -0.11 -0.94 -0.22 0.00 0.00 0.00 0.00 60.65 59.39 3ic9 s ILE 112 Cb -0.16 -1.66 -0.04 0.00 0.01 0.00 0.00 42.46 40.60 3ic9 s ILE 112 CO 0.02 0.53 0.63 -0.60 0.00 0.00 0.00 174.94 175.51 3ic9 s ARG 113 N 0.37 4.39 0.00 2.79 6.06 -1.26 -1.63 118.95 129.67 3ic9 s ARG 113 Ca -0.18 0.75 0.00 0.00 -2.50 0.00 0.00 55.73 53.80 3ic9 s ARG 113 Cb -0.17 -3.41 0.00 0.00 0.06 0.00 0.00 34.95 31.42 3ic9 s ARG 113 CO 0.08 0.17 0.00 0.41 -2.50 0.00 0.00 175.30 173.46 3ic9 n GLY 114 N 2.95 2.84 3.67 8.12 0.00 -0.38 -4.88 105.19 117.50 3ic9 n GLY 114 Ca -0.04 -1.82 -0.39 0.00 0.00 0.00 0.00 46.02 43.77 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 -1.86 3.38 0.20 1.61 0.40 -1.26 -2.02 117.98 118.42 3ic9 s PHE 115 Ca 0.00 0.82 -0.11 0.00 -0.60 0.00 0.00 56.93 57.03 3ic9 s PHE 115 Cb 0.00 -2.69 -0.07 0.00 0.51 0.00 0.00 43.02 40.77 3ic9 s PHE 115 CO 0.00 -0.10 0.55 0.00 0.70 0.00 0.00 175.22 176.37 3ic9 s ALA 116 N 1.62 3.57 0.02 5.36 0.00 -1.26 -1.93 121.76 129.14 3ic9 s ALA 116 Ca 0.25 -0.22 -0.05 0.00 0.00 0.00 0.00 51.96 51.94 3ic9 s ALA 116 Cb -0.16 -2.47 -0.01 0.00 0.00 0.00 0.00 23.12 20.49 3ic9 s ALA 116 CO 0.10 0.49 0.09 -1.59 0.00 0.00 0.00 175.76 174.85 3ic9 s LYS 117 N -2.49 0.50 0.09 0.00 -2.85 -0.24 -4.78 119.74 109.97 3ic9 s LYS 117 Ca 0.44 -0.59 -0.30 0.00 -1.00 0.00 0.00 55.97 54.51 3ic9 s LYS 117 Cb -0.13 0.20 -0.06 0.00 -2.06 0.00 0.00 37.83 35.79 3ic9 s LYS 117 CO 0.20 -0.12 1.10 -0.06 0.10 0.00 0.00 175.35 176.57 3ic9 s PHE 118 N -1.94 3.57 -0.20 1.78 0.08 0.66 -0.13 117.98 121.80 3ic9 s PHE 118 Ca -0.11 1.52 -0.06 0.00 0.12 0.00 0.00 56.93 58.41 3ic9 s PHE 118 Cb -0.05 -3.28 -0.20 0.00 -0.57 0.00 0.00 43.02 38.92 3ic9 s PHE 118 CO -0.02 -0.66 0.04 1.28 -0.10 0.00 0.00 175.22 175.77 3ic9 n LEU 119 N 3.37 2.62 0.00 -0.37 4.77 0.11 -4.67 117.00 122.83 3ic9 n LEU 119 Ca 0.06 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 3ic9 n LEU 119 Cb 0.48 -0.99 0.00 0.00 -2.33 0.00 0.00 43.42 40.57 3ic9 n LEU 119 CO 0.54 0.80 0.00 -0.90 -1.33 0.00 0.00 177.39 176.50 3ic9 n ASP 120 N -3.57 0.00 0.06 -1.43 5.68 -1.10 -4.83 116.55 111.36 3ic9 n ASP 120 Ca -0.40 -0.99 0.09 0.00 -0.50 0.00 0.00 54.79 52.99 3ic9 n ASP 120 Cb 0.97 0.00 0.37 0.00 -1.14 0.00 0.00 41.12 41.32 3ic9 n ASP 120 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3ic9 n GLU 121 N 0.00 0.09 0.00 0.11 1.02 -1.26 -2.65 120.64 117.95 3ic9 n GLU 121 Ca 0.00 0.37 0.00 0.00 -0.02 0.00 0.00 57.16 57.51 3ic9 n GLU 121 Cb 0.00 -1.68 0.00 0.00 -0.02 0.00 0.00 31.44 29.74 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 -1.85 0.00 -3.97 -0.32 8.25 -1.26 -4.93 115.22 111.14 3ic9 n HIS 122 Ca 0.02 -0.15 -0.25 0.00 -0.26 0.00 0.00 57.72 57.08 3ic9 n HIS 122 Cb 0.17 -0.02 -0.17 0.00 1.12 0.00 0.00 29.99 31.09 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 -0.31 0.88 -0.04 1.59 2.01 -1.08 -0.65 115.64 118.04 3ic9 s THR 123 Ca 0.00 -0.22 0.01 0.00 0.31 0.00 0.00 61.69 61.79 3ic9 s THR 123 Cb 0.00 -0.91 -0.03 0.00 0.01 0.00 0.00 72.50 71.57 3ic9 s THR 123 CO 0.00 0.34 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.48 3ic9 s LEU 124 N 1.58 3.39 -0.12 4.42 1.02 -0.29 0.07 118.68 128.75 3ic9 s LEU 124 Ca 0.02 0.01 -0.03 0.00 0.02 0.00 0.00 54.13 54.15 3ic9 s LEU 124 Cb -0.13 -1.85 -0.03 0.00 0.02 0.00 0.00 46.19 44.20 3ic9 s LEU 124 CO -0.06 0.33 -0.02 -1.58 0.02 0.00 0.00 176.35 175.04 3ic9 s GLN 125 N -1.15 3.32 -0.24 1.70 0.74 0.81 -0.63 119.66 124.22 3ic9 s GLN 125 Ca 0.16 -0.48 -0.04 0.00 0.05 0.00 0.00 55.36 55.04 3ic9 s GLN 125 Cb -0.11 -2.84 -0.00 0.00 1.10 0.00 0.00 33.01 31.15 3ic9 s GLN 125 CO 0.05 0.46 -0.01 0.54 -0.55 0.00 0.00 175.29 175.78 3ic9 s VAL 126 N -0.22 3.50 0.00 1.34 0.11 0.36 -1.07 120.40 124.42 3ic9 s VAL 126 Ca 0.04 -0.56 0.00 0.00 -2.93 0.00 0.00 61.98 58.53 3ic9 s VAL 126 Cb -0.13 -2.66 0.00 0.00 -1.53 0.00 0.00 36.38 32.07 3ic9 s VAL 126 CO 0.02 0.33 0.00 0.47 -3.33 0.00 0.00 175.10 172.59 3ic9 n ASP 127 N 4.81 0.00 -0.98 3.54 10.43 -0.81 -2.17 116.55 131.37 3ic9 n ASP 127 Ca -0.17 0.00 -0.00 0.00 2.57 0.00 0.00 54.79 57.19 3ic9 n ASP 127 Cb 0.50 0.00 0.21 0.00 1.84 0.00 0.00 41.12 43.66 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 0.34 2.53 0.00 -2.24 5.68 -1.26 -4.73 116.55 116.88 3ic9 n ASP 128 Ca 0.00 -3.65 0.00 0.00 -0.50 0.00 0.00 54.79 50.64 3ic9 n ASP 128 Cb 0.00 -0.60 0.00 0.00 -1.14 0.00 0.00 41.12 39.38 3ic9 n ASP 128 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3ic9 n HIS 129 N -1.07 0.00 -3.86 2.11 1.44 -0.92 -5.01 115.22 107.91 3ic9 n HIS 129 Ca 0.29 0.00 -0.11 0.00 -2.01 0.00 0.00 57.72 55.88 3ic9 n HIS 129 Cb 0.94 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.94 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 -1.77 -0.02 -0.06 4.39 0.01 -1.06 -2.48 113.70 112.70 3ic9 s SER 130 Ca 0.00 -0.02 0.05 0.00 1.31 0.00 0.00 55.95 57.29 3ic9 s SER 130 Cb 0.00 0.22 -0.01 0.00 0.21 0.00 0.00 66.02 66.43 3ic9 s SER 130 CO 0.00 -0.20 -0.22 -1.10 0.41 0.00 0.00 173.24 172.13 3ic9 s GLN 131 N -0.69 2.61 -0.19 12.44 -0.21 -0.05 -0.48 119.66 133.09 3ic9 s GLN 131 Ca -0.08 -0.85 -0.01 0.00 0.02 0.00 0.00 55.36 54.44 3ic9 s GLN 131 Cb -0.05 -2.24 0.01 0.00 1.00 0.00 0.00 33.01 31.73 3ic9 s GLN 131 CO 0.01 0.41 -0.13 0.08 -2.12 0.00 0.00 175.29 173.54 3ic9 s VAL 132 N -0.22 2.67 -0.29 1.09 1.01 0.20 -1.17 120.40 123.69 3ic9 s VAL 132 Ca -0.01 -0.74 -0.10 0.00 0.00 0.00 0.00 61.98 61.13 3ic9 s VAL 132 Cb -0.13 -2.16 -0.03 0.00 0.00 0.00 0.00 36.38 34.06 3ic9 s VAL 132 CO 0.03 0.49 0.16 -0.51 0.00 0.00 0.00 175.10 175.28 3ic9 s ILE 133 N 1.26 4.91 -0.08 2.22 2.07 0.23 -1.14 121.20 130.67 3ic9 s ILE 133 Ca 0.03 -0.13 0.03 0.00 -1.41 0.00 0.00 60.65 59.17 3ic9 s ILE 133 Cb -0.14 -3.41 0.01 0.00 0.13 0.00 0.00 42.46 39.05 3ic9 s ILE 133 CO -0.07 0.17 -0.16 0.00 -1.91 0.00 0.00 174.94 172.97 3ic9 s ALA 134 N 1.68 1.61 0.25 1.50 0.00 0.18 -1.55 121.76 125.44 3ic9 s ALA 134 Ca 0.06 -0.64 -0.05 0.00 0.00 0.00 0.00 51.96 51.33 3ic9 s ALA 134 Cb -0.16 -0.68 0.27 0.00 0.00 0.00 0.00 23.12 22.55 3ic9 s ALA 134 CO 0.08 0.14 1.83 0.87 0.00 0.00 0.00 175.76 178.68 3ic9 h LYS 135 N 6.95 1.09 -4.42 0.00 1.57 -1.31 -3.43 116.57 117.03 3ic9 h LYS 135 Ca -0.27 -0.17 -0.29 0.00 -1.87 0.00 0.00 60.65 58.05 3ic9 h LYS 135 Cb 1.20 -0.19 -0.24 0.00 0.08 0.00 0.00 32.23 33.08 3ic9 h LYS 135 CO 0.48 0.87 -0.74 1.03 -0.57 0.00 0.00 179.45 180.51 3ic9 s ARG 136 N -5.55 0.46 -0.02 3.15 3.00 0.94 -4.92 118.95 116.01 3ic9 s ARG 136 Ca -0.12 -0.49 0.03 0.00 0.00 0.00 0.00 55.73 55.15 3ic9 s ARG 136 Cb 0.16 -0.32 -0.00 0.00 0.00 0.00 0.00 34.95 34.79 3ic9 s ARG 136 CO 0.82 0.07 -0.10 0.42 0.00 0.00 0.00 175.30 176.52 3ic9 s ILE 137 N -0.82 0.80 -0.20 1.52 1.01 -0.60 -1.55 121.20 121.37 3ic9 s ILE 137 Ca -0.05 -0.40 0.00 0.00 0.00 0.00 0.00 60.65 60.21 3ic9 s ILE 137 Cb -0.06 -0.69 0.02 0.00 0.01 0.00 0.00 42.46 41.73 3ic9 s ILE 137 CO 0.00 0.24 -0.16 -0.69 0.00 0.00 0.00 174.94 174.34 3ic9 s VAL 138 N 0.01 2.31 -0.40 2.92 1.01 0.55 -1.19 120.40 125.62 3ic9 s VAL 138 Ca -0.00 -0.99 -0.26 0.00 0.00 0.00 0.00 61.98 60.73 3ic9 s VAL 138 Cb -0.07 -2.06 0.02 0.00 0.00 0.00 0.00 36.38 34.28 3ic9 s VAL 138 CO 0.00 0.41 0.94 -0.63 0.00 0.00 0.00 175.10 175.82 3ic9 s ILE 139 N 1.29 4.53 -0.39 2.22 1.01 0.03 -0.22 121.20 129.68 3ic9 s ILE 139 Ca 0.03 1.08 0.12 0.00 0.00 0.00 0.00 60.65 61.87 3ic9 s ILE 139 Cb -0.14 -4.37 0.41 0.00 0.01 0.00 0.00 42.46 38.36 3ic9 s ILE 139 CO -0.10 -0.64 0.93 0.00 0.00 0.00 0.00 174.94 175.13 3ic9 n ALA 140 N 6.93 3.61 0.90 9.38 0.00 0.67 -0.74 120.51 141.26 3ic9 n ALA 140 Ca 0.07 -3.67 0.12 0.00 0.00 0.00 0.00 53.44 49.96 3ic9 n ALA 140 Cb 0.48 -0.82 0.30 0.00 0.00 0.00 0.00 19.45 19.40 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 -0.10 0.26 -4.70 0.00 -2.24 -1.17 -4.16 114.28 102.19 3ic9 n THR 141 Ca 0.22 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 3ic9 n THR 141 Cb 0.69 0.75 0.00 0.00 -2.10 0.00 0.00 70.33 69.67 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 1.30 0.25 3.40 3.38 0.00 -1.26 -4.56 105.19 107.70 3ic9 n GLY 142 Ca 0.17 -0.95 -0.20 0.00 0.00 0.00 0.00 46.02 45.04 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 2.61 0.21 1.61 1.04 -1.26 -0.95 113.70 112.96 3ic9 s SER 143 Ca 0.00 -1.16 0.07 0.00 0.48 0.00 0.00 55.95 55.35 3ic9 s SER 143 Cb 0.00 -0.14 -0.05 0.00 0.10 0.00 0.00 66.02 65.93 3ic9 s SER 143 CO 0.00 -0.33 -0.12 0.00 0.98 0.00 0.00 173.24 173.77 3ic9 s ARG 144 N -3.73 1.35 0.74 4.02 1.70 0.41 -4.86 118.95 118.59 3ic9 s ARG 144 Ca 0.28 -1.62 -0.13 0.00 -0.47 0.00 0.00 55.73 53.79 3ic9 s ARG 144 Cb 0.03 -1.09 0.04 0.00 -0.57 0.00 0.00 34.95 33.37 3ic9 s ARG 144 CO 0.10 0.15 1.13 -1.25 -1.08 0.00 0.00 175.30 174.35 3ic9 s PRO 145 N -3.67 2.25 0.08 3.89 0.04 -1.26 -0.44 135.00 135.88 3ic9 s PRO 145 Ca 0.23 1.44 -0.21 0.00 0.04 0.00 0.00 61.00 62.51 3ic9 s PRO 145 Cb 0.00 -1.88 0.05 0.00 0.04 0.00 0.00 34.50 32.72 3ic9 s PRO 145 CO 0.07 -1.69 0.50 1.21 0.04 0.00 0.00 177.00 177.13 3ic9 s ASN 146 N -2.68 -0.40 0.05 6.66 2.47 -1.23 -4.56 114.94 115.24 3ic9 s ASN 146 Ca 0.67 0.03 -0.25 0.00 0.42 0.00 0.00 52.86 53.73 3ic9 s ASN 146 Cb -0.22 0.50 0.06 0.00 -1.45 0.00 0.00 41.25 40.14 3ic9 s ASN 146 CO 0.49 -0.78 0.59 -0.72 -3.72 0.00 0.00 177.10 172.95 3ic9 s TYR 147 N -2.92 -0.52 0.91 0.43 -0.85 -1.26 -4.14 117.35 108.99 3ic9 s TYR 147 Ca -0.03 0.63 -0.11 0.00 -0.52 0.00 0.00 57.07 57.05 3ic9 s TYR 147 Cb -0.00 0.42 0.14 0.00 0.38 0.00 0.00 41.96 42.89 3ic9 s TYR 147 CO -0.06 -0.69 1.11 -1.25 -1.52 0.00 0.00 175.55 173.15 3ic9 s PRO 148 N -2.40 1.13 0.25 -3.49 0.04 -1.26 -4.93 135.00 124.33 3ic9 s PRO 148 Ca -0.05 1.29 -0.04 0.00 0.04 0.00 0.00 61.00 62.24 3ic9 s PRO 148 Cb -0.01 -1.76 0.40 0.00 0.04 0.00 0.00 34.50 33.18 3ic9 s PRO 148 CO -0.01 -2.47 1.81 1.49 0.04 0.00 0.00 177.00 177.86 3ic9 h GLU 149 N -1.74 0.79 -0.45 4.56 4.57 -2.02 -2.65 114.58 117.64 3ic9 h GLU 149 Ca -0.46 -0.05 0.09 0.00 -1.18 0.00 0.00 59.36 57.76 3ic9 h GLU 149 Cb 1.27 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 29.66 3ic9 h GLU 149 CO 0.46 0.52 0.31 0.27 -1.18 0.00 0.00 179.01 179.40 3ic9 h PHE 150 N 0.82 0.25 0.00 0.92 -5.15 -1.97 -1.07 116.94 110.74 3ic9 h PHE 150 Ca 0.40 0.01 -0.01 0.00 -0.20 0.00 0.00 57.97 58.16 3ic9 h PHE 150 Cb 0.35 -0.08 -0.00 0.00 0.22 0.00 0.00 35.95 36.44 3ic9 h PHE 150 CO -0.06 0.12 -0.07 1.25 -2.00 0.00 0.00 178.31 177.56 3ic9 h LEU 151 N 0.24 0.00 -1.91 2.10 5.85 -1.78 -3.02 115.31 116.79 3ic9 h LEU 151 Ca 0.21 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 3ic9 h LEU 151 Cb 0.51 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.53 3ic9 h LEU 151 CO -0.04 0.07 -0.12 0.00 -0.34 0.00 0.00 178.44 178.01 3ic9 h ALA 152 N 1.93 1.46 0.00 1.25 0.00 -1.29 -2.34 119.26 120.27 3ic9 h ALA 152 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3ic9 h ALA 152 Cb 0.67 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3ic9 h ALA 152 CO 0.01 0.15 0.00 0.00 0.00 0.00 0.00 179.25 179.41 3ic9 n ALA 153 N -2.36 1.60 0.63 0.00 0.00 -1.14 -2.04 120.51 117.20 3ic9 n ALA 153 Ca -0.02 -0.01 0.10 0.00 0.00 0.00 0.00 53.44 53.51 3ic9 n ALA 153 Cb 0.22 -1.26 0.42 0.00 0.00 0.00 0.00 19.45 18.83 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 -1.57 1.89 -0.76 0.00 0.00 -0.83 -1.19 120.51 118.05 3ic9 n ALA 154 Ca 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.42 3ic9 n ALA 154 Cb 0.17 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.28 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 0.50 3.51 0.00 0.00 0.00 -0.86 -1.07 105.19 107.27 3ic9 n GLY 155 Ca 0.04 0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.19 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 5.01 0.00 -1.29 1.61 3.41 -1.26 -2.17 113.62 118.93 3ic9 n SER 156 Ca 0.00 -0.65 0.09 0.00 -0.26 0.00 0.00 58.87 58.06 3ic9 n SER 156 Cb 0.00 -0.04 0.30 0.00 -0.26 0.00 0.00 64.21 64.21 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 -1.04 3.27 -2.97 4.33 1.74 -0.23 -4.90 116.66 116.85 3ic9 n ARG 157 Ca 0.17 -2.67 -0.41 0.00 -0.77 0.00 0.00 57.85 54.16 3ic9 n ARG 157 Cb 0.09 -1.69 -0.05 0.00 -1.02 0.00 0.00 32.46 29.79 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 -1.57 4.07 0.08 