#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iou n ILE 2 N 0.00 0.00 0.00 -0.18 -5.35 -1.26 -4.67 119.36 107.90 3iou n ILE 2 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 3iou n ILE 2 Cb 0.00 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 37.90 3iou n ILE 2 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 3iou n GLU 3 N 0.00 0.00 0.00 6.28 -0.58 -1.26 -4.95 120.64 120.13 3iou n GLU 3 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 3iou n GLU 3 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 3iou n GLU 3 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 3iou n GLU 4 N 0.00 0.00 -0.25 3.49 -0.58 -1.26 -4.58 120.64 117.46 3iou n GLU 4 Ca 0.00 0.00 0.11 0.00 -0.42 0.00 0.00 57.16 56.85 3iou n GLU 4 Cb 0.00 0.00 0.27 0.00 -0.57 0.00 0.00 31.44 31.14 3iou n GLU 4 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3iou n GLY 5 N 0.00 1.73 3.26 0.62 0.00 -1.26 -4.61 105.19 104.92 3iou n GLY 5 Ca 0.00 -0.68 -0.14 0.00 0.00 0.00 0.00 46.02 45.20 3iou n GLY 5 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3iou s LYS 6 N -1.33 0.67 0.12 1.61 1.02 -1.26 -4.40 119.74 116.16 3iou s LYS 6 Ca 0.40 -0.08 -0.04 0.00 0.02 0.00 0.00 55.97 56.28 3iou s LYS 6 Cb 0.22 0.30 -0.05 0.00 -0.52 0.00 0.00 37.83 37.78 3iou s LYS 6 CO 0.30 -0.18 0.34 -0.51 -0.92 0.00 0.00 175.35 174.37 3iou s LEU 7 N -1.14 4.29 -0.18 3.17 1.43 -1.16 -4.48 118.68 120.61 3iou s LEU 7 Ca -0.12 0.51 -0.01 0.00 -1.03 0.00 0.00 54.13 53.49 3iou s LEU 7 Cb -0.05 -3.23 0.05 0.00 0.03 0.00 0.00 46.19 42.99 3iou s LEU 7 CO 0.04 0.08 -0.04 0.54 0.23 0.00 0.00 176.35 177.20 3iou s VAL 8 N -1.62 1.11 -0.02 -1.59 0.11 -1.26 -2.99 120.40 114.14 3iou s VAL 8 Ca 0.40 -0.72 -0.06 0.00 -2.93 0.00 0.00 61.98 58.67 3iou s VAL 8 Cb -0.12 -1.34 -0.05 0.00 -1.53 0.00 0.00 36.38 33.34 3iou s VAL 8 CO 0.25 0.05 0.24 -0.63 -3.33 0.00 0.00 175.10 171.68 3iou s ILE 9 N 1.62 5.35 -0.03 7.04 1.01 -0.59 0.62 121.20 136.22 3iou s ILE 9 Ca -0.01 0.14 0.06 0.00 0.00 0.00 0.00 60.65 60.84 3iou s ILE 9 Cb -0.16 -3.54 -0.02 0.00 0.01 0.00 0.00 42.46 38.75 3iou s ILE 9 CO -0.07 0.41 -0.19 0.26 0.00 0.00 0.00 174.94 175.34 3iou s TRP 10 N -1.25 2.54 -0.04 3.97 0.52 -1.15 -0.13 118.94 123.40 3iou s TRP 10 Ca 0.25 -0.28 -0.11 0.00 0.02 0.00 0.00 56.10 55.99 3iou s TRP 10 Cb -0.13 -1.56 0.02 0.00 -1.15 0.00 0.00 33.47 30.65 3iou s TRP 10 CO 0.14 0.11 0.25 -1.50 0.02 0.00 0.00 176.95 175.98 3iou s ILE 11 N -0.71 0.05 0.22 2.03 2.07 0.01 -2.53 121.20 122.33 3iou s ILE 11 Ca 0.11 -0.37 -0.31 0.00 -1.41 0.00 0.00 60.65 58.67 3iou s ILE 11 Cb -0.10 -0.49 -0.15 0.00 0.13 0.00 0.00 42.46 41.85 3iou s ILE 11 CO 0.01 -0.21 1.08 -3.20 -1.91 0.00 0.00 174.94 170.71 3iou n ASN 12 N 1.87 1.25 -0.48 4.50 2.85 -1.26 -4.00 115.26 119.99 3iou n ASN 12 Ca -0.19 1.16 0.00 0.00 -0.11 0.00 0.00 54.58 55.44 3iou n ASN 12 Cb 0.57 -1.24 0.00 0.00 1.24 0.00 0.00 39.78 40.35 3iou n ASN 12 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3iou n GLY 13 N 1.73 1.31 0.00 8.20 0.00 -1.26 -1.71 105.19 113.46 3iou n GLY 13 Ca 0.13 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.17 3iou n GLY 13 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3iou n ASP 14 N 0.00 2.84 -4.84 1.61 5.68 -1.26 -5.02 116.55 115.56 3iou n ASP 14 Ca 0.00 -0.19 -0.32 0.00 -0.50 0.00 0.00 54.79 53.78 3iou n ASP 14 Cb 0.23 1.12 -0.03 0.00 -1.14 0.00 0.00 41.12 41.30 3iou n ASP 14 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 3iou s LYS 15 N -1.98 3.89 -0.96 0.11 -0.14 -0.70 -4.89 119.74 115.07 3iou s LYS 15 Ca -0.01 1.00 -0.16 0.00 -1.36 0.00 0.00 55.97 55.44 3iou s LYS 15 Cb 0.03 -2.13 -0.10 0.00 -1.68 0.00 0.00 37.83 33.95 3iou s LYS 15 CO 0.16 -0.32 2.07 0.41 -0.76 0.00 0.00 175.35 176.91 3iou n GLY 16 N -1.45 3.10 0.17 -3.33 0.00 -1.26 -4.64 105.19 97.79 3iou n GLY 16 Ca 0.07 -1.25 0.03 0.00 0.00 0.00 0.00 46.02 44.87 3iou n GLY 16 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 3iou h TYR 17 N 7.08 0.00 -0.95 1.61 -0.00 -1.86 -3.02 116.97 119.83 3iou h TYR 17 Ca 0.49 0.00 0.10 0.00 0.00 0.00 0.00 58.73 59.32 3iou h TYR 17 Cb 0.53 0.00 -0.08 0.00 0.00 0.00 0.00 36.73 37.19 3iou h TYR 17 CO 1.47 0.45 0.58 -0.91 -0.00 0.00 0.00 178.16 179.75 3iou h ASN 18 N 0.00 0.87 -0.63 0.10 -0.26 -1.93 2.74 115.58 116.47 3iou h ASN 18 Ca -0.00 0.04 -0.09 0.00 -0.56 0.00 0.00 56.30 55.69 3iou h ASN 18 Cb 0.94 -0.14 -0.02 0.00 -1.06 0.00 0.00 38.32 38.04 3iou h ASN 18 CO 0.06 0.49 0.06 1.23 -1.06 0.00 0.00 177.43 178.21 3iou h GLY 19 N 0.97 1.16 0.77 2.83 0.00 -1.72 0.17 103.07 107.26 3iou h GLY 19 Ca 0.45 -0.80 -0.03 0.00 0.00 0.00 0.00 47.33 46.95 3iou h GLY 19 CO -0.24 0.74 -0.03 -2.00 0.00 0.00 0.00 176.54 175.01 3iou h LEU 20 N 1.00 0.30 -2.42 3.11 5.85 -0.79 -2.14 115.31 120.21 3iou h LEU 20 Ca 0.19 -0.35 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 3iou h LEU 20 Cb 0.48 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.43 3iou h LEU 20 CO 0.02 0.58 -0.03 0.00 -0.34 0.00 0.00 178.44 178.67 3iou h ALA 21 N 0.73 1.29 0.00 1.25 0.00 0.48 -0.53 119.26 122.47 3iou h ALA 21 Ca 0.04 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 3iou h ALA 21 Cb 0.44 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3iou h ALA 21 CO 0.01 0.04 -0.47 1.49 0.00 0.00 0.00 179.25 180.32 3iou h GLU 22 N 0.00 0.00 -0.22 0.00 4.22 -0.11 -2.35 114.58 116.12 3iou h GLU 22 Ca -0.00 0.00 -0.06 0.00 0.08 0.00 0.00 59.36 59.38 3iou h GLU 22 Cb 0.11 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 3iou h GLU 22 CO 0.00 0.47 -0.11 0.28 -2.18 0.00 0.00 179.01 177.47 3iou h VAL 23 N 0.00 1.31 -0.39 0.32 2.07 -0.51 -3.12 116.25 115.93 3iou h VAL 23 Ca -0.00 -1.19 0.04 0.00 0.82 0.00 0.00 66.70 66.36 3iou h VAL 23 Cb 1.10 1.61 -0.05 0.00 -1.52 0.00 0.00 31.29 