0.55 2.96 -0.92 -1.59 118.68 122.26 3ic9 s LEU 158 Ca 0.44 0.91 0.03 0.00 -0.22 0.00 0.00 54.13 55.29 3ic9 s LEU 158 Cb 0.27 -3.06 -0.04 0.00 0.50 0.00 0.00 46.19 43.86 3ic9 s LEU 158 CO 0.24 -0.46 0.10 -0.76 -1.32 0.00 0.00 176.35 174.15 3ic9 s LEU 159 N 2.70 3.87 0.00 -0.68 1.02 0.14 -4.97 118.68 120.76 3ic9 s LEU 159 Ca 0.32 0.02 0.05 0.00 0.02 0.00 0.00 54.13 54.53 3ic9 s LEU 159 Cb -0.15 -2.54 -0.02 0.00 0.02 0.00 0.00 46.19 43.50 3ic9 s LEU 159 CO 0.08 0.17 0.17 0.35 0.02 0.00 0.00 176.35 177.13 3ic9 n THR 160 N 0.39 0.00 0.29 5.49 -2.24 -1.26 -0.46 114.28 116.48 3ic9 n THR 160 Ca -0.08 -2.37 0.19 0.00 -2.27 0.00 0.00 64.05 59.52 3ic9 n THR 160 Cb 0.52 0.91 0.99 0.00 -2.10 0.00 0.00 70.33 70.65 3ic9 n THR 160 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3ic9 h ASN 161 N 1.68 0.00 1.17 3.42 -1.07 -1.88 -0.12 115.58 118.78 3ic9 h ASN 161 Ca -0.30 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.07 3ic9 h ASN 161 Cb 1.20 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.45 3ic9 h ASN 161 CO 0.47 0.00 0.00 0.44 0.07 0.00 0.00 177.43 178.41 3ic9 h ASP 162 N 0.00 0.00 0.00 6.14 3.32 -1.95 -3.37 116.42 120.55 3ic9 h ASP 162 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3ic9 h ASP 162 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 3ic9 h ASP 162 CO 0.00 0.00 -0.25 -0.46 -1.72 0.00 0.00 179.24 176.81 3ic9 n ASN 163 N -2.82 1.26 -0.33 6.45 0.23 -0.87 -4.85 115.26 114.33 3ic9 n ASN 163 Ca 0.02 -0.04 0.06 0.00 -0.53 0.00 0.00 54.58 54.09 3ic9 n ASN 163 Cb 0.34 0.34 0.22 0.00 -2.08 0.00 0.00 39.78 38.60 3ic9 n ASN 163 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 3ic9 h LEU 164 N 0.00 0.77 -0.33 -4.53 5.85 -1.20 -1.78 115.31 114.09 3ic9 h LEU 164 Ca 0.00 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.78 3ic9 h LEU 164 Cb 0.00 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 40.94 3ic9 h LEU 164 CO 0.00 0.39 -0.11 0.49 -0.34 0.00 0.00 178.44 178.87 3ic9 n PHE 165 N -4.71 0.00 1.03 1.25 3.72 -1.26 -3.24 117.46 114.24 3ic9 n PHE 165 Ca 0.17 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.68 3ic9 n PHE 165 Cb 0.37 -0.14 0.03 0.00 -0.94 0.00 0.00 39.48 38.79 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 -0.79 0.40 -1.70 -1.08 -0.58 -0.67 -4.76 120.64 111.45 3ic9 n GLU 166 Ca 0.15 -0.31 -0.42 0.00 -0.42 0.00 0.00 57.16 56.16 3ic9 n GLU 166 Cb 0.28 -1.49 -0.00 0.00 -0.57 0.00 0.00 31.44 29.66 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 -1.03 3.69 0.21 -4.62 4.77 -1.20 -4.90 117.00 113.91 3ic9 n LEU 167 Ca 0.06 1.19 0.10 0.00 -0.03 0.00 0.00 56.01 57.34 3ic9 n LEU 167 Cb 0.37 -1.49 0.18 0.00 -2.33 0.00 0.00 43.42 40.15 3ic9 n LEU 167 CO 0.36 -0.48 0.75 -1.13 -1.33 0.00 0.00 177.39 175.57 3ic9 h ASN 168 N 2.50 0.00 -5.25 -1.43 -0.73 -1.93 -3.47 115.58 105.28 3ic9 h ASN 168 Ca -0.47 0.00 -0.12 0.00 1.87 0.00 0.00 56.30 57.59 3ic9 h ASN 168 Cb 1.28 0.00 -0.15 0.00 0.27 0.00 0.00 38.32 39.73 3ic9 h ASN 168 CO 0.62 0.11 -0.56 -0.62 -0.37 0.00 0.00 177.43 176.61 3ic9 s ASP 169 N -6.23 0.32 0.28 1.15 -1.08 -1.26 -4.24 116.67 105.61 3ic9 s ASP 169 Ca 0.06 -0.93 -0.29 0.00 -0.52 0.00 0.00 52.55 50.87 3ic9 s ASP 169 Cb 0.06 0.27 -0.09 0.00 -1.46 0.00 0.00 42.92 41.70 3ic9 s ASP 169 CO 0.68 -0.68 1.13 -0.76 0.52 0.00 0.00 175.17 176.06 3ic9 s LEU 170 N -2.93 4.53 0.74 -1.34 1.02 -1.26 -4.97 118.68 114.47 3ic9 s LEU 170 Ca 0.10 2.31 -0.11 0.00 0.02 0.00 0.00 54.13 56.45 3ic9 s LEU 170 Cb 0.07 -3.63 0.04 0.00 0.02 0.00 0.00 46.19 42.69 3ic9 s LEU 170 CO -0.08 -0.21 1.09 -2.84 0.02 0.00 0.00 176.35 174.33 3ic9 s PRO 171 N -1.36 2.50 0.13 1.29 0.02 -1.26 -4.97 135.00 131.35 3ic9 s PRO 171 Ca 0.46 1.16 -0.04 0.00 0.02 0.00 0.00 61.00 62.59 3ic9 s PRO 171 Cb -0.33 -1.93 -0.08 0.00 0.02 0.00 0.00 34.50 32.19 3ic9 s PRO 171 CO 0.42 -1.46 1.32 0.87 -0.33 0.00 0.00 177.00 177.83 3ic9 h LYS 172 N -0.84 0.43 -2.00 5.54 1.79 -1.95 -3.42 116.57 116.12 3ic9 h LYS 172 Ca -0.44 -0.44 -0.04 0.00 -2.18 0.00 0.00 60.65 57.55 3ic9 h LYS 172 Cb 1.23 0.12 -0.21 0.00 -1.58 0.00 0.00 32.23 31.79 3ic9 h LYS 172 CO 0.53 1.09 0.14 -1.54 -1.08 0.00 0.00 179.45 178.59 3ic9 s SER 173 N -7.07 -0.74 -0.04 0.86 1.04 -1.26 -1.35 113.70 105.14 3ic9 s SER 173 Ca -0.06 1.35 -0.00 0.00 0.48 0.00 0.00 55.95 57.72 3ic9 s SER 173 Cb 0.09 1.34 0.03 0.00 0.10 0.00 0.00 66.02 67.58 3ic9 s SER 173 CO 0.86 -0.30 -0.00 -0.69 0.98 0.00 0.00 173.24 174.09 3ic9 s VAL 174 N 0.16 0.26 -0.28 5.02 1.01 -0.40 -2.15 120.40 124.02 3ic9 s VAL 174 Ca -0.02 0.09 -0.22 0.00 0.00 0.00 0.00 61.98 61.84 3ic9 s VAL 174 Cb -0.04 -0.37 -0.01 0.00 0.00 0.00 0.00 36.38 35.95 3ic9 s VAL 174 CO 0.02 0.19 0.70 0.00 0.00 0.00 0.00 175.10 176.01 3ic9 s ALA 175 N 1.32 3.58 -0.21 5.51 0.00 -0.36 -3.15 121.76 128.45 3ic9 s ALA 175 Ca -0.05 -0.44 -0.09 0.00 0.00 0.00 0.00 51.96 51.38 3ic9 s ALA 175 Cb -0.13 -3.15 -0.04 0.00 0.00 0.00 0.00 23.12 19.79 3ic9 s ALA 175 CO -0.02 -0.99 0.10 0.08 0.00 0.00 0.00 175.76 174.93 3ic9 s VAL 176 N 2.70 5.00 -0.12 0.00 1.01 -0.20 -0.50 120.40 128.29 3ic9 s VAL 176 Ca 0.29 0.05 -0.00 0.00 0.00 0.00 0.00 61.98 62.31 3ic9 s VAL 176 Cb -0.15 -3.29 -0.02 0.00 0.00 0.00 0.00 36.38 32.92 3ic9 s VAL 176 CO 0.10 0.41 -0.10 -0.36 0.00 0.00 0.00 175.10 175.15 3ic9 s PHE 177 N 0.73 2.87 0.00 5.22 0.08 -0.51 -0.98 117.98 125.38 3ic9 s PHE 177 Ca 0.05 -0.43 0.00 0.00 0.12 0.00 0.00 56.93 56.68 3ic9 s PHE 177 Cb -0.13 -1.83 0.00 0.00 -0.57 0.00 0.00 43.02 40.49 3ic9 s PHE 177 CO 0.02 -0.06 0.00 0.41 -0.10 0.00 0.00 175.22 175.49 3ic9 n GLY 178 N 3.24 1.52 1.54 4.36 0.00 -0.42 -0.37 105.19 115.06 3ic9 n GLY 178 Ca -0.18 -0.96 0.03 0.00 0.00 0.00 0.00 46.02 44.92 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 1.65 3.70 -0.01 1.61 -0.04 -1.26 -3.96 135.00 136.70 3ic9 n PRO 179 Ca 0.00 -2.28 0.00 0.00 -0.04 0.00 0.00 63.50 61.18 3ic9 n PRO 179 Cb 0.00 -2.05 0.00 0.00 -0.04 0.00 0.00 33.50 31.41 3ic9 n PRO 179 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ic9 n GLY 180 N 0.37 0.72 0.40 0.55 0.00 -1.26 -0.11 105.19 105.87 3ic9 n GLY 180 Ca 0.22 -1.86 -0.15 0.00 0.00 0.00 0.00 46.02 44.23 3ic9 n GLY 180 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3ic9 h VAL 181 N -0.01 0.19 -0.09 1.61 2.07 -1.91 -2.00 116.25 116.12 3ic9 h VAL 181 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3ic9 h VAL 181 Cb 0.00 0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 29.96 3ic9 h VAL 181 CO 0.00 0.00 -0.00 0.40 0.02 0.00 0.00 177.57 177.99 3ic9 h ILE 182 N -0.70 1.26 -0.82 4.57 2.04 -1.91 -2.01 117.51 119.93 3ic9 h ILE 182 Ca 0.00 -0.81 0.05 0.00 1.00 0.00 0.00 64.86 65.11 3ic9 h ILE 182 Cb 0.68 1.63 -0.06 0.00 -0.74 0.00 0.00 36.82 38.33 3ic9 h ILE 182 CO -0.17 0.23 0.51 1.23 0.00 0.00 0.00 178.15 179.94 3ic9 h GLY 183 N -0.13 1.22 0.85 5.37 0.00 -1.67 -0.69 103.07 108.03 3ic9 h GLY 183 Ca 0.02 -0.37 -0.20 0.00 0.00 0.00 0.00 47.33 46.79 3ic9 h GLY 183 CO 0.00 0.27 -0.81 1.41 0.00 0.00 0.00 176.54 177.41 3ic9 h LEU 184 N 0.94 0.59 -0.52 3.11 3.38 -1.37 -1.59 115.31 119.85 3ic9 h LEU 184 Ca 0.35 -0.84 0.08 0.00 0.09 0.00 0.00 57.88 57.56 3ic9 h LEU 184 Cb 0.13 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.64 3ic9 h LEU 184 CO -0.16 1.37 0.16 -0.33 0.09 0.00 0.00 178.44 179.57 3ic9 h GLU 185 N -0.10 0.32 0.11 1.13 5.08 -1.19 -1.30 114.58 118.63 3ic9 h GLU 185 Ca -0.12 -0.02 -0.27 0.00 -1.00 0.00 0.00 59.36 57.95 3ic9 h GLU 185 Cb 1.55 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.73 3ic9 h GLU 185 CO 0.16 0.21 -1.25 -0.07 -1.00 0.00 0.00 179.01 177.06 3ic9 h LEU 186 N 0.33 0.38 -0.03 1.33 4.07 -1.20 -2.00 115.31 118.19 3ic9 h LEU 186 Ca 0.25 -0.42 -0.01 0.00 0.08 0.00 0.00 57.88 57.79 3ic9 h LEU 186 Cb 0.30 -0.12 -0.00 0.00 1.08 0.00 0.00 40.66 41.92 3ic9 h LEU 186 CO -0.28 1.33 -0.01 1.23 -1.08 0.00 0.00 178.44 179.63 3ic9 h GLY 187 N 1.75 0.06 0.92 0.83 0.00 -1.22 -1.48 103.07 103.93 3ic9 h GLY 187 Ca -0.13 -0.05 0.01 0.00 0.00 0.00 0.00 47.33 47.16 3ic9 h GLY 187 CO 0.19 0.04 0.15 -1.61 0.00 0.00 0.00 176.54 175.32 3ic9 h GLN 188 N -0.33 0.30 -0.34 4.80 4.15 -1.30 -0.13 115.11 122.26 3ic9 h GLN 188 Ca 0.01 -0.02 0.04 0.00 0.77 0.00 0.00 58.65 59.45 3ic9 h GLN 188 Cb 0.42 -0.07 -0.04 0.00 0.21 0.00 0.00 27.48 28.00 3ic9 h GLN 188 CO 0.00 0.20 0.11 0.00 -1.93 0.00 0.00 178.83 177.21 3ic9 h ALA 189 N 1.12 0.38 -0.75 3.38 0.00 -1.34 0.19 119.26 122.25 3ic9 h ALA 189 Ca 0.11 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 3ic9 h ALA 189 Cb 0.01 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 3ic9 h ALA 189 CO -0.06 -0.28 0.45 -0.07 0.00 0.00 0.00 179.25 179.29 3ic9 h LEU 190 N 0.25 0.89 -0.58 0.00 3.38 -1.14 -1.69 115.31 116.43 3ic9 h LEU 190 Ca 0.15 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 3ic9 h LEU 190 Cb 0.13 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 3ic9 h LEU 190 CO -0.16 0.69 0.12 -1.28 0.09 0.00 0.00 178.44 177.90 3ic9 h SER 191 N 1.02 0.90 0.24 -0.43 0.87 -0.41 -1.30 113.55 114.44 3ic9 h SER 191 Ca 0.27 -0.25 -0.01 0.00 -1.23 0.00 0.00 61.79 60.57 3ic9 h SER 191 Cb -0.04 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 61.68 3ic9 h SER 191 CO -0.05 0.92 -0.04 0.03 -0.53 0.00 0.00 176.83 177.16 3ic9 h ARG 192 N 0.85 0.00 -0.64 2.24 3.08 -0.32 -2.64 114.38 116.95 3ic9 h ARG 192 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.23 3ic9 h ARG 192 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.43 3ic9 h ARG 192 CO 0.01 0.04 0.00 1.28 -1.07 0.00 0.00 179.97 180.23 3ic9 n LEU 193 N -3.44 4.03 0.00 3.04 4.77 -0.59 -4.25 117.00 120.56 3ic9 n LEU 193 Ca -0.02 -2.04 0.00 0.00 -0.03 0.00 0.00 56.01 53.92 3ic9 n LEU 193 Cb 0.16 -0.55 0.00 0.00 -2.33 0.00 0.00 43.42 40.70 3ic9 n LEU 193 CO 0.26 0.61 0.00 0.61 -1.33 0.00 0.00 177.39 177.54 3ic9 n GLY 194 N 0.79 0.77 3.73 -0.72 0.00 -0.99 -4.88 105.19 103.88 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 -2.90 4.30 -0.26 1.61 1.01 -0.63 -4.97 120.40 118.57 3ic9 s VAL 195 Ca 0.00 1.84 -0.29 0.00 0.00 0.00 0.00 61.98 63.53 3ic9 s VAL 195 Cb 0.00 -4.17 -0.01 0.00 0.00 0.00 0.00 36.38 32.20 3ic9 s VAL 195 CO 0.00 0.25 1.43 -0.63 0.00 0.00 0.00 175.10 176.15 3ic9 s ILE 196 N 0.26 3.96 0.06 2.22 1.01 -0.45 -4.12 121.20 124.14 3ic9 s ILE 196 Ca 0.50 1.09 0.09 0.00 0.00 0.00 0.00 60.65 62.33 3ic9 s ILE 196 Cb -0.26 -3.96 -0.03 0.00 0.01 0.00 0.00 42.46 38.22 3ic9 s ILE 196 CO 0.31 -0.38 -0.24 -0.69 0.00 0.00 0.00 174.94 173.94 3ic9 s VAL 197 N 4.65 1.93 0.01 2.92 1.01 -1.26 -1.28 120.40 128.38 3ic9 s VAL 197 Ca 0.62 -1.38 0.03 0.00 0.00 0.00 0.00 61.98 61.26 3ic9 s VAL 197 Cb -0.20 -1.67 -0.01 0.00 0.00 0.00 0.00 36.38 34.49 3ic9 s VAL 197 CO 0.25 0.23 -0.09 -0.54 0.00 0.00 0.00 175.10 174.95 3ic9 s LYS 198 N -1.38 0.64 -0.12 2.72 1.02 -1.19 -4.27 119.74 117.15 3ic9 s LYS 198 Ca 0.10 -0.45 0.01 0.00 0.02 0.00 0.00 55.97 55.65 3ic9 s LYS 198 Cb -0.10 -0.58 -0.01 0.00 -0.52 0.00 0.00 37.83 36.63 3ic9 s LYS 198 CO 0.03 0.15 -0.17 0.08 -0.92 0.00 0.00 175.35 174.52 3ic9 s VAL 199 N -0.54 2.72 -0.09 3.17 1.01 -0.32 -1.03 120.40 125.31 3ic9 s VAL 199 Ca -0.00 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.23 3ic9 s VAL 199 Cb -0.05 -2.12 0.01 0.00 0.00 0.00 0.00 36.38 34.22 3ic9 s VAL 199 CO 0.00 0.53 -0.20 -0.36 0.00 0.00 0.00 175.10 175.08 3ic9 s PHE 200 N 0.39 2.20 0.41 5.22 0.08 -0.16 -1.23 117.98 124.89 3ic9 s PHE 200 Ca -0.13 -0.90 0.04 0.00 0.12 0.00 0.00 56.93 56.06 3ic9 s PHE 200 Cb -0.16 -1.50 -0.03 0.00 -0.57 0.00 0.00 43.02 40.76 3ic9 s PHE 200 CO 0.06 -0.39 0.11 0.20 -0.10 0.00 0.00 175.22 175.11 3ic9 s GLY 201 N 0.49 2.60 0.00 4.36 0.00 -0.14 -1.30 107.32 113.33 3ic9 s GLY 201 Ca -0.17 -1.24 0.00 0.00 0.00 0.00 0.00 44.72 43.32 3ic9 s GLY 201 CO 0.06 -1.86 0.00 -0.96 0.00 0.00 0.00 173.10 170.35 3ic9 n ARG 202 N -0.92 2.35 -0.12 2.90 1.85 -1.07 -0.73 116.66 120.93 3ic9 n ARG 202 Ca -0.07 0.00 0.12 0.00 -1.00 0.00 0.00 57.85 56.90 3ic9 n ARG 202 Cb 0.65 -0.82 0.21 0.00 -1.05 0.00 0.00 32.46 31.45 3ic9 n ARG 202 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 3ic9 n SER 203 N -1.18 3.10 0.00 2.89 3.41 -1.16 -4.50 113.62 116.17 3ic9 n SER 203 Ca 0.00 -1.95 0.00 0.00 -0.26 0.00 0.00 58.87 56.66 3ic9 n SER 203 Cb 0.15 -0.15 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 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 1.42 0.84 3.77 5.00 0.00 -0.54 -5.00 105.19 110.67 3ic9 n GLY 204 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 3ic9 n GLY 204 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ic9 s SER 205 N -2.87 6.53 -0.17 1.61 0.01 -1.26 -4.93 113.70 112.61 3ic9 s SER 205 Ca 0.00 2.61 -0.04 0.00 1.31 0.00 0.00 55.95 59.83 3ic9 s SER 205 Cb 0.00 -2.64 0.06 0.00 0.21 0.00 0.00 66.02 63.65 3ic9 s SER 205 CO 0.00 -0.69 0.07 -0.69 0.41 0.00 0.00 173.24 172.34 3ic9 s VAL 206 N -1.24 0.10 0.00 3.43 1.01 -1.26 -4.78 120.40 117.67 3ic9 s VAL 206 Ca 0.54 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.25 3ic9 s VAL 206 Cb -0.37 -0.71 0.00 0.00 0.00 0.00 0.00 36.38 35.30 3ic9 s VAL 206 CO 0.48 -0.25 0.00 0.00 0.00 0.00 0.00 175.10 175.34 3ic9 n ALA 207 N 5.21 0.00 -0.85 5.51 0.00 0.85 -1.40 120.51 129.82 3ic9 n ALA 207 Ca -0.08 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.44 3ic9 n ALA 207 Cb 0.48 0.00 0.39 0.00 0.00 0.00 0.00 19.45 20.32 3ic9 n ALA 207 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3ic9 n ASN 208 N -0.42 5.42 -4.76 0.00 6.94 -1.26 -4.60 115.26 116.58 3ic9 n ASN 208 Ca 0.00 -2.83 -0.41 0.00 -0.02 0.00 0.00 54.58 51.32 3ic9 n ASN 208 Cb 0.00 -0.65 -0.02 0.00 -2.36 0.00 0.00 39.78 36.75 3ic9 n ASN 208 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3ic9 s LEU 209 N -2.56 4.40 -0.15 -4.53 1.43 -0.50 -4.94 118.68 111.83 3ic9 s LEU 209 Ca 0.53 2.69 0.10 0.00 -1.03 0.00 0.00 54.13 56.43 3ic9 s LEU 209 Cb 0.39 -3.64 -0.16 0.00 0.03 0.00 0.00 46.19 42.81 3ic9 s LEU 209 CO 0.18 -0.64 0.01 0.00 0.23 0.00 0.00 176.35 176.13 3ic9 n GLN 210 N 1.59 1.48 -2.31 1.70 6.02 -1.26 -4.62 117.38 119.98 3ic9 n GLN 210 Ca 0.04 0.01 -0.41 0.00 -0.01 0.00 0.00 57.00 56.63 3ic9 n GLN 210 Cb 0.41 -1.36 -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 -4.91 7.02 0.13 1.08 2.15 -1.26 -4.94 116.67 115.94 3ic9 s ASP 211 Ca -0.10 2.33 -0.12 0.00 0.43 0.00 0.00 52.55 55.09 3ic9 s ASP 211 Cb 0.05 -2.61 -0.06 0.00 -0.30 0.00 0.00 42.92 40.00 3ic9 s ASP 211 CO 0.55 -0.41 1.46 -0.08 -0.17 0.00 0.00 175.17 176.51 3ic9 h GLU 212 N 4.99 0.88 -0.61 4.34 4.57 -2.02 -0.86 114.58 125.88 3ic9 h GLU 212 Ca -0.45 -0.47 0.00 0.00 -1.18 0.00 0.00 59.36 57.26 3ic9 h GLU 212 Cb 1.21 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.82 3ic9 h GLU 212 CO 0.74 1.12 0.00 -1.91 -1.18 0.00 0.00 179.01 177.78 3ic9 n GLU 213 N -4.11 0.08 0.00 1.92 2.13 -1.26 -1.83 120.64 117.57 3ic9 n GLU 213 Ca -0.03 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.79 3ic9 n GLU 213 Cb 0.53 -1.16 0.00 0.00 0.27 0.00 0.00 31.44 31.08 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 0.60 0.00 -0.15 5.31 5.02 -0.33 -0.52 118.16 128.10 3ic9 n LYS 215 Ca 0.00 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.18 3ic9 n LYS 215 Cb 0.03 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.03 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 0.81 -0.57 1.97 2.47 -1.63 -1.29 114.38 116.15 3ic9 h ARG 216 Ca 0.00 -0.30 0.00 0.00 -1.26 0.00 0.00 59.98 58.43 3ic9 h ARG 216 Cb 0.00 -0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 28.24 3ic9 h ARG 216 CO 0.00 0.92 0.37 -0.92 0.56 0.00 0.00 179.97 180.90 3ic9 h TYR 217 N 0.64 0.71 -0.27 3.04 3.20 -1.07 -1.18 116.97 122.04 3ic9 h TYR 217 Ca 0.11 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.96 3ic9 h TYR 217 Cb 0.60 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 3ic9 h TYR 217 CO 0.05 0.45 0.04 0.00 -1.64 0.00 0.00 178.16 177.06 3ic9 h ALA 218 N 1.20 0.36 -0.63 1.82 0.00 -1.78 -0.08 119.26 120.16 3ic9 h ALA 218 Ca 0.21 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.95 3ic9 h ALA 218 Cb -0.08 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 3ic9 h ALA 218 CO -0.04 0.06 0.39 1.49 0.00 0.00 0.00 179.25 181.15 3ic9 h GLU 219 N 0.27 0.75 -0.43 0.00 4.81 -1.04 -0.03 114.58 118.91 3ic9 h GLU 219 Ca 0.08 -0.05 -0.10 0.00 -0.13 0.00 0.00 59.36 59.17 3ic9 h GLU 219 Cb 0.35 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 3ic9 h GLU 219 CO 0.01 0.50 -0.11 -0.22 -0.73 0.00 0.00 179.01 178.46 3ic9 h LYS 220 N 0.78 0.84 -0.03 1.92 3.64 -0.99 -1.80 116.57 120.94 3ic9 h LYS 220 Ca 0.25 -0.32 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3ic9 h LYS 220 Cb 0.01 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 31.78 3ic9 h LYS 220 CO -0.10 0.95 0.01 1.15 -2.27 0.00 0.00 179.45 179.20 3ic9 h THR 221 N 0.67 1.00 -0.88 1.00 2.02 -0.69 -2.23 112.91 113.80 3ic9 h THR 221 Ca 0.11 -0.01 0.07 0.00 0.77 0.00 0.00 66.41 67.35 3ic9 h THR 221 Cb 0.65 0.97 -0.06 0.00 -1.74 0.00 0.00 68.15 67.97 3ic9 h THR 221 CO 0.04 0.00 0.57 -0.26 0.37 0.00 0.00 175.52 176.25 3ic9 h PHE 222 N 0.03 0.99 0.00 3.16 0.04 -0.91 -1.08 116.94 119.17 3ic9 h PHE 222 Ca 0.01 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.81 3ic9 h PHE 222 Cb 0.00 -0.33 0.00 0.00 2.20 0.00 0.00 35.95 37.83 3ic9 h PHE 222 CO -0.08 0.51 0.00 0.09 -0.60 0.00 0.00 178.31 178.23 3ic9 n ASN 223 N -4.49 0.28 0.17 2.17 3.02 -0.68 -0.77 115.26 114.95 3ic9 n ASN 223 Ca 0.13 0.56 0.13 0.00 -0.03 0.00 0.00 54.58 55.38 3ic9 n ASN 223 Cb 0.22 -0.62 0.57 0.00 -0.61 0.00 0.00 39.78 39.34 3ic9 n ASN 223 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 3ic9 h GLU 224 N 0.00 0.00 0.00 3.52 5.08 -0.72 -3.36 114.58 119.10 3ic9 h GLU 224 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 3ic9 h GLU 224 Cb 0.34 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 3ic9 h GLU 224 CO 0.00 0.00 -1.12 -1.91 -1.00 0.00 0.00 179.01 174.98 3ic9 n GLU 225 N -2.40 0.05 -3.75 2.33 2.13 0.05 -5.10 120.64 113.95 3ic9 n GLU 225 Ca 0.01 0.02 -0.10 0.00 0.66 0.00 0.00 57.16 57.75 3ic9 n GLU 225 Cb 0.19 -0.85 -0.06 0.00 0.27 0.00 0.00 31.44 31.00 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 -0.04 -0.02 4.31 -0.12 -0.53 -5.08 117.98 114.46 3ic9 s PHE 226 Ca -0.03 -0.28 -0.30 0.00 -0.05 0.00 0.00 56.93 56.27 3ic9 s PHE 226 Cb 0.01 0.10 -0.06 0.00 -0.63 0.00 0.00 43.02 42.44 3ic9 s PHE 226 CO 0.05 -0.60 1.62 -0.47 -0.05 0.00 0.00 175.22 175.77 3ic9 s TYR 227 N -3.56 2.19 -0.22 3.49 5.04 -1.26 -3.84 117.35 119.20 3ic9 s TYR 227 Ca 0.02 0.30 -0.04 0.00 -2.44 0.00 0.00 57.07 54.91 3ic9 s TYR 227 Cb 0.02 -3.90 0.09 0.00 0.35 0.00 0.00 41.96 38.53 3ic9 s TYR 227 CO -0.10 -3.68 0.21 0.12 -1.34 0.00 0.00 175.55 170.76 3ic9 s PHE 228 N 3.49 -0.19 -0.37 4.97 5.36 -1.26 -1.17 117.98 128.80 3ic9 s PHE 228 Ca 0.72 0.01 -0.08 0.00 -0.96 0.00 0.00 56.93 56.62 3ic9 s PHE 228 Cb -0.35 -0.46 0.05 0.00 -0.34 0.00 0.00 43.02 41.92 3ic9 s PHE 228 CO 0.30 -0.65 0.18 0.34 -1.46 0.00 0.00 175.22 173.93 3ic9 s ASP 229 N 2.29 5.51 0.23 6.13 -1.08 -0.36 -4.88 116.67 124.50 3ic9 s ASP 229 Ca 0.07 -1.26 0.26 0.00 -0.52 0.00 0.00 52.55 51.09 3ic9 s ASP 229 Cb -0.16 -1.94 0.83 0.00 -1.46 0.00 0.00 42.92 40.20 3ic9 s ASP 229 CO -0.16 -0.42 1.76 0.00 0.52 0.00 0.00 175.17 176.87 3ic9 h ALA 230 N 8.32 1.00 -1.14 3.66 0.00 -1.85 -0.35 119.26 128.90 3ic9 h ALA 230 Ca -0.23 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.12 3ic9 h ALA 230 Cb 1.09 0.00 -0.42 0.00 0.00 0.00 0.00 17.79 18.45 3ic9 h ALA 230 CO 0.67 0.00 -0.80 1.63 0.00 0.00 0.00 179.25 180.75 3ic9 n LYS 231 N -2.31 3.39 -2.24 0.00 5.02 -1.24 -1.46 118.16 119.32 3ic9 n LYS 231 Ca 0.05 -4.29 -0.41 0.00 -2.02 0.00 0.00 58.31 51.64 3ic9 n LYS 231 Cb 0.39 -2.21 -0.03 0.00 -0.02 0.00 0.00 35.03 33.16 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 -3.56 3.47 -0.40 7.82 0.00 0.09 -4.93 121.76 124.25 3ic9 s ALA 232 Ca 0.48 1.13 -0.12 0.00 0.00 0.00 0.00 51.96 53.45 3ic9 s ALA 232 Cb 0.40 -3.43 0.03 0.00 0.00 0.00 0.00 23.12 20.13 3ic9 s ALA 232 CO -0.08 -0.47 0.25 0.50 0.00 0.00 0.00 175.76 175.96 3ic9 s ARG 233 N -1.64 2.85 -0.17 0.00 3.52 -1.26 -4.63 118.95 117.61 3ic9 s ARG 233 Ca 0.47 -1.12 -0.04 0.00 -0.13 0.00 0.00 55.73 54.92 3ic9 s ARG 233 Cb -0.37 -3.83 -0.02 0.00 -1.56 0.00 0.00 34.95 29.17 3ic9 s ARG 233 CO 0.49 -0.76 -0.04 0.08 -0.81 0.00 0.00 175.30 174.26 3ic9 s VAL 234 N 1.58 3.80 -0.17 7.11 1.01 -1.26 -1.36 120.40 131.11 3ic9 s VAL 234 Ca 0.03 -0.38 -0.21 0.00 0.00 0.00 0.00 61.98 61.42 3ic9 s VAL 234 Cb -0.20 -2.68 -0.18 0.00 0.00 0.00 0.00 36.38 33.32 3ic9 s VAL 234 CO 0.07 0.48 0.33 0.40 0.00 0.00 0.00 175.10 176.38 3ic9 h ILE 235 N 5.26 1.03 -2.61 2.22 1.08 -0.62 -3.49 117.51 120.38 3ic9 h ILE 235 Ca -0.32 -2.01 -0.00 0.00 -0.39 0.00 0.00 64.86 62.13 3ic9 h ILE 235 Cb 1.19 2.19 -0.14 0.00 -3.07 0.00 0.00 36.82 36.98 3ic9 h ILE 235 CO 0.62 0.35 0.27 -0.94 -0.69 0.00 0.00 178.15 177.75 3ic9 s SER 236 N -6.43 -0.55 -0.37 1.72 1.04 -0.93 -4.99 113.70 103.19 3ic9 s SER 236 Ca -0.22 0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.38 3ic9 s SER 236 Cb 0.02 0.54 0.14 0.00 0.10 0.00 0.00 66.02 66.82 3ic9 s SER 236 CO 0.54 -0.81 0.21 0.42 0.98 0.00 0.00 173.24 174.58 3ic9 s THR 237 N -2.99 0.38 -0.18 2.02 -4.23 -1.26 -1.07 115.64 108.30 3ic9 s THR 237 Ca -0.01 -1.85 0.00 0.00 -1.18 0.00 0.00 61.69 58.65 3ic9 s THR 237 Cb -0.01 -1.28 0.01 0.00 1.34 0.00 0.00 72.50 72.57 3ic9 s THR 237 CO -0.07 -0.97 -0.18 -0.63 -0.54 0.00 0.00 174.62 172.24 3ic9 s ILE 238 N 0.96 2.27 0.05 2.99 1.01 -0.39 -1.96 121.20 126.14 3ic9 s ILE 238 Ca 0.18 -0.87 -0.35 0.00 0.00 0.00 0.00 60.65 59.61 3ic9 s ILE 238 Cb -0.23 -1.97 -0.14 0.00 0.01 0.00 0.00 42.46 40.13 3ic9 s ILE 238 CO 0.00 0.52 1.59 1.21 0.00 0.00 0.00 174.94 178.27 3ic9 n GLU 239 N 4.61 1.80 -1.53 2.79 2.13 -0.33 -0.82 120.64 129.29 3ic9 n GLU 239 Ca -0.20 0.65 -0.00 0.00 0.66 0.00 0.00 57.16 58.26 3ic9 n GLU 239 Cb 0.50 -2.40 0.00 0.00 0.27 0.00 0.00 31.44 29.82 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 4.00 1.48 0.05 5.31 4.76 0.18 -4.87 118.16 129.07 3ic9 n LYS 240 Ca 0.19 -0.05 -0.00 0.00 -2.87 0.00 0.00 58.31 55.57 3ic9 n LYS 240 Cb 0.25 0.01 0.29 0.00 -1.84 0.00 0.00 35.03 33.73 3ic9 n LYS 240 CO 0.00 0.00 0.00 1.05 -1.37 0.00 0.00 177.40 177.08 3ic9 h GLU 241 N 0.00 0.41 0.00 1.97 4.11 -2.03 -3.34 114.58 115.69 3ic9 h GLU 241 Ca -0.01 -0.11 0.00 0.00 0.07 0.00 0.00 59.36 59.31 3ic9 h GLU 241 Cb 0.02 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.23 3ic9 h GLU 241 CO 0.01 0.55 0.00 -0.25 0.07 0.00 0.00 179.01 179.39 3ic9 n ASP 242 N -4.21 0.31 -3.19 3.06 8.00 -1.26 -5.09 116.55 114.17 3ic9 n ASP 242 Ca 0.00 -0.65 -0.11 0.00 0.71 0.00 0.00 54.79 54.74 3ic9 n ASP 242 Cb 0.32 0.33 -0.01 0.00 -0.02 0.00 0.00 41.12 41.74 3ic9 n ASP 242 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ic9 s ALA 243 N -0.33 -0.23 -0.18 2.24 0.00 -1.26 -4.76 121.76 117.24 3ic9 s ALA 243 Ca 0.00 -0.98 -0.03 0.00 0.00 0.00 0.00 51.96 50.94 3ic9 s ALA 243 Cb 0.00 0.88 -0.02 0.00 0.00 0.00 0.00 23.12 23.98 3ic9 s ALA 243 CO 0.00 -0.92 -0.05 0.08 0.00 0.00 0.00 175.76 174.88 3ic9 s VAL 244 N -2.82 3.57 -0.14 0.00 1.01 0.98 0.51 120.40 123.49 3ic9 s VAL 244 Ca 0.21 -0.45 -0.26 0.00 0.00 0.00 0.00 61.98 61.48 3ic9 s VAL 244 Cb -0.03 -2.58 -0.02 0.00 0.00 0.00 0.00 36.38 33.75 3ic9 s VAL 244 CO 0.14 0.46 0.85 -0.70 0.00 0.00 0.00 175.10 175.85 3ic9 s GLU 245 N 0.88 4.34 -0.22 2.72 2.12 0.00 -1.02 118.70 127.52 3ic9 s GLU 245 Ca -0.01 1.07 -0.04 0.00 0.36 0.00 0.00 54.97 56.35 3ic9 s GLU 245 Cb -0.15 -3.55 -0.01 0.00 0.26 0.00 0.00 34.13 30.68 3ic9 s GLU 245 CO 0.01 -0.28 -0.03 0.08 -0.54 0.00 0.00 175.26 174.51 3ic9 s VAL 246 N 1.96 3.53 -0.24 3.70 1.01 0.61 -1.26 120.40 129.70 3ic9 s VAL 246 Ca 0.40 -0.44 -0.06 0.00 0.00 0.00 0.00 61.98 61.88 3ic9 s VAL 246 Cb -0.17 -2.61 -0.02 0.00 0.00 0.00 0.00 36.38 33.59 3ic9 s VAL 246 CO 0.14 0.42 0.03 -0.63 0.00 0.00 0.00 175.10 175.06 3ic9 s ILE 247 N 1.41 3.92 0.19 2.22 1.01 -0.23 -0.95 121.20 128.77 3ic9 s ILE 247 Ca 0.05 -0.36 -0.10 0.00 0.00 0.00 0.00 60.65 60.24 3ic9 s ILE 247 Cb -0.14 -2.84 -0.01 0.00 0.01 0.00 0.00 42.46 39.48 3ic9 s ILE 247 CO -0.02 0.33 0.34 -0.72 0.00 0.00 0.00 174.94 174.88 3ic9 s TYR 248 N 1.55 0.38 -0.15 3.97 1.13 -0.24 0.19 117.35 124.18 3ic9 s TYR 248 Ca 0.06 -0.74 -0.07 0.00 -1.41 0.00 0.00 57.07 54.91 3ic9 s TYR 248 Cb -0.15 0.01 -0.04 0.00 -1.10 0.00 0.00 41.96 40.68 3ic9 s TYR 248 CO 0.01 -0.80 0.11 -0.06 -2.51 0.00 0.00 175.55 172.30 3ic9 s PHE 249 N -3.98 3.43 0.00 -3.49 0.08 -0.46 0.65 117.98 114.21 3ic9 s PHE 249 Ca 0.19 0.35 0.00 0.00 0.12 0.00 0.00 56.93 57.59 3ic9 s PHE 249 Cb 0.02 -2.02 0.00 0.00 -0.57 0.00 0.00 43.02 40.45 3ic9 s PHE 249 CO 0.02 0.47 0.00 -0.40 -0.10 0.00 0.00 175.22 175.21 3ic9 n ASP 250 N 2.76 0.00 0.13 1.36 3.85 -0.37 -4.42 116.55 119.86 3ic9 n ASP 250 Ca -0.18 -0.74 0.13 0.00 -0.71 0.00 0.00 54.79 53.29 3ic9 n ASP 250 Cb 0.53 0.00 0.47 0.00 -1.35 0.00 0.00 41.12 40.77 3ic9 n ASP 250 CO 0.00 0.00 0.00 0.11 -1.01 0.00 0.00 177.20 176.30 3ic9 h LYS 251 N 0.00 0.00 -0.69 0.11 1.57 -2.00 -0.72 116.57 114.85 3ic9 h LYS 251 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3ic9 h LYS 251 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3ic9 h LYS 251 CO 0.00 0.00 0.00 0.43 -0.57 0.00 0.00 179.45 179.31 3ic9 n SER 252 N -2.30 3.70 -0.99 0.86 7.64 -1.26 -4.92 113.62 116.34 3ic9 n SER 252 Ca 0.03 -2.00 -0.13 0.00 1.01 0.00 0.00 58.87 57.78 3ic9 n SER 252 Cb 0.31 -0.46 -0.06 0.00 -1.01 0.00 0.00 64.21 62.99 3ic9 n SER 252 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3ic9 n GLY 253 N 1.59 1.38 3.65 0.23 0.00 -0.27 -4.99 105.19 106.78 3ic9 n GLY 253 Ca 0.23 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 3ic9 n GLY 253 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3ic9 s GLN 254 N -3.10 4.23 0.24 1.61 2.00 -1.26 -4.73 119.66 118.65 3ic9 s GLN 254 Ca 0.00 0.99 -0.31 0.00 -2.00 0.00 0.00 55.36 54.04 3ic9 s GLN 254 Cb 0.00 -3.62 -0.11 0.00 0.80 0.00 0.00 33.01 30.08 3ic9 s GLN 254 CO 0.00 -0.45 1.62 0.21 -0.50 0.00 0.00 175.29 176.17 3ic9 s LYS 255 N 2.60 4.15 -0.02 1.67 2.20 -1.26 -1.23 119.74 127.84 3ic9 s LYS 255 Ca 0.37 2.53 0.00 0.00 -0.36 0.00 0.00 55.97 58.51 3ic9 s LYS 255 Cb -0.16 -3.07 0.02 0.00 -1.51 0.00 0.00 37.83 33.11 3ic9 s LYS 255 CO 0.09 -0.65 0.00 0.99 -0.36 0.00 0.00 175.35 175.42 3ic9 s THR 256 N 0.62 0.15 -0.17 3.43 2.01 0.21 -4.93 115.64 116.96 3ic9 s THR 256 Ca 0.68 0.07 -0.03 0.00 0.31 0.00 0.00 61.69 62.72 3ic9 s THR 256 Cb -0.47 -0.23 -0.02 0.00 0.01 0.00 0.00 72.50 71.78 3ic9 s THR 256 CO 0.39 0.12 -0.04 -0.89 -0.69 0.00 0.00 174.62 173.51 3ic9 s THR 257 N 0.85 3.74 -0.15 -0.82 2.01 -1.26 -1.08 115.64 118.93 3ic9 s THR 257 Ca -0.08 -0.41 -0.09 0.00 0.31 0.00 0.00 61.69 61.42 3ic9 s THR 257 Cb -0.12 -2.64 0.05 0.00 0.01 0.00 0.00 72.50 69.80 3ic9 s THR 257 CO -0.02 0.48 0.36 -0.70 -0.69 0.00 0.00 174.62 174.06 3ic9 s GLU 258 N 0.57 0.35 0.03 4.92 2.12 -0.13 -4.98 118.70 121.59 3ic9 s GLU 258 Ca -0.03 0.68 -0.13 0.00 0.36 0.00 0.00 54.97 55.85 3ic9 s GLU 258 Cb -0.14 -0.02 -0.06 0.00 0.26 0.00 0.00 34.13 34.17 3ic9 s GLU 258 CO 0.03 -0.14 0.41 -1.12 -0.54 0.00 0.00 175.26 173.89 3ic9 s SER 259 N 1.20 6.74 0.01 -1.70 0.01 -1.26 -0.29 113.70 118.41 3ic9 s SER 259 Ca -0.08 0.90 0.03 0.00 1.31 0.00 0.00 55.95 58.11 3ic9 s SER 259 Cb -0.08 -2.22 -0.01 0.00 0.21 0.00 0.00 66.02 63.92 3ic9 s SER 259 CO -0.10 0.27 -0.09 -0.36 0.41 0.00 0.00 173.24 173.37 3ic9 s PHE 260 N -1.20 0.79 0.31 2.43 0.08 -0.19 -4.94 117.98 115.25 3ic9 s PHE 260 Ca 0.27 -0.21 -0.01 0.00 0.12 0.00 0.00 56.93 57.10 3ic9 s PHE 260 Cb -0.16 -0.49 0.47 0.00 -0.57 0.00 0.00 43.02 42.27 3ic9 s PHE 260 CO 0.15 -0.01 1.97 0.37 -0.10 0.00 0.00 175.22 177.59 3ic9 h GLN 261 N 5.63 1.03 -4.09 0.44 4.15 -1.75 0.28 115.11 120.80 3ic9 h GLN 261 Ca -0.32 -0.07 -0.12 0.00 0.77 0.00 0.00 58.65 58.91 3ic9 h GLN 261 Cb 1.18 -0.23 -0.14 0.00 0.21 0.00 0.00 27.48 28.50 3ic9 h GLN 261 CO 0.48 0.70 -0.53 0.71 -1.93 0.00 0.00 178.83 178.26 3ic9 s TYR 262 N -5.85 0.45 0.06 3.99 2.02 -0.92 -4.41 117.35 112.70 3ic9 s TYR 262 Ca -0.11 -0.90 0.06 0.00 -0.37 0.00 0.00 57.07 55.75 3ic9 s TYR 262 Cb 0.18 -0.26 -0.04 0.00 -0.40 0.00 0.00 41.96 41.44 3ic9 s TYR 262 CO 0.79 -0.50 -0.13 0.14 -1.57 0.00 0.00 175.55 174.28 3ic9 s VAL 263 N -3.93 3.20 -0.19 0.71 -7.23 -0.62 -1.22 120.40 111.11 3ic9 s VAL 263 Ca 0.11 -1.16 -0.01 0.00 -1.81 0.00 0.00 61.98 59.11 3ic9 s VAL 263 Cb 0.06 -2.43 0.01 0.00 0.56 0.00 0.00 36.38 34.58 3ic9 s VAL 263 CO -0.07 0.24 -0.13 -0.22 -0.31 0.00 0.00 175.10 174.61 3ic9 s LEU 264 N -1.79 2.47 -0.98 1.32 2.96 0.34 0.25 118.68 123.25 3ic9 s LEU 264 Ca 0.18 -0.53 -0.19 0.00 -0.22 0.00 0.00 54.13 53.37 3ic9 s LEU 264 Cb -0.11 -1.59 0.13 0.00 0.50 0.00 0.00 46.19 45.12 3ic9 s LEU 264 CO 0.09 0.00 1.21 0.00 -1.32 0.00 0.00 176.35 176.33 3ic9 s ALA 265 N 1.32 3.36 -0.47 5.97 0.00 0.39 -1.43 121.76 130.90 3ic9 s ALA 265 Ca 0.04 -2.78 0.01 0.00 0.00 0.00 0.00 51.96 49.24 3ic9 s ALA 265 Cb -0.14 -4.12 0.50 0.00 0.00 0.00 0.00 23.12 19.36 3ic9 s ALA 265 CO -0.08 -3.04 1.90 0.00 0.00 0.00 0.00 175.76 174.54 3ic9 n ALA 266 N 6.74 5.55 -1.53 0.00 0.00 0.50 -4.75 120.51 127.03 3ic9 n ALA 266 Ca 0.27 -2.73 -0.30 0.00 0.00 0.00 0.00 53.44 50.67 3ic9 n ALA 266 Cb 0.49 -1.51 0.22 0.00 0.00 0.00 0.00 19.45 18.65 3ic9 n ALA 266 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3ic9 s THR 267 N -3.42 1.78 0.14 0.00 -4.23 -0.94 -4.23 115.64 104.75 3ic9 s THR 267 Ca 0.52 0.00 -0.34 0.00 -1.18 0.00 0.00 61.69 60.69 3ic9 s THR 267 Cb 0.43 -2.76 -0.14 0.00 1.34 0.00 0.00 72.50 71.37 3ic9 s THR 267 CO 0.05 0.00 1.54 0.61 -0.54 0.00 0.00 174.62 176.28 3ic9 n GLY 268 N -2.47 1.01 3.84 3.99 0.00 -1.26 -4.61 105.19 105.69 3ic9 n GLY 268 Ca 0.15 0.67 -0.31 0.00 0.00 0.00 0.00 46.02 46.53 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 0.88 2.95 -0.12 1.61 0.52 -1.26 -3.56 118.95 119.97 3ic9 s ARG 269 Ca 0.80 0.79 0.00 0.00 -0.52 0.00 0.00 55.73 56.81 3ic9 s ARG 269 Cb -0.73 -2.00 -0.02 0.00 0.52 0.00 0.00 34.95 32.72 3ic9 s ARG 269 CO 0.40 -1.05 -0.14 0.21 0.02 0.00 0.00 175.30 174.74 3ic9 s LYS 270 N -5.13 3.26 0.26 3.54 2.20 0.41 -4.86 119.74 119.42 3ic9 s LYS 270 Ca 0.58 -0.69 -0.30 0.00 -0.36 0.00 0.00 55.97 55.20 3ic9 s LYS 270 Cb -0.13 -2.59 -0.10 0.00 -1.51 0.00 0.00 37.83 33.50 3ic9 s LYS 270 CO 0.54 0.27 1.40 0.00 -0.36 0.00 0.00 175.35 177.20 3ic9 s ALA 271 N 0.20 3.59 -1.43 3.13 0.00 -1.26 -0.45 121.76 125.54 3ic9 s ALA 271 Ca -0.08 1.29 -0.12 0.00 0.00 0.00 0.00 51.96 53.05 3ic9 s ALA 271 Cb -0.15 -3.53 -0.04 0.00 0.00 0.00 0.00 23.12 19.39 3ic9 s ALA 271 CO 0.05 -0.70 2.52 0.09 0.00 0.00 0.00 175.76 177.72 3ic9 n ASN 272 N 2.02 6.02 0.00 0.00 3.02 -0.12 -4.24 115.26 121.96 3ic9 n ASN 272 Ca 0.05 -2.66 0.00 0.00 -0.03 0.00 0.00 54.58 51.94 3ic9 n ASN 272 Cb 0.41 -1.52 0.00 0.00 -0.61 0.00 0.00 39.78 38.06 3ic9 n ASN 272 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 3ic9 n VAL 273 N 4.42 0.55 0.23 2.41 0.24 -1.26 -4.73 118.33 120.19 3ic9 n VAL 273 Ca 0.63 -0.64 0.11 0.00 -2.04 0.00 0.00 64.34 62.39 3ic9 n VAL 273 Cb 0.30 0.79 -0.13 0.00 -1.47 0.00 0.00 33.84 33.32 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 -0.28 0.30 -1.08 -1.34 5.75 -1.26 -4.32 116.55 114.33 3ic9 n ASP 274 Ca 0.00 -0.17 -0.01 0.00 -0.01 0.00 0.00 54.79 54.60 3ic9 n ASP 274 Cb 0.26 1.58 0.21 0.00 -1.03 0.00 0.00 41.12 42.14 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 -2.13 2.12 0.00 0.11 4.76 -1.26 -4.62 118.16 117.15 3ic9 n LYS 275 Ca -0.02 -3.07 0.07 0.00 -2.87 0.00 0.00 58.31 52.42 3ic9 n LYS 275 Cb 0.51 -1.82 -0.00 0.00 -1.84 0.00 0.00 35.03 31.88 3ic9 n LYS 275 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3ic9 n LEU 276 N -0.97 1.46 -0.29 -0.35 4.77 -1.26 -4.89 117.00 115.47 3ic9 n LEU 276 Ca 0.30 -0.76 -0.03 0.00 -0.03 0.00 0.00 56.01 55.49 3ic9 n LEU 276 Cb 1.00 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 42.09 3ic9 n LEU 276 CO 0.18 0.28 -0.03 0.61 -1.33 0.00 0.00 177.39 177.11 3ic9 n GLY 277 N 1.06 0.32 0.34 -0.72 0.00 -1.26 -0.25 105.19 104.68 3ic9 n GLY 277 Ca 0.06 -0.81 0.18 0.00 0.00 0.00 0.00 46.02 45.45 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 0.00 0.00 -0.23 0.99 4.07 -1.87 -0.12 115.31 118.15 3ic9 h LEU 278 Ca -0.06 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.90 3ic9 h LEU 278 Cb 0.88 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.62 3ic9 h LEU 278 CO 0.08 0.00 0.00 -1.84 -1.08 0.00 0.00 178.44 175.60 3ic9 n GLU 279 N -3.46 0.05 -0.13 1.13 0.00 -1.26 -0.97 120.64 115.99 3ic9 n GLU 279 Ca 0.00 0.36 0.09 0.00 0.00 0.00 0.00 57.16 57.61 3ic9 n GLU 279 Cb 0.31 -1.60 0.29 0.00 0.00 0.00 0.00 31.44 30.43 3ic9 n GLU 279 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3ic9 n ASN 280 N -1.69 1.92 -4.57 -1.84 3.02 -0.06 -4.87 115.26 107.18 3ic9 n ASN 280 Ca 0.02 -1.84 -0.28 0.00 -0.03 0.00 0.00 54.58 52.45 3ic9 n ASN 280 Cb 0.14 -0.17 -0.10 0.00 -0.61 0.00 0.00 39.78 39.04 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 -1.65 1.41 -0.33 3.41 -4.23 -0.14 -4.25 115.64 109.86 3ic9 s THR 281 Ca 0.30 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.91 3ic9 s THR 281 Cb 0.16 -2.63 0.72 0.00 1.34 0.00 0.00 72.50 72.10 3ic9 s THR 281 CO 0.23 0.00 1.73 -1.54 -0.54 0.00 0.00 174.62 174.50 3ic9 n SER 282 N -1.04 4.91 -4.66 3.99 3.41 -1.26 -4.97 113.62 113.99 3ic9 n SER 282 Ca -0.09 -3.06 -0.42 0.00 -0.26 0.00 0.00 58.87 55.04 3ic9 n SER 282 Cb 0.67 -0.72 -0.03 0.00 -0.26 0.00 0.00 64.21 63.87 3ic9 n SER 282 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3ic9 s ILE 283 N -2.78 3.07 0.26 -1.33 1.01 -1.26 -4.78 121.20 115.39 3ic9 s ILE 283 Ca 0.52 0.09 -0.29 0.00 0.00 0.00 0.00 60.65 60.96 3ic9 s ILE 283 Cb 0.41 -3.06 -0.09 0.00 0.01 0.00 0.00 42.46 39.73 3ic9 s ILE 283 CO 0.13 -0.01 1.18 -1.61 0.00 0.00 0.00 174.94 174.64 3ic9 s GLU 284 N 4.42 4.52 0.15 2.79 2.02 -1.26 -4.98 118.70 126.36 3ic9 s GLU 284 Ca 0.87 1.93 0.11 0.00 0.02 0.00 0.00 54.97 57.90 3ic9 s GLU 284 Cb -0.42 -3.18 -0.04 0.00 0.10 0.00 0.00 34.13 30.59 3ic9 s GLU 284 CO 0.40 0.01 -0.25 -0.51 0.02 0.00 0.00 175.26 174.94 3ic9 s LEU 285 N -1.09 2.41 0.93 1.80 1.43 -1.26 -1.63 118.68 121.27 3ic9 s LEU 285 Ca 0.49 -0.76 -0.15 0.00 -1.03 0.00 0.00 54.13 52.68 3ic9 s LEU 285 Cb -0.34 -1.25 0.17 0.00 0.03 0.00 0.00 46.19 44.80 3ic9 s LEU 285 CO 0.42 0.16 1.29 1.51 0.23 0.00 0.00 176.35 179.96 3ic9 s ASP 286 N -2.27 3.43 0.00 2.29 3.84 0.45 -4.85 116.67 119.56 3ic9 s ASP 286 Ca 0.17 0.40 0.03 0.00 -0.00 0.00 0.00 52.55 53.15 3ic9 s ASP 286 Cb -0.09 -0.56 0.16 0.00 -1.38 0.00 0.00 42.92 41.05 3ic9 s ASP 286 CO 0.08 -2.55 1.02 1.17 -0.00 0.00 0.00 175.17 174.88 3ic9 n LYS 287 N -3.67 0.03 -0.17 2.11 4.81 -1.26 -0.19 118.16 119.81 3ic9 n LYS 287 Ca 0.13 0.34 0.09 0.00 -0.87 0.00 0.00 58.31 58.01 3ic9 n LYS 287 Cb 0.60 -1.50 0.18 0.00 0.02 0.00 0.00 35.03 34.33 3ic9 n LYS 287 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 3ic9 n LYS 288 N -1.39 2.27 -1.48 1.64 4.01 -1.26 -4.98 118.16 116.98 3ic9 n LYS 288 Ca 0.01 -2.07 -0.09 0.00 -0.51 0.00 0.00 58.31 55.65 3ic9 n LYS 288 Cb 0.03 -1.41 -0.03 0.00 -0.51 0.00 0.00 35.03 33.11 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 1.14 -3.83 -4.74 4.39 3.02 0.73 -5.03 115.26 110.94 3ic9 n ASN 289 Ca 0.16 0.16 -0.39 0.00 -0.03 0.00 0.00 54.58 54.49 3ic9 n ASN 289 Cb 0.51 -2.35 -0.06 0.00 -0.61 0.00 0.00 39.78 37.28 3ic9 n ASN 289 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3ic9 s SER 290 N -2.83 6.86 0.17 6.41 0.01 -1.25 -4.81 113.70 118.25 3ic9 s SER 290 Ca 0.00 1.02 -0.34 0.00 1.31 0.00 0.00 55.95 57.95 3ic9 s SER 290 Cb 0.00 -2.34 -0.14 0.00 0.21 0.00 0.00 66.02 63.75 3ic9 s SER 290 CO 0.00 0.02 1.56 -2.65 0.41 0.00 0.00 173.24 172.58 3ic9 n PRO 291 N 3.31 2.15 -2.37 12.44 -0.02 -1.26 -0.41 135.00 148.84 3ic9 n PRO 291 Ca -0.06 0.77 -0.38 0.00 -2.02 0.00 0.00 63.50 61.81 3ic9 n PRO 291 Cb 0.51 -2.53 -0.03 0.00 -0.02 0.00 0.00 33.50 31.43 3ic9 n PRO 291 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3ic9 s LEU 292 N 0.80 4.27 0.04 2.45 1.43 -0.65 -4.83 118.68 122.19 3ic9 s LEU 292 Ca 0.77 2.29 -0.20 0.00 -1.03 0.00 0.00 54.13 55.97 3ic9 s LEU 292 Cb -0.67 -3.95 0.04 0.00 0.03 0.00 0.00 46.19 41.64 3ic9 s LEU 292 CO 0.39 -0.52 0.45 0.72 0.23 0.00 0.00 176.35 177.62 3ic9 s PHE 293 N -1.40 -0.32 -0.27 0.29 -0.12 -1.26 -3.98 117.98 110.93 3ic9 s PHE 293 Ca 0.54 0.33 -0.29 0.00 -0.05 0.00 0.00 56.93 57.46 3ic9 s PHE 293 Cb -0.30 0.25 0.01 0.00 -0.63 0.00 0.00 43.02 42.35 3ic9 s PHE 293 CO 0.38 -0.58 1.17 0.34 -0.05 0.00 0.00 175.22 176.47 