32.43 3iou h VAL 23 CO 0.06 0.36 -0.23 0.61 0.02 0.00 0.00 177.57 178.39 3iou n GLY 24 N -0.01 -1.39 0.06 2.17 0.00 -0.73 0.98 105.19 106.28 3iou n GLY 24 Ca -0.05 0.54 -0.13 0.00 0.00 0.00 0.00 46.02 46.38 3iou n GLY 24 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3iou h LYS 25 N 0.00 0.03 0.00 1.61 -0.00 -1.63 0.14 116.57 116.72 3iou h LYS 25 Ca 0.06 -0.01 -0.01 0.00 -0.00 0.00 0.00 60.65 60.69 3iou h LYS 25 Cb 0.16 -0.00 -0.00 0.00 -0.00 0.00 0.00 32.23 32.39 3iou h LYS 25 CO -0.37 0.37 -0.06 0.87 -0.00 0.00 0.00 179.45 180.27 3iou h LYS 26 N -0.32 0.00 0.11 0.07 1.79 -1.01 0.67 116.57 117.87 3iou h LYS 26 Ca 0.00 0.00 -0.24 0.00 -2.18 0.00 0.00 60.65 58.23 3iou h LYS 26 Cb 0.36 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.01 3iou h LYS 26 CO 0.00 0.06 -1.20 0.35 -1.08 0.00 0.00 179.45 177.58 3iou h PHE 27 N 0.00 0.42 -0.12 -1.35 3.57 0.64 -3.32 116.94 116.78 3iou h PHE 27 Ca -0.00 -0.31 0.03 0.00 3.53 0.00 0.00 57.97 61.23 3iou h PHE 27 Cb 0.19 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 38.91 3iou h PHE 27 CO 0.00 1.47 0.10 1.49 -2.23 0.00 0.00 178.31 179.14 3iou h GLU 28 N -0.39 0.00 0.00 1.11 4.81 -0.00 -2.49 114.58 117.62 3iou h GLU 28 Ca -0.26 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 58.87 3iou h GLU 28 Cb 1.67 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 31.04 3iou h GLU 28 CO 0.06 0.00 -0.52 0.87 -0.73 0.00 0.00 179.01 178.69 3iou h LYS 29 N 0.00 0.00 0.00 1.92 6.56 0.22 -0.30 116.57 124.98 3iou h LYS 29 Ca 0.06 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.65 3iou h LYS 29 Cb 0.25 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.91 3iou h LYS 29 CO -0.00 0.52 -1.79 -3.47 -2.06 0.00 0.00 179.45 172.64 3iou n ASP 30 N -3.76 0.20 0.00 0.86 4.64 -0.97 -4.67 116.55 112.85 3iou n ASP 30 Ca -0.01 -0.19 0.00 0.00 -1.38 0.00 0.00 54.79 53.21 3iou n ASP 30 Cb 0.56 1.79 0.00 0.00 -1.04 0.00 0.00 41.12 42.42 3iou n ASP 30 CO 0.00 0.00 0.00 0.41 -0.82 0.00 0.00 177.20 176.79 3iou n THR 31 N -2.12 0.00 0.00 5.18 -1.04 -1.03 -5.04 114.28 110.23 3iou n THR 31 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 3iou n THR 31 Cb 0.52 -0.78 0.00 0.00 -1.82 0.00 0.00 70.33 68.26 3iou n THR 31 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3iou n GLY 32 N 2.62 1.46 3.59 3.41 0.00 -0.12 -5.04 105.19 111.10 3iou n GLY 32 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3iou n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3iou s ILE 33 N -2.40 3.94 0.27 -0.61 -1.09 -1.26 -4.96 121.20 115.10 3iou s ILE 33 Ca 0.00 0.88 -0.29 0.00 -2.23 0.00 0.00 60.65 59.01 3iou s ILE 33 Cb 0.00 -4.49 -0.09 0.00 -1.58 0.00 0.00 42.46 36.30 3iou s ILE 33 CO 0.00 -1.09 1.19 -1.59 -1.23 0.00 0.00 174.94 172.22 3iou s LYS 34 N 5.06 4.52 -0.13 2.79 -2.85 -1.26 -4.10 119.74 123.77 3iou s LYS 34 Ca 0.51 1.95 0.01 0.00 -1.00 0.00 0.00 55.97 57.44 3iou s LYS 34 Cb -0.10 -3.17 0.02 0.00 -2.06 0.00 0.00 37.83 32.52 3iou s LYS 34 CO 0.28 0.02 -0.15 0.08 0.10 0.00 0.00 175.35 175.67 3iou s VAL 35 N -0.85 1.58 -0.15 1.79 1.01 -1.26 -2.97 120.40 119.54 3iou s VAL 35 Ca 0.48 -0.67 -0.00 0.00 0.00 0.00 0.00 61.98 61.79 3iou s VAL 35 Cb -0.34 -1.45 -0.00 0.00 0.00 0.00 0.00 36.38 34.58 3iou s VAL 35 CO 0.43 0.46 -0.14 -0.89 0.00 0.00 0.00 175.10 174.96 3iou s THR 36 N 1.15 2.80 -0.21 3.92 2.01 -1.16 -4.84 115.64 119.32 3iou s THR 36 Ca -0.02 -0.73 -0.06 0.00 0.31 0.00 0.00 61.69 61.19 3iou s THR 36 Cb -0.14 -2.19 -0.03 0.00 0.01 0.00 0.00 72.50 70.15 3iou s THR 36 CO -0.05 0.51 0.02 -0.69 -0.69 0.00 0.00 174.62 173.72 3iou s VAL 37 N 0.76 4.16 0.03 3.82 1.01 -1.26 -1.55 120.40 127.38 3iou s VAL 37 Ca -0.06 -0.24 0.09 0.00 0.00 0.00 0.00 61.98 61.77 3iou s VAL 37 Cb -0.15 -2.89 -0.03 0.00 0.00 0.00 0.00 36.38 33.31 3iou s VAL 37 CO 0.01 0.42 -0.25 -1.61 0.00 0.00 0.00 175.10 173.66 3iou s GLU 38 N 1.00 1.90 -0.76 2.72 2.02 0.82 -4.98 118.70 121.42 3iou s GLU 38 Ca 0.02 -1.06 0.03 0.00 0.02 0.00 0.00 54.97 53.99 3iou s GLU 38 Cb -0.14 -2.02 0.21 0.00 0.10 0.00 0.00 34.13 32.29 3iou s GLU 38 CO 0.02 0.53 0.71 -2.39 0.02 0.00 0.00 175.26 174.14 3iou n HIS 39 N 1.90 3.56 -2.81 1.61 1.44 -1.26 -0.81 115.22 118.86 3iou n HIS 39 Ca -0.17 -4.12 -0.43 0.00 -2.01 0.00 0.00 57.72 51.00 3iou n HIS 39 Cb 0.52 -0.77 -0.04 0.00 0.12 0.00 0.00 29.99 29.81 3iou n HIS 39 CO 0.00 0.00 0.00 -2.14 -2.81 0.00 0.00 176.34 171.39 3iou s PRO 40 N -1.84 3.24 0.03 -1.40 0.02 -1.26 -4.75 135.00 129.04 3iou s PRO 40 Ca 0.30 -0.46 -0.14 0.00 0.02 0.00 0.00 61.00 60.73 3iou s PRO 40 Cb 0.01 -4.13 -0.07 0.00 0.02 0.00 0.00 34.50 30.33 3iou s PRO 40 CO -0.10 -1.69 0.32 -3.47 -0.33 0.00 0.00 177.00 171.74 3iou n ASP 41 N 7.78 -0.22 -1.49 2.53 -0.08 -1.26 -0.01 116.55 123.81 3iou n ASP 41 Ca -0.00 0.45 -0.18 0.00 -1.51 0.00 0.00 54.79 53.55 3iou n ASP 41 Cb 0.47 -0.36 -0.06 0.00 2.34 0.00 0.00 41.12 43.50 3iou n ASP 41 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 3iou n LYS 42 N 0.50 -1.28 -0.27 -0.67 4.76 -1.26 -4.84 118.16 115.10 3iou n LYS 42 Ca 0.07 1.08 0.05 0.00 -2.87 0.00 0.00 58.31 56.65 3iou n LYS 42 Cb 0.06 -5.38 0.19 0.00 -1.84 0.00 0.00 35.03 28.06 3iou n LYS 42 CO 0.00 0.00 0.00 1.37 -1.37 0.00 0.00 177.40 177.40 3iou h LEU 43 N 0.00 0.45 -2.57 -0.35 8.10 -0.84 1.24 115.31 121.35 3iou h LEU 43 Ca -0.38 0.09 -0.00 0.00 0.11 0.00 0.00 57.88 57.70 3iou h LEU 43 Cb 1.19 0.02 -0.00 0.00 -0.44 0.00 0.00 40.66 41.43 3iou h LEU 43 CO 0.53 0.21 -0.02 1.05 -4.11 0.00 0.00 178.44 176.10 3iou h GLU 44 N 0.58 0.00 0.04 0.17 9.09 -1.90 1.72 114.58 124.27 3iou h GLU 44 Ca 0.42 0.00 -0.36 0.00 0.05 0.00 0.00 59.36 59.47 3iou h GLU 44 Cb 0.57 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.63 3iou h GLU 44 CO -0.35 0.02 -2.02 -1.91 0.05 0.00 0.00 179.01 174.79 3iou n