3ic9 s ASP 294 N -1.94 6.90 0.47 1.98 -1.08 0.23 -4.92 116.67 118.31 3ic9 s ASP 294 Ca -0.06 1.28 0.30 0.00 -0.52 0.00 0.00 52.55 53.56 3ic9 s ASP 294 Cb -0.01 -2.54 1.16 0.00 -1.46 0.00 0.00 42.92 40.07 3ic9 s ASP 294 CO -0.01 -0.87 1.88 1.05 0.52 0.00 0.00 175.17 177.74 3ic9 h GLU 295 N 8.30 0.00 0.14 4.34 4.11 -1.96 0.61 114.58 130.13 3ic9 h GLU 295 Ca -0.23 0.00 -0.36 0.00 0.07 0.00 0.00 59.36 58.84 3ic9 h GLU 295 Cb 1.08 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.32 3ic9 h GLU 295 CO 1.01 0.00 -1.93 -0.07 0.07 0.00 0.00 179.01 178.09 3ic9 h LEU 296 N 0.00 0.45 0.00 3.06 3.38 -1.91 -3.41 115.31 116.89 3ic9 h LEU 296 Ca 0.00 -0.92 0.00 0.00 0.09 0.00 0.00 57.88 57.05 3ic9 h LEU 296 Cb 0.55 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.15 3ic9 h LEU 296 CO 0.00 1.81 -1.68 0.35 0.09 0.00 0.00 178.44 179.01 3ic9 n THR 297 N -3.50 0.04 -1.00 0.22 -2.24 -1.16 -1.09 114.28 105.56 3ic9 n THR 297 Ca -0.30 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 3ic9 n THR 297 Cb 1.06 0.20 0.00 0.00 -2.10 0.00 0.00 70.33 69.48 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 -2.11 0.53 -4.72 3.22 4.77 0.21 -4.65 117.00 114.25 3ic9 n LEU 298 Ca -0.02 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.54 3ic9 n LEU 298 Cb 0.51 -1.56 -0.03 0.00 -2.33 0.00 0.00 43.42 40.01 3ic9 n LEU 298 CO 0.45 -0.53 0.93 -1.10 -1.33 0.00 0.00 177.39 175.81 3ic9 s GLN 299 N -1.06 4.42 0.72 3.23 -0.21 -1.25 -0.60 119.66 124.90 3ic9 s GLN 299 Ca 0.00 1.88 -0.12 0.00 0.02 0.00 0.00 55.36 57.14 3ic9 s GLN 299 Cb 0.00 -3.29 0.17 0.00 1.00 0.00 0.00 33.01 30.89 3ic9 s GLN 299 CO 0.00 -0.26 0.78 0.25 -2.12 0.00 0.00 175.29 173.93 3ic9 n THR 300 N 3.56 0.00 0.31 -0.19 -2.24 0.09 -0.60 114.28 115.21 3ic9 n THR 300 Ca 0.08 -0.46 0.19 0.00 -2.27 0.00 0.00 64.05 61.59 3ic9 n THR 300 Cb 0.45 -1.40 1.05 0.00 -2.10 0.00 0.00 70.33 68.33 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 -1.66 0.00 -3.59 3.42 4.64 -1.86 -3.33 113.55 111.17 3ic9 h SER 301 Ca -0.27 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.41 3ic9 h SER 301 Cb 0.79 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.74 3ic9 h SER 301 CO 0.18 0.00 0.22 -0.69 -0.87 0.00 0.00 176.83 175.67 3ic9 s VAL 302 N -4.42 4.78 -0.88 0.95 1.01 -1.26 -4.94 120.40 115.63 3ic9 s VAL 302 Ca -0.05 0.37 0.12 0.00 0.00 0.00 0.00 61.98 62.42 3ic9 s VAL 302 Cb 0.14 -4.21 0.11 0.00 0.00 0.00 0.00 36.38 32.42 3ic9 s VAL 302 CO 0.48 -0.56 1.39 -0.90 0.00 0.00 0.00 175.10 175.51 3ic9 n ASP 303 N 6.36 0.12 -1.05 3.32 5.68 -1.25 -1.03 116.55 128.71 3ic9 n ASP 303 Ca -0.00 0.54 0.10 0.00 -0.50 0.00 0.00 54.79 54.93 3ic9 n ASP 303 Cb 0.48 -0.56 0.21 0.00 -1.14 0.00 0.00 41.12 40.11 3ic9 n ASP 303 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3ic9 n HIS 304 N -1.64 0.55 -4.89 2.11 1.44 -1.26 -4.89 115.22 106.63 3ic9 n HIS 304 Ca 0.02 -0.32 -0.32 0.00 -2.01 0.00 0.00 57.72 55.08 3ic9 n HIS 304 Cb 0.12 -0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.07 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 -1.25 2.19 0.25 0.61 1.01 -0.20 -1.55 121.20 122.26 3ic9 s ILE 305 Ca 0.36 -0.95 0.10 0.00 0.00 0.00 0.00 60.65 60.16 3ic9 s ILE 305 Cb 0.20 -1.87 -0.04 0.00 0.01 0.00 0.00 42.46 40.76 3ic9 s ILE 305 CO 0.28 0.55 -0.08 -0.36 0.00 0.00 0.00 174.94 175.33 3ic9 s PHE 306 N 0.58 2.58 -0.04 3.97 0.08 -0.33 -0.73 117.98 124.09 3ic9 s PHE 306 Ca -0.12 -0.25 -0.01 0.00 0.12 0.00 0.00 56.93 56.67 3ic9 s PHE 306 Cb -0.17 -1.17 0.03 0.00 -0.57 0.00 0.00 43.02 41.15 3ic9 s PHE 306 CO 0.03 0.62 0.02 0.54 -0.10 0.00 0.00 175.22 176.33 3ic9 s VAL 307 N -2.21 0.12 0.02 -0.44 0.11 0.23 -0.79 120.40 117.44 3ic9 s VAL 307 Ca 0.29 0.21 0.02 0.00 -2.93 0.00 0.00 61.98 59.57 3ic9 s VAL 307 Cb -0.07 -0.28 -0.01 0.00 -1.53 0.00 0.00 36.38 34.49 3ic9 s VAL 307 CO 0.17 0.18 -0.06 0.00 -3.33 0.00 0.00 175.10 172.07 3ic9 s ALA 308 N 1.60 0.42 0.00 1.54 0.00 0.08 -4.66 121.76 120.75 3ic9 s ALA 308 Ca -0.02 -0.44 0.00 0.00 0.00 0.00 0.00 51.96 51.50 3ic9 s ALA 308 Cb -0.13 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 22.97 3ic9 s ALA 308 CO -0.03 0.03 0.00 0.41 0.00 0.00 0.00 175.76 176.17 3ic9 n GLY 309 N 2.28 -1.09 0.37 0.00 0.00 -1.26 -3.81 105.19 101.67 3ic9 n GLY 309 Ca -0.18 -1.51 0.19 0.00 0.00 0.00 0.00 46.02 44.52 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 1.95 0.00 -0.51 1.61 5.19 -1.85 -2.78 116.42 120.03 3ic9 h ASP 310 Ca 0.00 0.00 0.10 0.00 -0.62 0.00 0.00 57.03 56.51 3ic9 h ASP 310 Cb 0.00 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.48 3ic9 h ASP 310 CO 0.00 0.00 0.35 0.00 -3.12 0.00 0.00 179.24 176.47 3ic9 h ALA 311 N 1.59 2.14 -0.17 3.45 0.00 -1.65 0.43 119.26 125.05 3ic9 h ALA 311 Ca 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3ic9 h ALA 311 Cb 0.86 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.61 3ic9 h ALA 311 CO -0.00 -0.27 0.00 0.27 0.00 0.00 0.00 179.25 179.25 3ic9 n ASN 312 N -4.45 1.43 -2.04 0.00 0.23 -1.05 -4.72 115.26 104.66 3ic9 n ASN 312 Ca 0.08 -1.73 -0.19 0.00 -0.53 0.00 0.00 54.58 52.21 3ic9 n ASN 312 Cb 0.40 -0.11 -0.04 0.00 -2.08 0.00 0.00 39.78 37.95 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 0.19 -5.23 -4.06 0.53 5.15 0.14 -4.96 115.26 107.02 3ic9 n ASN 313 Ca 0.14 0.22 -0.19 0.00 -0.60 0.00 0.00 54.58 54.16 3ic9 n ASN 313 Cb 0.28 -4.49 -0.14 0.00 -0.53 0.00 0.00 39.78 34.89 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 -2.79 0.82 -1.23 -0.44 2.01 -1.26 -4.84 115.64 107.91 3ic9 s THR 314 Ca 0.00 -0.59 -0.15 0.00 0.31 0.00 0.00 61.69 61.26 3ic9 s THR 314 Cb 0.00 -0.71 -0.00 0.00 0.01 0.00 0.00 72.50 71.79 3ic9 s THR 314 CO 0.00 0.13 0.68 0.18 -0.69 0.00 0.00 174.62 174.91 3ic9 n LEU 315 N 2.54 -2.54 -3.41 4.42 4.77 -1.26 -4.74 117.00 116.77 3ic9 n LEU 315 Ca -0.15 -1.02 -0.40 0.00 -0.03 0.00 0.00 56.01 54.41 3ic9 n LEU 315 Cb 0.56 -2.32 -0.02 0.00 -2.33 0.00 0.00 43.42 39.32 3ic9 n LEU 315 CO 0.24 0.48 3.11 0.35 -1.33 0.00 0.00 177.39 180.24 3ic9 n THR 316 N -4.30 4.35 -4.24 -5.08 -2.24 -1.26 -4.40 114.28 97.12 3ic9 n THR 316 Ca -0.17 -2.98 -0.17 0.00 -2.27 0.00 0.00 64.05 58.46 3ic9 n THR 316 Cb 0.62 -2.52 -0.11 0.00 -2.10 0.00 0.00 70.33 66.22 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 0.08 2.43 0.04 3.22 2.01 -1.26 -5.02 118.68 120.18 3ic9 s LEU 317 Ca 0.63 -0.85 -0.30 0.00 0.01 0.00 0.00 54.13 53.63 3ic9 s LEU 317 Cb 0.17 -0.50 -0.17 0.00 0.01 0.00 0.00 46.19 45.70 3ic9 s LEU 317 CO -0.07 -0.18 1.41 0.25 1.01 0.00 0.00 176.35 178.77 3ic9 h LEU 318 N 3.38 -0.68 -2.14 1.79 7.12 -1.99 -0.55 115.31 122.23 3ic9 h LEU 318 Ca -0.39 -0.02 0.00 0.00 0.13 0.00 0.00 57.88 57.60 3ic9 h LEU 318 Cb 1.20 0.18 -0.00 0.00 -0.53 0.00 0.00 40.66 41.50 3ic9 h LEU 318 CO 0.53 -0.39 0.00 1.12 -0.13 0.00 0.00 178.44 179.58 3ic9 h HIS 319 N -0.95 0.00 -0.20 1.25 2.07 -1.98 -1.38 115.15 113.96 3ic9 h HIS 319 Ca -0.08 0.00 -0.21 0.00 -2.85 0.00 0.00 60.37 57.23 3ic9 h HIS 319 Cb 0.66 0.00 0.01 0.00 2.57 0.00 0.00 27.41 30.65 3ic9 h HIS 319 CO -0.01 0.00 -0.69 0.93 -3.07 0.00 0.00 177.93 175.09 3ic9 h GLU 320 N 0.00 0.81 -0.94 5.12 4.39 -1.77 -1.65 114.58 120.54 3ic9 h GLU 320 Ca 0.00 -0.61 0.06 0.00 0.34 0.00 0.00 59.36 59.15 3ic9 h GLU 320 Cb 0.00 0.11 -0.06 0.00 -0.10 0.00 0.00 28.75 28.70 3ic9 h GLU 320 CO -0.00 1.23 0.61 0.00 -1.16 0.00 0.00 179.01 179.69 3ic9 h ALA 321 N 0.59 1.45 -0.50 3.43 0.00 -0.09 0.39 119.26 124.54 3ic9 h ALA 321 Ca -0.03 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 3ic9 h ALA 321 Cb 1.31 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 3ic9 h ALA 321 CO 0.15 0.42 0.02 0.00 0.00 0.00 0.00 179.25 179.83 3ic9 h ALA 322 N 1.48 0.67 -0.55 0.00 0.00 -1.10 -0.83 119.26 118.93 3ic9 h ALA 322 Ca 0.40 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 3ic9 h ALA 322 Cb 0.15 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3ic9 h ALA 322 CO -0.15 0.46 0.04 -0.44 0.00 0.00 0.00 179.25 179.16 3ic9 h ASP 323 N 0.73 0.91 -0.65 0.00 3.32 -0.52 -2.46 116.42 117.75 3ic9 h ASP 323 Ca 0.14 -0.29 0.11 0.00 0.02 0.00 0.00 57.03 57.02 3ic9 h ASP 323 Cb 0.49 -0.24 -0.08 0.00 0.22 0.00 0.00 39.33 39.71 3ic9 h ASP 323 CO 0.02 0.97 0.23 0.44 -1.72 0.00 0.00 179.24 179.18 3ic9 h ASP 324 N 0.83 0.20 -0.47 6.45 5.19 -0.06 -0.93 116.42 127.62 3ic9 h ASP 324 Ca 0.16 0.09 0.04 0.00 -0.62 0.00 0.00 57.03 56.71 3ic9 h ASP 324 Cb 0.48 0.09 -0.04 0.00 0.18 0.00 0.00 39.33 40.03 3ic9 h ASP 324 CO 0.02 0.10 0.22 1.23 -3.12 0.00 0.00 179.24 177.69 3ic9 h GLY 325 N 0.39 0.65 1.01 2.75 0.00 -0.88 0.19 103.07 107.18 3ic9 h GLY 325 Ca 0.34 -0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.51 3ic9 h GLY 325 CO -0.36 0.09 0.45 1.70 0.00 0.00 0.00 176.54 178.42 3ic9 h LYS 326 N 0.44 1.03 0.28 4.80 1.63 -0.92 0.19 116.57 124.02 3ic9 h LYS 326 Ca 0.21 -0.10 -0.01 0.00 -0.85 0.00 0.00 60.65 59.90 3ic9 h LYS 326 Cb 0.13 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 31.55 3ic9 h LYS 326 CO -0.16 0.74 -0.13 0.28 -3.45 0.00 0.00 179.45 176.73 3ic9 h VAL 327 N 1.04 0.75 -0.59 2.00 2.07 -0.53 -1.58 116.25 119.41 3ic9 h VAL 327 Ca 0.27 -0.60 -0.05 0.00 0.82 0.00 0.00 66.70 67.15 3ic9 h VAL 327 Cb -0.02 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 3ic9 h VAL 327 CO -0.05 0.12 0.19 0.00 0.02 0.00 0.00 177.57 177.85 3ic9 h ALA 328 N -0.11 0.77 -0.36 1.67 0.00 -0.58 -0.88 119.26 119.78 3ic9 h ALA 328 Ca -0.04 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 3ic9 h ALA 328 Cb 0.48 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 3ic9 h ALA 328 CO 0.06 0.43 0.17 0.78 0.00 0.00 0.00 179.25 180.69 3ic9 h GLY 329 N 0.83 0.56 0.79 0.00 0.00 -0.64 0.26 103.07 104.86 3ic9 h GLY 329 Ca 0.19 -0.29 -0.02 0.00 0.00 0.00 0.00 47.33 47.21 3ic9 h GLY 329 CO -0.01 0.27 0.00 -0.84 0.00 0.00 0.00 176.54 175.96 3ic9 h THR 330 N 0.44 1.25 -0.38 4.70 2.02 -1.17 0.68 112.91 120.46 3ic9 h THR 330 Ca 0.12 -0.84 -0.11 0.00 0.77 0.00 0.00 66.41 66.36 3ic9 h THR 330 Cb 0.13 1.50 -0.02 0.00 -1.74 0.00 0.00 68.15 68.03 3ic9 h THR 330 CO -0.01 0.25 -0.19 0.78 0.37 0.00 0.00 175.52 176.71 3ic9 h ASN 331 N 0.02 0.74 -0.45 4.18 2.35 -1.07 0.12 115.58 121.47 3ic9 h ASN 331 Ca 0.04 -0.25 -0.07 0.00 -0.55 0.00 0.00 56.30 55.48 3ic9 h ASN 331 Cb 0.37 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 3ic9 h ASN 331 CO 0.01 0.93 0.01 0.00 -1.65 0.00 0.00 177.43 176.72 3ic9 h ALA 332 N 1.13 0.60 -0.04 -0.83 0.00 -0.44 -1.24 119.26 118.45 3ic9 h ALA 332 Ca 0.10 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 3ic9 h ALA 332 Cb 0.68 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 3ic9 h ALA 332 CO 0.05 0.39 0.02 0.78 0.00 0.00 0.00 179.25 180.48 3ic9 h GLY 333 N 0.63 0.06 1.32 0.00 0.00 -0.43 -3.27 103.07 101.37 3ic9 h GLY 333 Ca 0.13 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.43 3ic9 h GLY 333 CO 0.02 0.03 -0.37 0.00 0.00 0.00 0.00 176.54 176.22 3ic9 n ALA 334 N -2.18 3.11 -1.32 3.60 0.00 0.38 -4.68 120.51 119.42 3ic9 n ALA 334 Ca -0.07 -0.26 -0.49 0.00 0.00 0.00 0.00 53.44 52.62 3ic9 n ALA 334 Cb 0.10 -1.23 -0.05 0.00 0.00 0.00 0.00 19.45 18.26 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 -1.59 0.17 1.51 0.00 9.36 -0.47 -1.59 117.16 124.54 3ic9 n TYR 335 Ca 0.06 0.93 0.07 0.00 3.32 0.00 0.00 57.90 62.27 3ic9 n TYR 335 Cb 0.35 -1.84 0.28 0.00 -0.63 0.00 0.00 39.34 37.49 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 1.18 1.40 -2.31 2.98 -0.04 -1.26 -5.06 135.00 131.89 3ic9 n PRO 336 Ca 0.17 -0.62 -0.43 0.00 -0.04 0.00 0.00 63.50 62.59 3ic9 n PRO 336 Cb 0.13 -1.25 -0.02 0.00 -0.04 0.00 0.00 33.50 32.32 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 -1.82 4.04 -0.09 0.52 1.01 -0.62 -5.00 120.40 118.43 3ic9 s VAL 337 Ca 0.22 1.22 0.04 0.00 0.00 0.00 0.00 61.98 63.45 3ic9 s VAL 337 Cb 0.11 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 32.57 3ic9 s VAL 337 CO 0.16 -0.25 -0.23 -0.63 0.00 0.00 0.00 175.10 174.15 3ic9 s ILE 338 N 4.15 1.98 0.18 2.22 -1.09 -1.26 -4.64 121.20 122.74 3ic9 s ILE 338 Ca 0.61 -0.97 0.10 0.00 -2.23 0.00 0.00 60.65 58.15 3ic9 s ILE 338 Cb -0.22 -1.71 -0.04 0.00 -1.58 0.00 0.00 42.46 38.91 3ic9 s ILE 338 CO 0.22 0.54 -0.22 0.00 -1.23 0.00 0.00 174.94 174.25 3ic9 s ALA 339 N 0.33 2.31 -0.07 9.38 0.00 -1.26 -5.13 121.76 127.31 3ic9 s ALA 339 Ca -0.17 -1.56 -0.15 0.00 0.00 0.00 0.00 51.96 50.08 3ic9 s ALA 339 Cb -0.17 -0.28 -0.05 0.00 0.00 0.00 0.00 23.12 22.62 3ic9 s ALA 339 CO 0.08 0.37 0.37 1.14 0.00 0.00 0.00 175.76 177.72 3ic9 s GLN 340 N -2.64 4.06 0.40 0.00 0.00 -1.26 -4.51 119.66 115.70 3ic9 s GLN 340 Ca 0.18 0.30 -0.27 0.00 -0.00 0.00 0.00 55.36 55.57 3ic9 s GLN 340 Cb -0.07 -3.32 -0.09 0.00 0.00 0.00 0.00 33.01 29.53 3ic9 s GLN 340 CO 0.08 0.47 1.36 0.20 0.00 0.00 0.00 175.29 177.40 3ic9 s GLY 341 N -0.31 2.94 -0.51 2.60 0.00 -0.25 -4.97 107.32 106.81 3ic9 s GLY 341 Ca 0.22 1.34 -0.13 0.00 0.00 0.00 0.00 44.72 46.14 3ic9 s GLY 341 CO 0.10 1.96 0.44 1.62 0.00 0.00 0.00 173.10 177.21 3ic9 s GLN 342 N -2.17 2.79 0.55 2.90 2.00 -1.26 -4.88 119.66 119.58 3ic9 s GLN 342 Ca 0.55 -1.72 -0.21 0.00 -2.00 0.00 0.00 55.36 51.99 3ic9 s GLN 342 Cb -0.41 -4.15 -0.05 0.00 0.80 0.00 0.00 33.01 29.20 3ic9 s GLN 342 CO 0.53 -1.27 1.23 1.03 -0.50 0.00 0.00 175.29 176.32 3ic9 s ARG 343 N 1.51 3.21 0.73 1.67 1.81 -1.26 -5.00 118.95 121.61 3ic9 s ARG 343 Ca 0.04 1.91 -0.12 0.00 -1.72 0.00 0.00 55.73 55.84 3ic9 s ARG 343 Cb -0.28 -2.13 0.03 0.00 -0.45 0.00 0.00 34.95 32.12 3ic9 s ARG 343 CO 0.02 -1.04 1.09 1.03 -0.68 0.00 0.00 175.30 175.72 3ic9 s ARG 344 N -3.07 2.49 0.16 3.54 0.52 -1.26 -4.94 118.95 116.39 3ic9 s ARG 344 Ca 0.73 1.21 -0.34 0.00 -0.52 0.00 0.00 55.73 56.81 3ic9 s ARG 344 Cb -0.32 -1.92 -0.13 0.00 0.52 0.00 0.00 34.95 33.09 3ic9 s ARG 344 CO 0.37 -1.47 1.62 0.00 0.02 0.00 0.00 175.30 175.84 3ic9 n ALA 345 N -3.15 1.61 -1.63 2.13 0.00 -1.26 -4.86 120.51 113.35 3ic9 n ALA 345 Ca 0.09 0.43 -0.46 0.00 0.00 0.00 0.00 53.44 53.50 3ic9 n ALA 345 Cb 0.53 -2.39 -0.03 0.00 0.00 0.00 0.00 19.45 17.56 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 3.67 1.62 -3.69 0.00 -0.02 -1.26 -4.77 135.00 130.54 3ic9 n PRO 346 Ca 0.17 0.58 -0.17 0.00 -2.02 0.00 0.00 63.50 62.06 3ic9 n PRO 346 Cb 0.30 -2.15 -0.16 0.00 -0.02 0.00 0.00 33.50 31.47 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 0.34 0.25 -0.02 2.45 2.96 -1.26 -0.96 118.68 122.44 3ic9 s LEU 347 Ca 0.69 0.25 0.01 0.00 -0.22 0.00 0.00 54.13 54.87 3ic9 s LEU 347 Cb -0.74 0.18 0.01 0.00 0.50 0.00 0.00 46.19 46.14 3ic9 s LEU 347 CO 0.52 -0.21 -0.05 -0.55 -1.32 0.00 0.00 176.35 174.73 3ic9 s SER 348 N 1.91 0.79 -0.02 3.68 0.15 -0.11 -4.99 113.70 115.11 3ic9 s SER 348 Ca -0.00 -0.11 0.02 0.00 0.70 0.00 0.00 55.95 56.55 3ic9 s SER 348 Cb -0.12 -0.24 0.00 0.00 -1.71 0.00 0.00 66.02 63.95 3ic9 s SER 348 CO -0.05 0.01 -0.07 -0.69 1.20 0.00 0.00 173.24 173.64 3ic9 s VAL 349 N 0.37 0.60 -0.15 4.45 1.01 -1.26 -1.11 120.40 124.30 3ic9 s VAL 349 Ca -0.04 -0.28 0.01 0.00 0.00 0.00 0.00 61.98 61.67 3ic9 s VAL 349 Cb -0.08 -0.53 0.00 0.00 0.00 0.00 0.00 36.38 35.76 3ic9 s VAL 349 CO -0.00 0.19 -0.17 -0.69 0.00 0.00 0.00 175.10 174.43 3ic9 s VAL 350 N 0.13 2.56 -0.38 2.92 1.01 0.86 -4.97 120.40 122.51 3ic9 s VAL 350 Ca -0.01 -0.81 -0.02 0.00 0.00 0.00 0.00 61.98 61.14 3ic9 s VAL 350 Cb -0.06 -2.07 0.19 0.00 0.00 0.00 0.00 36.38 34.43 3ic9 s VAL 350 CO -0.00 0.52 2.25 0.49 0.00 0.00 0.00 175.10 178.36 3ic9 n PHE 351 N 4.04 1.68 -1.69 5.22 3.72 -1.26 -1.94 117.46 127.23 3ic9 n PHE 351 Ca -0.19 -2.04 -0.18 0.00 -0.05 0.00 0.00 57.45 54.99 3ic9 n PHE 351 Cb 0.52 -1.12 0.12 0.00 -0.94 0.00 0.00 39.48 38.06 3ic9 n PHE 351 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3ic9 n THR 352 N 0.41 0.00 -3.89 4.37 -2.24 -1.26 -4.91 114.28 106.76 3ic9 n THR 352 Ca 0.38 -0.66 -0.24 0.00 -2.27 0.00 0.00 64.05 61.26 3ic9 n THR 352 Cb 0.58 -1.61 -0.17 0.00 -2.10 0.00 0.00 70.33 67.02 3ic9 n THR 352 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3ic9 s GLU 353 N -4.71 0.98 0.88 -0.78 2.12 -1.26 -3.05 118.70 112.88 3ic9 s GLU 353 Ca 0.46 -0.06 -0.10 0.00 0.36 0.00 0.00 54.97 55.63 3ic9 s GLU 353 Cb -0.01 -1.18 0.12 0.00 0.26 0.00 0.00 34.13 33.32 3ic9 s GLU 353 CO 0.32 -0.26 1.13 -2.14 -0.54 0.00 0.00 175.26 173.78 3ic9 s PRO 354 N 1.72 1.33 0.62 4.30 0.02 -1.26 -4.96 135.00 136.77 3ic9 s PRO 354 Ca 0.03 1.43 -0.09 0.00 0.02 0.00 0.00 61.00 62.39 3ic9 s PRO 354 Cb -0.13 -1.77 -0.02 0.00 0.02 0.00 0.00 34.50 32.61 3ic9 s PRO 354 CO -0.05 -2.38 0.99 -0.65 -0.33 0.00 0.00 177.00 174.57 3ic9 s GLN 355 N -4.72 3.27 -0.05 5.54 -0.21 -0.41 -4.65 119.66 118.44 3ic9 s GLN 355 Ca 0.65 0.46 0.06 0.00 0.02 0.00 0.00 55.36 56.55 3ic9 s GLN 355 Cb -0.21 -2.14 -0.02 0.00 1.00 0.00 0.00 33.01 31.64 3ic9 s GLN 355 CO 0.57 -0.66 -0.21 0.08 -2.12 0.00 0.00 175.29 172.95 3ic9 s VAL 356 N -3.13 2.43 -0.01 1.09 1.01 -0.82 -0.35 120.40 120.62 3ic9 s VAL 356 Ca 0.54 -0.95 0.02 0.00 0.00 0.00 0.00 61.98 61.59 3ic9 s VAL 356 Cb -0.11 -1.90 0.00 0.00 0.00 0.00 0.00 36.38 34.37 3ic9 s VAL 356 CO 0.50 0.58 -0.06 0.00 0.00 0.00 0.00 175.10 176.12 3ic9 s ALA 357 N -0.45 0.59 -0.08 5.51 0.00 -1.26 -0.10 121.76 125.98 3ic9 s ALA 357 Ca 0.05 -0.24 0.05 0.00 0.00 0.00 0.00 51.96 51.81 3ic9 s ALA 357 Cb -0.12 -0.20 -0.01 0.00 0.00 0.00 0.00 23.12 22.80 3ic9 s ALA 357 CO 0.01 0.11 -0.24 -1.12 0.00 0.00 0.00 175.76 174.53 3ic9 s SER 358 N 0.05 3.16 0.00 0.00 0.01 -0.27 -4.32 113.70 112.33 3ic9 s SER 358 Ca -0.00 -0.51 0.04 0.00 1.31 0.00 0.00 55.95 56.79 3ic9 s SER 358 Cb -0.05 -1.08 -0.01 0.00 0.21 0.00 0.00 66.02 65.09 3ic9 s SER 358 CO -0.00 0.22 -0.14 -0.69 0.41 0.00 0.00 173.24 173.04 3ic9 s VAL 359 N 0.02 1.07 0.00 3.43 1.01 -0.53 -0.93 120.40 124.46 3ic9 s VAL 359 Ca -0.09 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.22 3ic9 s VAL 359 Cb -0.15 -0.91 0.00 0.00 0.00 0.00 0.00 36.38 35.32 3ic9 s VAL 359 CO 0.05 0.23 0.00 0.61 0.00 0.00 0.00 175.10 175.99 3ic9 n GLY 360 N 2.55 0.49 3.76 4.51 0.00 -0.13 -1.47 105.19 114.91 3ic9 n GLY 360 Ca -0.15 -0.82 -0.41 0.00 0.00 0.00 0.00 46.02 44.64 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 4.38 0.82 0.99 1.43 -0.32 -4.56 118.68 121.42 3ic9 s LEU 361 Ca 0.00 2.79 -0.12 0.00 -1.03 0.00 0.00 54.13 55.78 3ic9 s LEU 361 Cb 0.00 -3.64 0.08 0.00 0.03 0.00 0.00 46.19 42.66 3ic9 s LEU 361 CO 0.00 -0.70 1.10 -0.94 0.23 0.00 0.00 176.35 176.04 3ic9 s SER 362 N -0.05 4.29 0.23 2.29 1.04 -1.26 -4.37 113.70 115.87 3ic9 s SER 362 Ca 0.54 1.29 -0.07 0.00 0.48 0.00 0.00 55.95 58.20 3ic9 s SER 362 Cb -0.43 -2.00 0.31 0.00 0.10 0.00 0.00 66.02 64.00 3ic9 s SER 362 CO 0.52 -2.10 1.81 0.25 0.98 0.00 0.00 173.24 174.70 3ic9 h LEU 363 N -1.18 0.62 -1.04 2.42 5.85 -1.95 -0.04 115.31 119.99 3ic9 h LEU 363 Ca -0.48 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.26 3ic9 h LEU 363 Cb 1.28 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 42.19 3ic9 h LEU 363 CO 0.59 0.38 0.35 0.03 -0.34 0.00 0.00 178.44 179.45 3ic9 h ARG 364 N 0.75 1.03 -0.28 1.25 3.08 -1.96 0.63 114.38 118.88 3ic9 h ARG 364 Ca 0.35 -0.14 -0.14 0.00 0.07 0.00 0.00 59.98 60.12 3ic9 h ARG 364 Cb 0.26 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 3ic9 h ARG 364 CO -0.21 0.79 -0.40 1.96 -1.07 0.00 0.00 179.97 181.04 3ic9 h GLN 365 N 1.03 0.68 -0.12 0.04 4.20 -1.69 -0.91 115.11 118.33 3ic9 h GLN 365 Ca 0.25 -0.35 -0.02 0.00 0.06 0.00 0.00 58.65 58.59 3ic9 h GLN 365 Cb 0.10 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 27.88 3ic9 h GLN 365 CO -0.03 0.96 -0.02 0.82 -0.67 0.00 0.00 178.83 179.88 3ic9 h ILE 366 N 0.55 1.28 -0.69 2.54 2.04 -0.61 -0.95 117.51 121.67 3ic9 h ILE 366 Ca 0.05 -0.91 0.10 0.00 1.00 0.00 0.00 64.86 65.09 3ic9 h ILE 366 Cb 0.93 1.65 -0.07 0.00 -0.74 0.00 0.00 36.82 38.58 3ic9 h ILE 366 CO 0.08 0.26 0.31 -0.33 0.00 0.00 0.00 178.15 178.48 3ic9 h GLU 367 N -0.08 0.51 -0.75 2.37 4.39 -0.82 0.47 114.58 120.68 3ic9 h GLU 367 Ca 0.03 -0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.70 3ic9 h GLU 367 Cb 0.42 -0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 28.91 3ic9 h GLU 367 CO 0.01 0.34 0.46 0.22 -1.16 0.00 0.00 179.01 178.88 3ic9 h ASP 368 N 0.53 0.90 0.16 1.42 3.58 -0.99 -2.88 116.42 119.15 3ic9 h ASP 368 Ca 0.35 -0.06 -0.35 0.00 0.42 0.00 0.00 57.03 57.39 3ic9 h ASP 368 Cb 0.41 -0.23 -0.06 0.00 1.72 0.00 0.00 39.33 41.17 3ic9 h ASP 368 CO -0.30 0.70 -2.17 0.18 -2.88 0.00 0.00 179.24 174.77 3ic9 n LEU 369 N -4.51 0.39 -0.28 2.28 7.99 -0.38 -4.52 117.00 117.98 3ic9 n LEU 369 Ca 0.07 0.13 0.03 0.00 -0.01 0.00 0.00 56.01 56.23 3ic9 n LEU 369 Cb 0.05 0.34 0.05 0.00 -0.11 0.00 0.00 43.42 43.75 3ic9 n LEU 369 CO 0.37 0.48 0.46 -1.22 -1.51 0.00 0.00 177.39 175.97 3ic9 n TYR 370 N -2.87 0.12 -4.00 -1.77 4.01 0.16 -5.04 117.16 107.78 3ic9 n TYR 370 Ca -0.28 -0.26 -0.10 0.00 -0.16 0.00 0.00 57.90 57.10 3ic9 n TYR 370 Cb 1.12 -0.02 -0.07 0.00 -0.31 0.00 0.00 39.34 40.06 3ic9 n TYR 370 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3ic9 s ALA 371 N -0.74 0.07 0.07 -0.72 0.00 -1.08 0.10 121.76 119.46 3ic9 s ALA 371 Ca 0.09 -0.98 0.02 0.00 0.00 0.00 0.00 51.96 51.09 3ic9 s ALA 371 Cb 0.05 0.99 -0.01 0.00 0.00 0.00 0.00 23.12 24.16 3ic9 s ALA 371 CO 0.08 -0.70 0.06 -0.40 0.00 0.00 0.00 175.76 174.80 3ic9 n ASP 372 N -0.27 -0.15 -0.32 0.00 5.68 0.25 -4.63 116.55 117.11 3ic9 n ASP 372 Ca -0.05 -1.45 0.23 0.00 -0.50 0.00 0.00 54.79 53.02 3ic9 n ASP 372 Cb 0.63 0.35 0.52 0.00 -1.14 0.00 0.00 41.12 41.48 3ic9 n ASP 372 CO 0.00 0.00 0.00 0.06 -1.33 0.00 0.00 177.20 175.93 3ic9 h GLN 373 N 0.00 0.37 0.00 0.11 3.07 -2.02 -3.21 115.11 113.43 3ic9 h GLN 373 Ca -0.05 -0.02 0.00 0.00 0.09 0.00 0.00 58.65 58.67 3ic9 h GLN 373 Cb 0.25 -0.08 0.00 0.00 0.08 0.00 0.00 27.48 27.73 3ic9 h GLN 373 CO 0.07 0.24 -0.46 -0.25 0.09 0.00 0.00 178.83 178.52 3ic9 n ASP 374 N -4.60 0.88 -3.79 0.06 8.00 -1.26 -5.04 116.55 110.79 3ic9 n ASP 374 Ca 0.25 -0.52 -0.12 0.00 0.71 0.00 0.00 54.79 55.11 3ic9 n ASP 374 Cb 0.88 1.05 -0.08 0.00 -0.02 0.00 0.00 41.12 42.95 3ic9 n ASP 374 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ic9 s ALA 375 N -1.72 -0.59 -0.04 2.24 0.00 -1.21 -5.16 121.76 115.28 3ic9 s ALA 375 Ca 0.01 0.00 0.02 0.00 0.00 0.00 0.00 51.96 51.99 3ic9 s ALA 375 Cb 0.04 0.22 0.01 0.00 0.00 0.00 0.00 23.12 23.40 3ic9 s ALA 375 CO 0.25 -0.34 -0.08 0.00 0.00 0.00 0.00 175.76 175.59 3ic9 s ALA 376 N -2.10 0.87 -0.48 0.00 0.00 -1.26 -0.58 121.76 118.20 3ic9 s ALA 376 Ca -0.08 -0.23 0.03 0.00 0.00 0.00 0.00 51.96 51.67 3ic9 s ALA 376 Cb -0.03 -0.41 0.53 0.00 0.00 0.00 0.00 23.12 23.21 3ic9 s ALA 376 CO -0.01 0.08 1.80 -1.71 0.00 0.00 0.00 175.76 175.91 3ic9 n ASN 377 N 3.70 5.13 -4.09 0.00 4.05 0.28 -4.95 115.26 119.39 3ic9 n ASN 377 Ca -0.22 -3.73 -0.10 0.00 0.45 0.00 0.00 54.58 50.98 3ic9 n ASN 377 Cb 0.52 -0.80 -0.10 0.00 1.23 0.00 0.00 39.78 40.63 3ic9 n ASN 377 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 177.26 173.49 3ic9 s TYR 378 N -3.53 0.63 0.28 1.20 -0.85 -1.25 -0.86 117.35 112.97 3ic9 s TYR 378 Ca 0.57 -0.82 0.06 0.00 -0.52 0.00 0.00 57.07 56.36 3ic9 s TYR 378 Cb 0.47 -0.40 -0.06 0.00 0.38 0.00 0.00 41.96 42.35 3ic9 s TYR 378 CO 0.03 -0.21 -0.04 0.14 -1.52 0.00 0.00 175.55 173.95 3ic9 s VAL 379 N -2.93 1.52 -0.08 -3.49 -7.23 0.38 -4.75 120.40 103.82 3ic9 s VAL 379 Ca 0.02 -2.09 0.05 0.00 -1.81 0.00 0.00 61.98 58.14 3ic9 s VAL 379 Cb 0.01 -2.49 -0.01 0.00 0.56 0.00 0.00 36.38 34.45 3ic9 s VAL 379 CO -0.05 -0.26 -0.23 -0.69 -0.31 0.00 0.00 175.10 173.56 3ic9 s VAL 380 N -3.09 2.23 -0.10 1.32 1.01 -1.26 -1.89 120.40 118.61 3ic9 s VAL 380 Ca 0.30 -0.98 -0.02 0.00 0.00 0.00 0.00 61.98 61.28 3ic9 s VAL 380 Cb 0.05 -1.84 -0.03 0.00 0.00 0.00 0.00 36.38 34.55 3ic9 s VAL 380 CO 0.12 0.56 -0.02 -0.83 0.00 0.00 0.00 175.10 174.93 3ic9 s GLY 381 N 0.04 1.79 0.10 4.51 0.00 0.14 -4.39 107.32 109.52 3ic9 s GLY 381 Ca -0.09 -0.82 0.05 0.00 0.00 0.00 0.00 44.72 43.86 3ic9 s GLY 381 CO 0.06 -0.46 -0.13 1.20 0.00 0.00 0.00 173.10 173.76 3ic9 s GLN 382 N -0.57 0.92 -0.03 2.90 -0.21 -1.25 -0.38 119.66 121.05 3ic9 s GLN 382 Ca 0.09 -1.13 -0.11 0.00 0.02 0.00 0.00 55.36 54.24 3ic9 s GLN 382 Cb -0.12 -0.81 0.02 0.00 1.00 0.00 0.00 33.01 33.10 3ic9 s GLN 382 CO 0.02 0.16 0.23 0.54 -2.12 0.00 0.00 175.29 174.12 3ic9 s VAL 383 N -1.91 0.05 -0.12 1.09 0.11 -0.82 -4.03 120.40 114.76 3ic9 s VAL 383 Ca 0.05 -0.42 -0.06 0.00 -2.93 0.00 0.00 61.98 58.62 3ic9 s VAL 383 Cb -0.06 -0.48 -0.04 0.00 -1.53 0.00 0.00 36.38 34.27 