GLU 45 N -3.30 0.65 -0.18 1.06 4.07 0.65 -4.52 120.64 119.07 3iou n GLU 45 Ca -0.02 0.32 -0.08 0.00 -0.06 0.00 0.00 57.16 57.32 3iou n GLU 45 Cb 0.12 -1.63 0.01 0.00 -0.06 0.00 0.00 31.44 29.88 3iou n GLU 45 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 3iou h LYS 46 N -0.46 0.80 -0.44 5.31 1.57 0.24 -3.33 116.57 120.26 3iou h LYS 46 Ca -0.50 -0.17 0.07 0.00 -1.87 0.00 0.00 60.65 58.19 3iou h LYS 46 Cb 1.72 -0.12 -0.09 0.00 0.08 0.00 0.00 32.23 33.82 3iou h LYS 46 CO -0.14 0.73 -0.42 0.35 -0.57 0.00 0.00 179.45 179.40 3iou h PHE 47 N 0.71 -1.23 -0.60 -1.35 3.57 0.23 -0.89 116.94 117.39 3iou h PHE 47 Ca 0.17 0.07 0.11 0.00 3.53 0.00 0.00 57.97 61.85 3iou h PHE 47 Cb 0.26 0.60 -0.09 0.00 2.79 0.00 0.00 35.95 39.51 3iou h PHE 47 CO 0.01 -0.43 0.13 -1.35 -2.23 0.00 0.00 178.31 174.44 3iou h PRO 48 N -0.30 0.25 -0.84 6.41 0.11 -1.80 1.48 132.00 137.31 3iou h PRO 48 Ca 0.15 -0.02 0.20 0.00 0.11 0.00 0.00 66.00 66.44 3iou h PRO 48 Cb 0.58 -0.06 -0.15 0.00 0.11 0.00 0.00 31.00 31.48 3iou h PRO 48 CO -0.59 0.17 0.00 1.96 -0.21 0.00 0.00 178.00 179.32 3iou h GLN 49 N 0.26 0.08 0.11 1.05 7.50 -1.32 -0.99 115.11 121.80 3iou h GLN 49 Ca 0.31 -0.00 -0.34 0.00 0.50 0.00 0.00 58.65 59.12 3iou h GLN 49 Cb 0.46 -0.02 -0.02 0.00 0.05 0.00 0.00 27.48 27.96 3iou h GLN 49 CO -0.40 0.05 -1.82 -0.39 -1.50 0.00 0.00 178.83 174.77 3iou h VAL 50 N 0.08 0.72 -0.90 -0.54 -1.51 -0.70 -3.38 116.25 110.02 3iou h VAL 50 Ca 0.47 -2.33 0.15 0.00 -1.23 0.00 0.00 66.70 63.76 3iou h VAL 50 Cb 0.87 2.49 -0.07 0.00 -2.13 0.00 0.00 31.29 32.45 3iou h VAL 50 CO -0.76 0.79 0.58 0.00 -1.23 0.00 0.00 177.57 176.95 3iou h ALA 51 N -0.03 1.86 -0.39 5.19 0.00 0.22 -2.44 119.26 123.66 3iou h ALA 51 Ca -0.40 0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.39 3iou h ALA 51 Cb 1.90 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 19.50 3iou h ALA 51 CO 0.04 -0.11 0.17 0.00 0.00 0.00 0.00 179.25 179.36 3iou n ALA 52 N -2.43 3.63 -0.13 0.00 0.00 -0.39 -3.47 120.51 117.72 3iou n ALA 52 Ca 0.18 -1.19 0.00 0.00 0.00 0.00 0.00 53.44 52.43 3iou n ALA 52 Cb 0.49 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.80 3iou n ALA 52 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3iou n THR 53 N -0.02 0.00 0.00 0.00 -2.24 -0.95 -5.01 114.28 106.06 3iou n THR 53 Ca 0.22 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 3iou n THR 53 Cb 0.91 1.13 0.00 0.00 -2.10 0.00 0.00 70.33 70.27 3iou n THR 53 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3iou n GLY 54 N 0.30 1.20 0.00 3.38 0.00 -1.23 -5.09 105.19 103.75 3iou n GLY 54 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3iou n GLY 54 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3iou n ASP 55 N 0.00 0.04 -0.20 1.61 9.92 -1.04 -4.91 116.55 121.97 3iou n ASP 55 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 3iou n ASP 55 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 