3ic9 s VAL 383 CO 0.02 -0.23 0.09 -0.55 -3.33 0.00 0.00 175.10 171.10 3ic9 s SER 384 N -0.93 5.92 0.00 3.54 0.15 -1.26 -1.31 113.70 119.80 3ic9 s SER 384 Ca -0.10 0.31 0.28 0.00 0.70 0.00 0.00 55.95 57.13 3ic9 s SER 384 Cb -0.05 -1.87 1.04 0.00 -1.71 0.00 0.00 66.02 63.43 3ic9 s SER 384 CO 0.02 0.36 1.75 0.49 1.20 0.00 0.00 173.24 177.06 3ic9 n PHE 385 N 2.31 0.00 -0.03 3.44 3.72 -0.20 -3.90 117.46 122.80 3ic9 n PHE 385 Ca -0.19 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.22 3ic9 n PHE 385 Cb 0.54 -0.20 0.33 0.00 -0.94 0.00 0.00 39.48 39.22 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 0.63 0.59 -0.49 -1.08 5.08 -1.74 -2.70 114.58 114.88 3ic9 h GLU 386 Ca 0.00 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 3ic9 h GLU 386 Cb 0.42 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.56 3ic9 h GLU 386 CO 0.00 0.50 0.00 0.41 -1.00 0.00 0.00 179.01 178.92 3ic9 n GLY 387 N -1.15 2.80 3.69 -3.84 0.00 -1.25 -4.82 105.19 100.61 3ic9 n GLY 387 Ca 0.03 -0.61 -0.42 0.00 0.00 0.00 0.00 46.02 45.02 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 -1.25 4.40 0.09 1.61 -0.44 -1.02 -4.98 119.66 118.08 3ic9 s GLN 388 Ca 0.35 1.43 -0.31 0.00 -2.50 0.00 0.00 55.36 54.34 3ic9 s GLN 388 Cb 0.20 -3.55 -0.13 0.00 -1.64 0.00 0.00 33.01 27.89 3ic9 s GLN 388 CO 0.21 -0.35 1.50 0.78 0.50 0.00 0.00 175.29 177.93 3ic9 h GLY 389 N 8.11 -1.17 1.00 2.59 0.00 -1.93 -0.57 103.07 111.10 3ic9 h GLY 389 Ca -0.31 0.64 -0.02 0.00 0.00 0.00 0.00 47.33 47.64 3ic9 h GLY 389 CO 0.86 -0.29 0.32 -0.09 0.00 0.00 0.00 176.54 177.35 3ic9 h ARG 390 N -0.67 0.88 -0.68 4.80 9.65 -1.86 -0.44 114.38 126.06 3ic9 h ARG 390 Ca -0.00 -0.11 0.07 0.00 -1.10 0.00 0.00 59.98 58.83 3ic9 h ARG 390 Cb 0.68 -0.17 -0.06 0.00 -1.39 0.00 0.00 29.97 29.03 3ic9 h ARG 390 CO -0.27 0.69 0.37 0.77 2.80 0.00 0.00 179.97 184.33 3ic9 h SER 391 N 0.85 0.52 -0.16 -3.80 0.02 -1.84 -2.39 113.55 106.76 3ic9 h SER 391 Ca 0.22 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.19 3ic9 h SER 391 Cb 0.08 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 3ic9 h SER 391 CO -0.03 0.33 0.04 -0.09 -1.14 0.00 0.00 176.83 175.94 3ic9 h ARG 392 N 0.66 0.25 0.00 3.45 2.43 -0.75 0.39 114.38 120.81 3ic9 h ARG 392 Ca 0.32 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 3ic9 h ARG 392 Cb 0.24 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 3ic9 h ARG 392 CO -0.21 0.38 0.00 0.28 -1.51 0.00 0.00 179.97 178.91 3ic9 n VAL 393 N -4.83 0.00 -2.41 0.20 0.31 -0.21 -4.46 118.33 106.93 3ic9 n VAL 393 Ca -0.05 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.26 3ic9 n VAL 393 Cb 0.15 -0.01 0.02 0.00 -0.91 0.00 0.00 33.84 33.09 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 0.11 1.17 0.33 2.92 0.00 -0.84 -5.11 105.19 103.77 3ic9 n GLY 395 Ca 0.00 -0.44 0.08 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.28 1.32 -1.69 1.61 4.76 0.13 -4.93 118.16 119.08 3ic9 n LYS 396 Ca -0.11 -2.79 -0.42 0.00 -2.87 0.00 0.00 58.31 52.12 3ic9 n LYS 396 Cb 0.88 -1.47 -0.00 0.00 -1.84 0.00 0.00 35.03 32.59 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 -1.21 4.07 -3.90 4.39 6.94 -1.03 -4.63 115.26 119.88 3ic9 n ASN 397 Ca 0.16 -2.82 -0.14 0.00 -0.02 0.00 0.00 54.58 51.76 3ic9 n ASN 397 Cb 0.67 -1.64 -0.15 0.00 -2.36 0.00 0.00 39.78 36.31 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 3.21 0.22 0.00 -3.83 1.02 -1.26 -3.66 119.74 115.44 3ic9 s LYS 398 Ca 0.48 -0.06 0.00 0.00 0.02 0.00 0.00 55.97 56.41 3ic9 s LYS 398 Cb 0.14 -0.25 0.00 0.00 -0.52 0.00 0.00 37.83 37.21 3ic9 s LYS 398 CO -0.08 0.02 0.00 0.41 -0.92 0.00 0.00 175.35 174.78 3ic9 n GLY 399 N 3.21 1.88 3.14 -3.33 0.00 -1.26 -4.34 105.19 104.48 3ic9 n GLY 399 Ca -0.15 -1.89 -0.13 0.00 0.00 0.00 0.00 46.02 43.85 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 1.10 -0.10 0.99 1.43 -0.02 -1.03 118.68 121.06 3ic9 s LEU 400 Ca 0.00 0.34 0.01 0.00 -1.03 0.00 0.00 54.13 53.45 3ic9 s LEU 400 Cb 0.00 0.87 0.02 0.00 0.03 0.00 0.00 46.19 47.11 3ic9 s LEU 400 CO 0.00 -0.17 -0.11 -0.22 0.23 0.00 0.00 176.35 176.08 3ic9 s LEU 401 N -0.28 1.47 -0.14 1.79 2.96 -0.43 -1.21 118.68 122.84 3ic9 s LEU 401 Ca -0.04 -0.35 -0.04 0.00 -0.22 0.00 0.00 54.13 53.49 3ic9 s LEU 401 Cb -0.03 -0.92 -0.03 0.00 0.50 0.00 0.00 46.19 45.71 3ic9 s LEU 401 CO 0.01 -0.05 -0.01 0.20 -1.32 0.00 0.00 176.35 175.18 3ic9 s ASN 402 N 1.27 5.06 -0.09 3.68 0.01 0.23 -1.95 114.94 123.15 3ic9 s ASN 402 Ca -0.02 -0.02 0.04 0.00 -0.71 0.00 0.00 52.86 52.14 3ic9 s ASN 402 Cb -0.14 -1.74 -0.00 0.00 0.41 0.00 0.00 41.25 39.78 3ic9 s ASN 402 CO -0.04 0.22 -0.23 -0.69 -1.51 0.00 0.00 177.10 174.85 3ic9 s VAL 403 N 0.06 1.99 -0.10 1.60 1.01 0.49 -1.34 120.40 124.11 3ic9 s VAL 403 Ca 0.01 -0.98 -0.01 0.00 0.00 0.00 0.00 61.98 61.00 3ic9 s VAL 403 Cb -0.13 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.50 3ic9 s VAL 403 CO 0.02 0.55 -0.06 -0.31 0.00 0.00 0.00 175.10 175.30 3ic9 s TYR 404 N 0.30 2.97 0.01 5.22 2.02 0.02 0.28 117.35 128.16 3ic9 s TYR 404 Ca -0.17 -0.13 0.01 0.00 -0.37 0.00 0.00 57.07 56.41 3ic9 s TYR 404 Cb -0.17 -1.81 -0.01 0.00 -0.40 0.00 0.00 41.96 39.57 3ic9 s TYR 404 CO 0.08 0.17 -0.04 0.00 -1.57 0.00 0.00 175.55 174.19 3ic9 s ALA 405 N -0.32 0.35 0.06 3.71 0.00 -0.79 -1.00 121.76 123.76 3ic9 s ALA 405 Ca 0.05 -0.30 -0.34 0.00 0.00 0.00 0.00 51.96 51.37 3ic9 s ALA 405 Cb -0.12 -0.04 -0.13 0.00 0.00 0.00 0.00 23.12 22.82 3ic9 s ALA 405 CO 0.02 0.04 1.71 -3.47 0.00 0.00 0.00 175.76 174.07 3ic9 n ASP 406 N 2.63 3.28 0.16 0.00 -0.08 0.42 -0.47 116.55 122.49 3ic9 n ASP 406 Ca -0.15 1.03 0.01 0.00 -1.51 0.00 0.00 54.79 54.17 3ic9 n ASP 406 Cb 0.58 -1.41 0.25 0.00 2.34 0.00 0.00 41.12 42.88 3ic9 n ASP 406 CO 0.00 0.00 0.00 -0.09 0.12 0.00 0.00 177.20 177.23 3ic9 h ARG 407 N 7.37 0.00 0.12 -0.67 2.43 -1.30 0.34 114.38 122.67 3ic9 h ARG 407 Ca -0.46 0.00 -0.24 0.00 -0.81 0.00 0.00 59.98 58.47 3ic9 h ARG 407 Cb 1.26 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 3ic9 h ARG 407 CO 0.91 0.51 -1.16 1.15 -1.51 0.00 0.00 179.97 179.88 3ic9 h THR 408 N 0.00 1.22 0.00 0.20 2.02 -1.90 0.48 112.91 114.92 3ic9 h THR 408 Ca -0.01 -2.44 -0.08 0.00 0.77 0.00 0.00 66.41 64.66 3ic9 h THR 408 Cb 0.96 2.89 -0.01 0.00 -1.74 0.00 0.00 68.15 70.24 3ic9 h THR 408 CO 0.07 0.69 -1.77 -1.54 0.37 0.00 0.00 175.52 173.34 3ic9 n SER 409 N -4.03 1.55 0.00 4.18 3.41 -1.24 -4.51 113.62 112.99 3ic9 n SER 409 Ca -0.21 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.40 3ic9 n SER 409 Cb 0.86 1.43 0.00 0.00 -0.26 0.00 0.00 64.21 66.24 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 1.80 0.68 3.71 5.00 0.00 0.12 -4.90 105.19 111.60 3ic9 n GLY 410 Ca -0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.59 2.70 -2.17 1.61 2.13 -1.25 -0.80 120.64 120.28 3ic9 n GLU 411 Ca 0.00 0.98 -0.42 0.00 0.66 0.00 0.00 57.16 58.37 3ic9 n GLU 411 Cb 0.00 -2.82 -0.03 0.00 0.27 0.00 0.00 31.44 28.86 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 1.26 2.75 -0.24 4.31 5.36 -1.26 -0.43 117.98 129.73 3ic9 s PHE 412 Ca 0.76 0.72 -0.03 0.00 -0.96 0.00 0.00 56.93 57.42 3ic9 s PHE 412 Cb -0.52 -3.72 -0.14 0.00 -0.34 0.00 0.00 43.02 38.30 3ic9 s PHE 412 CO 0.33 -2.71 -0.24 1.28 -1.46 0.00 0.00 175.22 172.42 3ic9 n LEU 413 N 5.49 2.62 0.00 6.12 4.32 -0.17 -4.82 117.00 130.57 3ic9 n LEU 413 Ca 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.13 3ic9 n LEU 413 Cb 0.43 -0.80 0.00 0.00 -1.62 0.00 0.00 43.42 41.43 3ic9 n LEU 413 CO 0.59 0.79 0.00 0.61 -1.22 0.00 0.00 177.39 178.16 3ic9 n GLY 414 N 2.09 -1.67 3.45 -0.72 0.00 -1.22 -1.17 105.19 105.94 3ic9 n GLY 414 Ca -0.44 -1.10 -0.12 0.00 0.00 0.00 0.00 46.02 44.36 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 -1.89 -1.67 0.39 4.61 0.00 -0.54 -0.80 121.76 121.85 3ic9 s ALA 415 Ca 0.00 0.71 0.04 0.00 0.00 0.00 0.00 51.96 52.70 3ic9 s ALA 415 Cb 0.00 0.66 -0.04 0.00 0.00 0.00 0.00 23.12 23.74 3ic9 s ALA 415 CO 0.00 -0.69 0.09 -1.21 0.00 0.00 0.00 175.76 173.95 3ic9 s GLU 416 N -3.25 1.85 -0.30 0.00 2.02 -0.45 -1.46 118.70 117.11 3ic9 s GLU 416 Ca 0.00 -2.10 -0.11 0.00 0.02 0.00 0.00 54.97 52.79 3ic9 s GLU 416 Cb -0.01 -0.80 0.18 0.00 0.10 0.00 0.00 34.13 33.60 3ic9 s GLU 416 CO -0.09 -0.36 0.96 0.12 0.02 0.00 0.00 175.26 175.91 3ic9 s PHE 418 N -3.21 -0.75 -1.65 1.61 5.36 -0.35 -0.60 117.98 118.39 3ic9 s PHE 418 Ca 0.27 0.81 0.00 0.00 -0.96 0.00 0.00 56.93 57.05 3ic9 s PHE 418 Cb 0.05 0.27 0.00 0.00 -0.34 0.00 0.00 43.02 43.00 3ic9 s PHE 418 CO 0.14 -0.41 0.00 0.41 -1.46 0.00 0.00 175.22 173.90 3ic9 n GLY 419 N 5.46 -1.66 3.76 13.12 0.00 0.53 -0.84 105.19 125.56 3ic9 n GLY 419 Ca -0.06 -1.10 -0.39 0.00 0.00 0.00 0.00 46.02 44.47 3ic9 n GLY 419 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ic9 s PRO 420 N -1.88 4.68 -1.79 1.61 0.04 -1.26 -1.29 135.00 135.11 3ic9 s PRO 420 Ca 0.00 1.51 0.00 0.00 0.04 0.00 0.00 61.00 62.55 3ic9 s PRO 420 Cb 0.00 -3.07 0.00 0.00 0.04 0.00 0.00 34.50 31.47 3ic9 s PRO 420 CO 0.00 0.34 0.00 0.00 0.04 0.00 0.00 177.00 177.38 3ic9 n ALA 421 N 1.05 -0.26 -0.33 8.56 0.00 -1.26 -4.89 120.51 123.38 3ic9 n ALA 421 Ca -0.00 0.27 0.13 0.00 0.00 0.00 0.00 53.44 53.84 3ic9 n ALA 421 Cb 0.48 -1.79 0.32 0.00 0.00 0.00 0.00 19.45 18.46 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 0.00 1.60 -0.98 0.00 0.00 -1.86 0.56 119.26 118.58 3ic9 h ALA 422 Ca -0.35 0.10 0.17 0.00 0.00 0.00 0.00 54.91 54.84 3ic9 h ALA 422 Cb 1.13 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.81 3ic9 h ALA 422 CO 0.51 -0.15 0.61 1.05 0.00 0.00 0.00 179.25 181.27 3ic9 h GLU 423 N 0.64 0.74 0.15 0.00 4.11 -1.89 0.66 114.58 118.99 3ic9 h GLU 423 Ca 0.57 -0.04 -0.28 0.00 0.07 0.00 0.00 59.36 59.68 3ic9 h GLU 423 Cb 0.96 -0.17 0.01 0.00 0.50 0.00 0.00 28.75 30.06 3ic9 h GLU 423 CO -0.42 0.49 -1.34 0.45 0.07 0.00 0.00 179.01 178.25 3ic9 h HIS 424 N 0.76 0.57 -0.41 2.06 3.86 -1.34 -2.89 115.15 117.76 3ic9 h HIS 424 Ca 0.53 -0.42 -0.00 0.00 -1.16 0.00 0.00 60.37 59.32 3ic9 h HIS 424 Cb 0.83 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 29.26 3ic9 h HIS 424 CO -0.00 1.52 0.24 0.82 0.86 0.00 0.00 177.93 181.36 3ic9 h ILE 425 N -0.20 1.12 -0.66 2.45 1.08 -1.05 -2.35 117.51 117.90 3ic9 h ILE 425 Ca -0.27 -0.29 0.01 0.00 -0.39 0.00 0.00 64.86 63.92 3ic9 h ILE 425 Cb 1.84 0.56 -0.03 0.00 -3.07 0.00 0.00 36.82 36.11 3ic9 h ILE 425 CO 0.12 0.13 0.43 1.23 -0.69 0.00 0.00 178.15 179.38 3ic9 h GLY 426 N 0.62 0.93 0.95 5.37 0.00 0.38 -0.68 103.07 110.65 3ic9 h GLY 426 Ca 0.15 -0.34 0.01 0.00 0.00 0.00 0.00 47.33 47.15 3ic9 h GLY 426 CO -0.03 0.33 0.17 0.45 0.00 0.00 0.00 176.54 177.46 3ic9 h HIS 427 N 0.88 0.32 -0.28 5.60 3.86 -1.24 0.18 115.15 124.47 3ic9 h HIS 427 Ca 0.25 0.01 0.05 0.00 -1.16 0.00 0.00 60.37 59.52 3ic9 h HIS 427 Cb -0.08 -0.10 -0.05 0.00 1.06 0.00 0.00 27.41 28.23 3ic9 h HIS 427 CO -0.03 0.19 -0.05 1.25 0.86 0.00 0.00 177.93 180.15 3ic9 h LEU 428 N 0.35 -0.23 -0.97 2.43 5.85 -1.12 -0.30 115.31 121.33 3ic9 h LEU 428 Ca 0.11 0.08 -0.09 0.00 0.84 0.00 0.00 57.88 58.82 3ic9 h LEU 428 Cb -0.01 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 3ic9 h LEU 428 CO -0.04 -0.08 -0.20 -0.07 -0.34 0.00 0.00 178.44 177.71 3ic9 h LEU 429 N 0.02 0.52 -0.17 2.25 3.38 -1.01 -2.46 115.31 117.84 3ic9 h LEU 429 Ca 0.13 -0.16 -0.13 0.00 0.09 0.00 0.00 57.88 57.82 3ic9 h LEU 429 Cb 0.20 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.81 3ic9 h LEU 429 CO -0.27 0.72 -0.39 0.00 0.09 0.00 0.00 178.44 178.59 3ic9 h ALA 430 N 1.32 0.27 -0.83 1.53 0.00 -0.05 -1.15 119.26 120.35 3ic9 h ALA 430 Ca 0.08 -0.45 0.03 0.00 0.00 0.00 0.00 54.91 54.56 3ic9 h ALA 430 Cb 0.61 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.31 3ic9 h ALA 430 CO 0.04 0.37 0.55 -1.49 0.00 0.00 0.00 179.25 178.72 3ic9 h TRP 431 N 0.21 1.01 -0.36 0.00 4.06 -1.11 -1.18 115.95 118.58 3ic9 h TRP 431 Ca -0.00 0.02 -0.04 0.00 2.06 0.00 0.00 58.89 60.94 3ic9 h TRP 431 Cb 1.00 -0.34 -0.01 0.00 -1.00 0.00 0.00 29.16 28.81 3ic9 h TRP 431 CO 0.10 0.60 0.08 0.00 -3.56 0.00 0.00 178.44 175.66 3ic9 h ALA 432 N 1.50 0.47 -0.73 1.49 0.00 -1.15 -2.51 119.26 118.34 3ic9 h ALA 432 Ca 0.32 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3ic9 h ALA 432 Cb -0.01 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 