3iou n ASP 55 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3iou n GLY 56 N 0.00 -1.82 0.80 0.44 0.00 -1.23 -4.52 105.19 98.86 3iou n GLY 56 Ca 0.00 -1.33 -0.07 0.00 0.00 0.00 0.00 46.02 44.62 3iou n GLY 56 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3iou n PRO 57 N -0.41 -1.08 -0.10 1.61 -0.04 -1.26 -4.81 135.00 128.91 3iou n PRO 57 Ca 0.00 -0.41 -0.15 0.00 -0.04 0.00 0.00 63.50 62.90 3iou n PRO 57 Cb 0.00 -0.34 -0.14 0.00 -0.04 0.00 0.00 33.50 32.98 3iou n PRO 57 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 3iou n ASP 58 N -3.34 1.24 -4.07 3.54 -0.08 0.20 -4.68 116.55 109.36 3iou n ASP 58 Ca 0.03 -0.03 -0.14 0.00 -1.51 0.00 0.00 54.79 53.15 3iou n ASP 58 Cb 0.13 0.06 -0.12 0.00 2.34 0.00 0.00 41.12 43.54 3iou n ASP 58 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 3iou s ILE 59 N -2.52 0.62 -0.00 5.18 -5.25 -1.22 -1.36 121.20 116.64 3iou s ILE 59 Ca -0.23 -1.07 0.04 0.00 -0.99 0.00 0.00 60.65 58.39 3iou s ILE 59 Cb 0.08 -0.66 -0.01 0.00 2.95 0.00 0.00 42.46 44.82 3iou s ILE 59 CO 0.71 -0.33 -0.12 -0.51 -1.79 0.00 0.00 174.94 172.90 3iou s ILE 60 N -1.30 0.91 -0.23 8.37 1.10 0.49 -2.94 121.20 127.60 3iou s ILE 60 Ca -0.08 -0.54 -0.07 0.00 -0.51 0.00 0.00 60.65 59.45 3iou s ILE 60 Cb -0.10 -0.77 -0.03 0.00 0.15 0.00 0.00 42.46 41.71 3iou s ILE 60 CO 0.01 0.22 0.05 -0.36 -2.11 0.00 0.00 174.94 172.75 3iou s PHE 61 N -0.33 3.09 0.22 3.50 0.40 -1.05 0.29 117.98 124.09 3iou s PHE 61 Ca 0.04 -0.37 -0.23 0.00 -0.60 0.00 0.00 56.93 55.77 3iou s PHE 61 Cb -0.05 -2.18 0.05 0.00 0.51 0.00 0.00 43.02 41.36 3iou s PHE 61 CO -0.00 -0.26 0.88 -0.46 0.70 0.00 0.00 175.22 176.07 3iou s TRP 62 N 1.29 -0.11 0.30 0.36 -0.11 0.08 -4.47 118.94 116.30 3iou s TRP 62 Ca 0.05 -0.29 -0.29 0.00 1.22 0.00 0.00 56.10 56.78 3iou s TRP 62 Cb -0.15 0.69 -0.10 0.00 -1.50 0.00 0.00 33.47 32.41 3iou s TRP 62 CO 0.03 -1.03 1.30 0.00 -4.62 0.00 0.00 176.95 172.63 3iou s ALA 63 N -3.28 3.51 0.55 5.86 0.00 -1.26 0.27 121.76 127.40 3iou s ALA 63 Ca 0.13 1.22 0.27 0.00 0.00 0.00 0.00 51.96 53.58 3iou s ALA 63 Cb -0.03 -3.47 1.45 0.00 0.00 0.00 0.00 23.12 21.07 3iou s ALA 63 CO 0.05 -0.60 1.97 1.12 0.00 0.00 0.00 175.76 178.30 3iou h HIS 64 N 3.81 0.00 -0.78 0.00 2.07 -1.66 -1.82 115.15 116.77 3iou h HIS 64 Ca -0.48 0.00 0.04 0.00 -2.85 0.00 0.00 60.37 57.08 3iou h HIS 64 Cb 1.22 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 31.16 3iou h HIS 64 CO 0.57 0.00 0.51 0.38 -3.07 0.00 0.00 177.93 176.32 3iou h ASP 65 N 0.00 0.82 1.09 3.10 2.03 -1.87 -1.36 116.42 120.23 3iou h ASP 65 Ca 0.25 -0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.54 3iou h ASP 65 Cb 1.09 -0.19 0.00 0.00 -0.83 0.00 0.00 39.33 39.40 3iou h ASP 65 CO -0.00 0.56 -0.40 -1.14 -1.03 0.00 0.00 179.24 177.23 3iou n ARG 66 N -4.45 0.28 0.17 4.15 3.00 -0.69 -3.68 116.66 115.44 3iou n ARG 66 Ca 0.10 0.13 0.14 0.00 -0.00 0.00 0.00 57.85 58.22 3iou n ARG 66 Cb 0.12 -1.73 0.50 0.00 0.00 0.00 0.00 32.46 31.35 3iou n ARG 66 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.63 178.37 3iou h PHE 67 N 0.00 0.00 0.21 -0.14 -1.00 -1.24 -2.79 116.94 111.98 3iou h PHE 67 Ca 0.00 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.77 3iou h PHE 67 Cb 0.74 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.31 3iou h PHE 67 CO 0.00 0.00 -0.10 0.78 -1.61 0.00 0.00 178.31 177.38 3iou h GLY 68 N 2.81 -0.29 -0.75 -1.45 0.00 -1.62 -1.67 103.07 100.09 3iou h GLY 68 Ca 0.00 0.11 0.18 0.00 0.00 0.00 0.00 47.33 47.62 3iou h GLY 68 CO 0.00 -0.11 -0.18 -1.33 0.00 0.00 0.00 176.54 174.92 3iou h GLY 69 N -0.60 0.71 0.57 4.60 0.00 -1.68 -1.94 103.07 104.74 3iou h GLY 69 Ca -0.03 0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.56 3iou h GLY 69 CO 0.05 -0.35 -0.07 -0.97 0.00 0.00 0.00 176.54 175.20 3iou h TYR 70 N 0.01 -0.18 -0.60 5.60 0.05 -1.51 -2.49 116.97 117.85 3iou h TYR 70 Ca 0.44 -0.00 0.04 0.00 0.05 0.00 0.00 58.73 59.26 3iou h TYR 70 Cb 0.71 0.06 -0.05 0.00 1.01 0.00 0.00 36.73 38.46 3iou h TYR 70 CO -0.65 0.21 0.34 0.00 -1.05 0.00 0.00 178.16 177.01 3iou h ALA 71 N 0.13 0.78 -0.36 3.88 0.00 -0.94 -0.80 119.26 121.96 3iou h ALA 71 Ca -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3iou h ALA 71 Cb 0.47 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 3iou h ALA 71 CO 0.03 0.03 0.16 0.37 0.00 0.00 0.00 179.25 179.84 3iou h GLN 72 N 0.65 0.53 0.00 0.00 -0.00 -1.46 0.64 115.11 115.46 3iou h GLN 72 Ca 0.26 -0.09 0.00 0.00 -0.00 0.00 0.00 58.65 58.82 3iou h GLN 72 Cb 0.11 -0.09 0.00 0.00 0.00 0.00 0.00 27.48 27.50 3iou h GLN 72 CO -0.14 0.50 0.00 0.43 0.00 0.00 0.00 178.83 179.61 3iou n SER 73 N -4.70 0.00 -2.24 -0.69 7.64 -0.57 -4.79 113.62 108.28 3iou n SER 73 Ca -0.01 -0.21 -0.19 0.00 1.01 0.00 0.00 58.87 59.47 3iou n SER 73 Cb 0.13 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 3iou n SER 73 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3iou n GLY 74 N -0.54 -0.38 0.06 0.23 0.00 0.22 -4.90 105.19 99.88 3iou n GLY 74 Ca 0.02 -0.08 0.03 0.00 0.00 0.00 0.00 46.02 45.98 3iou n GLY 74 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3iou n LEU 75 N -2.87 0.26 -4.88 0.99 4.77 -0.41 -4.83 117.00 110.03 3iou n LEU 75 Ca -0.18 0.11 -0.30 0.00 -0.03 0.00 0.00 56.01 55.61 3iou n LEU 75 Cb 0.65 0.15 -0.05 0.00 -2.33 0.00 0.00 43.42 41.84 3iou n LEU 75 CO 0.30 0.15 -0.18 -0.76 -1.33 0.00 0.00 177.39 175.57 3iou s LEU 76 N -5.13 4.20 0.07 2.23 1.43 -1.26 -0.53 118.68 119.69 3iou s LEU 76 Ca -0.07 0.18 -0.14 0.00 -1.03 0.00 0.00 54.13 53.07 3iou s LEU 76 Cb 0.10 -2.82 -0.06 0.00 0.03 0.00 0.00 46.19 43.44 3iou s LEU 76 CO 0.86 0.16 0.47 0.00 0.23 0.00 0.00 176.35 178.07 3iou s ALA 77 N -1.50 3.65 -0.25 4.21 0.00 -0.77 -4.66 121.76 122.46 3iou s ALA 77 Ca 0.33 -0.19 -0.29 0.00 