3ic9 h ALA 432 CO -0.09 0.15 0.40 -0.09 0.00 0.00 0.00 179.25 179.61 3ic9 h ARG 433 N 0.43 1.02 -0.07 0.00 9.65 -0.99 -2.12 114.38 122.29 3ic9 h ARG 433 Ca 0.11 -0.12 -0.08 0.00 -1.10 0.00 0.00 59.98 58.79 3ic9 h ARG 433 Cb 0.31 -0.20 -0.01 0.00 -1.39 0.00 0.00 29.97 28.68 3ic9 h ARG 433 CO 0.00 0.76 -0.35 0.37 2.80 0.00 0.00 179.97 183.55 3ic9 h GLN 434 N 1.00 0.13 -0.00 0.20 4.15 -1.13 -0.70 115.11 118.77 3ic9 h GLN 434 Ca 0.26 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.62 3ic9 h GLN 434 Cb 0.04 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.72 3ic9 h GLN 434 CO -0.04 0.47 -0.07 1.04 -1.93 0.00 0.00 178.83 178.30 3ic9 n GLN 435 N -4.10 0.49 -2.04 1.69 6.02 -0.95 -5.01 117.38 113.48 3ic9 n GLN 435 Ca -0.01 -0.10 0.00 0.00 -0.01 0.00 0.00 57.00 56.88 3ic9 n GLN 435 Cb 0.41 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.17 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 -1.17 -4.44 -4.26 -1.09 6.02 -0.27 -5.07 117.38 107.10 3ic9 n GLN 436 Ca 0.13 3.28 -0.14 0.00 -0.01 0.00 0.00 57.00 60.26 3ic9 n GLN 436 Cb 0.27 -3.90 -0.10 0.00 1.02 0.00 0.00 30.24 27.53 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 -0.48 1.11 0.32 5.09 -4.23 -1.26 -4.84 115.64 111.35 3ic9 s THR 438 Ca 0.00 -2.05 0.03 0.00 -1.18 0.00 0.00 61.69 58.49 3ic9 s THR 438 Cb 0.00 -1.91 0.16 0.00 1.34 0.00 0.00 72.50 72.08 3ic9 s THR 438 CO 0.00 -0.69 1.86 -0.37 -0.54 0.00 0.00 174.62 174.88 3ic9 h VAL 439 N 2.75 1.21 -0.49 2.29 -1.51 -1.29 -2.62 116.25 116.59 3ic9 h VAL 439 Ca -0.37 -0.79 -0.02 0.00 -1.23 0.00 0.00 66.70 64.29 3ic9 h VAL 439 Cb 1.19 0.86 -0.02 0.00 -2.13 0.00 0.00 31.29 31.19 3ic9 h VAL 439 CO 0.64 0.28 0.23 0.06 -1.23 0.00 0.00 177.57 177.55 3ic9 h GLN 440 N 0.60 0.70 -1.49 5.19 -0.00 -1.92 -1.54 115.11 116.65 3ic9 h GLN 440 Ca 0.13 -0.10 0.00 0.00 -0.00 0.00 0.00 58.65 58.67 3ic9 h GLN 440 Cb 0.32 -0.13 0.00 0.00 -0.00 0.00 0.00 27.48 27.67 3ic9 h GLN 440 CO 0.01 0.59 0.00 0.00 -0.00 0.00 0.00 178.83 179.43 3ic9 n ALA 441 N -2.31 1.29 0.00 0.06 0.00 -0.99 -3.33 120.51 115.24 3ic9 n ALA 441 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 3ic9 n ALA 441 Cb 0.12 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 18.64 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 0.85 0.00 -1.97 0.00 4.77 -0.58 -5.01 117.00 115.06 3ic9 n LEU 443 Ca 0.00 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 3ic9 n LEU 443 Cb 0.00 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 40.98 3ic9 n LEU 443 CO 0.00 0.00 1.48 0.35 -1.33 0.00 0.00 177.39 177.89 3ic9 n THR 444 N 0.00 2.85 -3.54 -5.08 -2.24 -1.21 -4.84 114.28 100.22 3ic9 n THR 444 Ca 0.00 -1.53 -0.37 0.00 -2.27 0.00 0.00 64.05 59.88 3ic9 n THR 444 Cb 0.00 -1.82 -0.06 0.00 -2.10 0.00 0.00 70.33 66.34 3ic9 n THR 444 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 3ic9 s PRO 446 N 0.31 4.06 -0.26 -0.78 0.02 -1.26 -4.96 135.00 132.13 3ic9 s PRO 446 Ca 0.52 0.21 0.01 0.00 0.02 0.00 0.00 61.00 61.75 3ic9 s PRO 446 Cb 0.27 -3.34 0.07 0.00 0.02 0.00 0.00 34.50 31.52 3ic9 s PRO 446 CO -0.03 0.43 -0.01 -0.06 -0.33 0.00 0.00 177.00 177.00 3ic9 s PHE 447 N -0.17 2.44 1.31 6.54 0.08 -1.26 -5.11 117.98 121.82 3ic9 s PHE 447 Ca 0.20 -1.91 -0.21 0.00 0.12 0.00 0.00 56.93 55.12 3ic9 s PHE 447 Cb -0.14 -1.79 0.33 0.00 -0.57 0.00 0.00 43.02 40.85 3ic9 s PHE 447 CO 0.08 -0.81 1.03 -0.47 -0.10 0.00 0.00 175.22 174.94 3ic9 s TYR 448 N 1.37 -0.12 -0.08 0.36 5.04 -1.26 -5.03 117.35 117.64 3ic9 s TYR 448 Ca -0.00 0.50 -0.06 0.00 -2.44 0.00 0.00 57.07 55.07 3ic9 s TYR 448 Cb -0.19 -3.22 0.03 0.00 0.35 0.00 0.00 41.96 38.94 3ic9 s TYR 448 CO -0.10 -4.44 0.20 -1.58 -1.34 0.00 0.00 175.55 168.30 3ic9 s HIS 449 N -2.68 -0.24 -0.33 4.97 5.65 -1.26 -4.22 115.29 117.18 3ic9 s HIS 449 Ca 0.70 0.59 -0.13 0.00 0.25 0.00 0.00 55.06 56.47 3ic9 s HIS 449 Cb -0.11 0.04 -0.02 0.00 -1.18 0.00 0.00 32.58 31.31 3ic9 s HIS 449 CO 0.57 -0.15 0.27 -1.25 -0.65 0.00 0.00 174.74 173.53 3ic9 s PRO 450 N 0.58 3.58 0.13 2.88 0.04 -1.26 -5.18 135.00 135.77 3ic9 s PRO 450 Ca -0.04 -0.53 0.02 0.00 0.04 0.00 0.00 61.00 60.50 3ic9 s PRO 450 Cb -0.05 -3.79 -0.04 0.00 0.04 0.00 0.00 34.50 30.66 3ic9 s PRO 450 CO -0.03 -0.43 -0.06 0.14 0.04 0.00 0.00 177.00 176.66 3ic9 s VAL 451 N 1.81 0.82 0.40 -0.36 -7.23 -1.26 -4.77 120.40 109.81 3ic9 s VAL 451 Ca 0.08 -1.98 0.08 0.00 -1.81 0.00 0.00 61.98 58.35 3ic9 s VAL 451 Cb -0.17 -1.84 0.22 0.00 0.56 0.00 0.00 36.38 35.15 3ic9 s VAL 451 CO 0.11 -0.74 1.99 0.40 -0.31 0.00 0.00 175.10 176.55 3ic9 h ILE 452 N 2.84 1.13 -0.14 -0.62 2.04 -1.94 -2.23 117.51 118.59 3ic9 h ILE 452 Ca -0.36 -0.44 0.04 0.00 1.00 0.00 0.00 64.86 65.10 3ic9 h ILE 452 Cb 1.18 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 38.09 3ic9 h ILE 452 CO 0.64 0.16 0.42 -0.33 0.00 0.00 0.00 178.15 179.04 3ic9 h GLU 453 N 0.40 0.00 0.00 2.37 3.07 -1.96 0.59 114.58 119.05 3ic9 h GLU 453 Ca 0.10 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 58.88 3ic9 h GLU 453 Cb 0.14 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.04 3ic9 h GLU 453 CO -0.01 0.00 -0.37 0.93 -1.40 0.00 0.00 179.01 178.16 3ic9 h GLU 454 N 0.00 0.00 -0.92 2.33 5.08 -1.70 -0.31 114.58 119.06 3ic9 h GLU 454 Ca 0.07 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.47 3ic9 h GLU 454 Cb 0.90 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.10 3ic9 h GLU 454 CO -0.00 0.37 0.60 0.78 -1.00 0.00 0.00 179.01 179.77 3ic9 h GLY 455 N 1.31 1.33 1.00 -3.84 0.00 -1.07 -1.76 103.07 100.04 3ic9 h GLY 455 Ca -0.00 -0.45 -0.03 0.00 0.00 0.00 0.00 47.33 46.84 3ic9 h GLY 455 CO 0.05 0.38 0.25 -2.00 0.00 0.00 0.00 176.54 175.22 3ic9 h LEU 456 N 1.14 0.84 -0.58 3.11 5.85 -1.17 -2.04 115.31 122.46 3ic9 h LEU 456 Ca 0.37 -0.17 0.08 0.00 0.84 0.00 0.00 57.88 59.01 3ic9 h LEU 456 Cb 0.04 -0.22 -0.07 0.00 0.37 0.00 0.00 40.66 40.79 3ic9 h LEU 456 CO -0.12 0.78 0.23 -0.09 -0.34 0.00 0.00 178.44 178.90 3ic9 h ARG 457 N 0.86 0.41 -0.32 1.25 2.43 -0.81 -0.88 114.38 117.30 3ic9 h ARG 457 Ca 0.21 -0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.39 3ic9 h ARG 457 Cb 0.19 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.62 3ic9 h ARG 457 CO -0.02 0.27 0.12 1.15 -1.51 0.00 0.00 179.97 179.98 3ic9 h THR 458 N 0.42 0.92 -0.69 0.20 2.02 -0.97 -1.09 112.91 113.71 3ic9 h THR 458 Ca 0.29 -0.09 -0.05 0.00 0.77 0.00 0.00 66.41 67.33 3ic9 h THR 458 Cb 0.32 0.63 -0.03 0.00 -1.74 0.00 0.00 68.15 67.34 3ic9 h THR 458 CO -0.27 0.05 0.25 0.00 0.37 0.00 0.00 175.52 175.91 3ic9 h ALA 459 N 1.20 1.13 -0.52 6.16 0.00 -0.72 -1.96 119.26 124.56 3ic9 h ALA 459 Ca 0.14 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 3ic9 h ALA 459 Cb 0.11 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3ic9 h ALA 459 CO -0.14 0.61 -0.13 -0.07 0.00 0.00 0.00 179.25 179.52 3ic9 h LEU 460 N 1.01 1.02 -0.66 0.00 3.38 -0.89 -2.00 115.31 117.18 3ic9 h LEU 460 Ca 0.23 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 3ic9 h LEU 460 Cb 0.24 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 3ic9 h LEU 460 CO -0.01 1.14 0.40 0.03 0.09 0.00 0.00 178.44 180.09 3ic9 h ARG 461 N 0.88 0.89 -0.16 1.13 3.08 -1.04 0.09 114.38 119.24 3ic9 h ARG 461 Ca 0.13 -0.08 0.03 0.00 0.07 0.00 0.00 59.98 60.13 3ic9 h ARG 461 Cb 0.70 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.54 3ic9 h ARG 461 CO 0.05 0.63 -0.02 0.22 -1.07 0.00 0.00 179.97 179.78 3ic9 h ASP 462 N 0.89 -0.10 -0.19 7.04 3.58 -1.18 -1.76 116.42 124.70 3ic9 h ASP 462 Ca 0.24 0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.71 3ic9 h ASP 462 Cb -0.03 0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.09 3ic9 h ASP 462 CO -0.04 -0.03 0.06 0.00 -2.88 0.00 0.00 179.24 176.35 3ic9 h ALA 463 N 1.15 0.25 -0.70 -0.78 0.00 -1.20 -3.17 119.26 114.81 3ic9 h ALA 463 Ca 0.08 -0.13 0.10 0.00 0.00 0.00 0.00 54.91 54.96 3ic9 h ALA 463 Cb 0.11 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 17.75 3ic9 h ALA 463 CO -0.15 -0.14 0.32 0.37 0.00 0.00 0.00 179.25 179.66 3ic9 h GLN 464 N 0.13 0.52 0.00 0.00 4.15 -0.74 -1.16 115.11 118.01 3ic9 h GLN 464 Ca 0.06 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.45 3ic9 h GLN 464 Cb 0.22 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.80 3ic9 h GLN 464 CO -0.00 0.34 0.00 0.00 -1.93 0.00 0.00 178.83 177.24 3ic9 n GLN 465 N -4.91 0.17 0.00 1.69 -0.00 -0.68 -1.86 117.38 111.78 3ic9 n GLN 465 Ca 0.11 0.12 0.12 0.00 -0.00 0.00 0.00 57.00 57.35 3ic9 n GLN 465 Cb 0.30 -1.50 0.18 0.00 -0.00 0.00 0.00 30.24 29.22 3ic9 n GLN 465 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 3ic9 n LYS 466 N -1.37 0.44 -1.96 2.61 5.02 -0.44 -5.01 118.16 117.45 3ic9 n LYS 466 Ca 0.08 -0.30 -0.33 0.00 -2.02 0.00 0.00 58.31 55.73 3ic9 n LYS 466 Cb 0.19 -1.49 0.02 0.00 -0.02 0.00 0.00 35.03 33.73 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 -2.77 3.49 0.00 -0.35 1.43 -0.78 -4.94 118.68 114.77 3ic9 s LEU 467 Ca 0.16 1.95 0.26 0.00 -1.03 0.00 0.00 54.13 55.46 3ic9 s LEU 467 Cb 0.18 -4.55 1.43 0.00 0.03 0.00 0.00 46.19 43.28 3ic9 s LEU 467 CO 0.66 -1.37 1.89 0.00 0.23 0.00 0.00 176.35 177.76 3ic9 n ALA 468 N -2.08 2.38 -1.92 4.21 0.00 0.16 -4.88 120.51 118.38 3ic9 n ALA 468 Ca 0.10 -0.14 -0.31 0.00 0.00 0.00 0.00 53.44 53.08 3ic9 n ALA 468 Cb 0.52 -1.42 -0.02 0.00 0.00 0.00 0.00 19.45 18.53 3ic9 n ALA 468 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 3ic9 s ILE 469 N -2.29 4.63 0.41 0.00 2.07 -1.26 -4.99 121.20 119.77 3ic9 s ILE 469 Ca 0.32 0.99 -0.27 0.00 -1.41 0.00 0.00 60.65 60.28 3ic9 s ILE 469 Cb 0.18 -3.77 -0.10 0.00 0.13 0.00 0.00 42.46 38.90 3ic9 s ILE 469 CO 0.35 -0.78 1.46 -1.84 -1.91 0.00 0.00 174.94 172.22 3ic9 n GLU 470 N -1.85 2.49 -0.35 3.50 0.28 -1.26 -4.88 120.64 118.57 3ic9 n GLU 470 Ca 0.05 0.88 0.26 0.00 -0.16 0.00 0.00 57.16 58.20 3ic9 n GLU 470 Cb 0.54 -2.65 0.51 0.00 1.43 0.00 0.00 31.44 31.27 3ic9 n GLU 470 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 177.13 176.75 3ic9 h LYS 471 N 2.66 0.26 -0.34 3.44 3.64 -1.95 -1.95 116.57 122.34 3ic9 h LYS 471 Ca -0.51 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.86 3ic9 h LYS 471 Cb 1.25 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 3ic9 h LYS 471 CO 0.63 0.17 0.00 0.72 -2.27 0.00 0.00 179.45 178.70 3ic9 n HIS 472 N -4.97 0.45 -3.65 1.91 8.25 -1.26 -4.69 115.22 111.26 3ic9 n HIS 472 Ca 0.32 -0.22 -0.38 0.00 -0.26 0.00 0.00 57.72 57.18 3ic9 n HIS 472 Cb 1.07 -0.01 -0.08 0.00 1.12 0.00 0.00 29.99 32.08 3ic9 n HIS 472 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3ic9 s ASP 473 N -0.97 5.53 0.00 0.41 -1.08 -0.73 -5.16 116.67 114.66 3ic9 s ASP 473 Ca 0.21 -2.90 0.00 0.00 -0.52 0.00 0.00 52.55 49.35 3ic9 s ASP 473 Cb 0.11 -1.92 0.00 0.00 -1.46 0.00 0.00 42.92 39.66 3ic9 s ASP 473 CO 0.14 -0.39 0.00 0.59 0.52 0.00 0.00 175.17 176.03 3ic9 n ASN 475 N 3.48 0.00 0.07 -0.34 3.02 -1.26 -5.00 115.26 115.23 3ic9 n ASN 475 Ca 0.10 0.00 0.13 0.00 -0.03 0.00 0.00 54.58 54.77 3ic9 n ASN 475 Cb 0.39 0.00 0.31 0.00 -0.61 0.00 0.00 39.78 39.88 3ic9 n ASN 475 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3ic9 n GLU 476 N 2.36 0.24 -3.74 3.52 1.02 -1.26 -4.75 120.64 118.03 3ic9 n GLU 476 Ca 0.00 0.14 -0.20 0.00 -0.02 0.00 0.00 57.16 57.08 3ic9 n GLU 476 Cb 0.00 -1.72 -0.17 0.00 -0.02 0.00 0.00 31.44 29.53 3ic9 n GLU 476 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 3ic9 s PHE 477 N -3.12 0.23 0.67 -0.32 5.36 -1.26 -4.00 117.98 115.55 3ic9 s PHE 477 Ca 0.09 0.11 -0.04 0.00 -0.96 0.00 0.00 56.93 56.13 3ic9 s PHE 477 Cb 0.13 -0.52 0.14 0.00 -0.34 0.00 0.00 43.02 42.43 3ic9 s PHE 477 CO 0.65 -0.20 0.91 -0.89 -1.46 0.00 0.00 175.22 174.23 3ic9 n ILE 478 N 4.98 0.00 -3.56 3.12 -0.00 -1.26 -5.17 119.36 117.46 3ic9 n ILE 478 Ca -0.10 -1.19 -0.12 0.00 -0.00 0.00 0.00 62.75 61.34 3ic9 n ILE 478 Cb 0.50 -1.13 -0.05 0.00 -0.00 0.00 0.00 39.64 38.95 3ic9 n ILE 478 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.55 176.97 3ic9 s THR 480 N -2.78 0.00 -1.79 1.39 -4.23 -1.26 -5.25 115.64 101.72 3ic9 s THR 480 Ca 0.58 0.00 0.14 0.00 -1.18 0.00 0.00 61.69 61.23 3ic9 s THR 480 Cb -0.03 -1.00 0.11 0.00 1.34 0.00 0.00 72.50 72.93 3ic9 s THR 480 CO 0.39 0.00 0.95 1.41 -0.54 0.00 0.00 174.62 176.83