0.00 0.00 0.00 51.96 51.82 3iou s ALA 77 Cb -0.13 -2.44 -0.02 0.00 0.00 0.00 0.00 23.12 20.53 3iou s ALA 77 CO 0.26 0.48 1.60 -2.00 0.00 0.00 0.00 175.76 176.11 3iou s GLU 78 N -1.53 3.74 -0.13 0.00 2.12 -1.26 -4.69 118.70 116.96 3iou s GLU 78 Ca 0.31 1.57 -0.05 0.00 0.36 0.00 0.00 54.97 57.15 3iou s GLU 78 Cb -0.16 -4.04 -0.04 0.00 0.26 0.00 0.00 34.13 30.15 3iou s GLU 78 CO 0.17 -1.36 0.07 0.96 -0.54 0.00 0.00 175.26 174.56 3iou s ILE 79 N 5.34 4.88 -0.54 -3.70 -5.25 -1.20 -5.05 121.20 115.68 3iou s ILE 79 Ca 0.71 -0.02 0.00 0.00 -0.99 0.00 0.00 60.65 60.35 3iou s ILE 79 Cb -0.23 -3.13 0.14 0.00 2.95 0.00 0.00 42.46 42.19 3iou s ILE 79 CO 0.29 0.56 0.31 0.42 -1.79 0.00 0.00 174.94 174.74 3iou s THR 80 N -0.53 3.12 -0.24 8.37 -4.23 -1.26 -4.78 115.64 116.09 3iou s THR 80 Ca 0.11 -2.93 -0.29 0.00 -1.18 0.00 0.00 61.69 57.39 3iou s THR 80 Cb -0.12 -3.11 -0.02 0.00 1.34 0.00 0.00 72.50 70.59 3iou s THR 80 CO 0.02 -0.80 1.65 -2.84 -0.54 0.00 0.00 174.62 172.11 3iou s PRO 81 N 0.08 3.71 -0.32 3.99 0.02 -1.26 -4.94 135.00 136.28 3iou s PRO 81 Ca 0.15 1.61 -0.37 0.00 0.02 0.00 0.00 61.00 62.42 3iou s PRO 81 Cb -0.22 -4.06 -0.13 0.00 0.02 0.00 0.00 34.50 30.10 3iou s PRO 81 CO -0.03 -1.40 2.06 -0.40 -0.33 0.00 0.00 177.00 176.90 3iou n ASP 82 N 8.76 2.18 0.00 2.53 5.75 -1.26 -4.46 116.55 130.06 3iou n ASP 82 Ca 0.19 0.64 0.00 0.00 -0.01 0.00 0.00 54.79 55.61 3iou n ASP 82 Cb 0.45 -1.21 0.00 0.00 -1.03 0.00 0.00 41.12 39.33 3iou n ASP 82 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 3iou n LYS 83 N 7.36 0.00 -0.34 0.11 0.00 -1.26 -3.19 118.16 120.84 3iou n LYS 83 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.68 3iou n LYS 83 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.22 3iou n LYS 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3iou n ALA 84 N 0.00 0.00 0.11 3.14 0.00 -1.26 -4.95 120.51 117.55 3iou n ALA 84 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 3iou n ALA 84 Cb 0.00 -0.10 0.01 0.00 0.00 0.00 0.00 19.45 19.36 3iou n ALA 84 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 3iou h PHE 85 N 0.00 0.00 -0.38 0.00 3.57 -1.79 -3.32 116.94 115.02 3iou h PHE 85 Ca 0.00 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.57 3iou h PHE 85 Cb 0.00 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 3iou h PHE 85 CO 0.00 0.39 0.26 1.96 -2.23 0.00 0.00 178.31 178.69 3iou h GLN 86 N 0.00 0.22 0.00 1.11 4.20 -1.83 -1.03 115.11 117.77 3iou h GLN 86 Ca -0.05 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.65 3iou h GLN 86 Cb 1.34 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 29.07 3iou h GLN 86 CO 0.04 0.14 0.00 -0.25 -0.67 0.00 0.00 178.83 178.10 3iou n ASP 87 N -4.47 0.50 -1.84 1.46 9.92 -1.25 -2.28 116.55 118.58 3iou n ASP 87 Ca 0.05 0.65 -0.09 0.00 -0.53 0.00 0.00 54.79 54.87 3iou n ASP 87 Cb 0.29 -0.74 0.23 0.00 -0.64 0.00 0.00 41.12 40.25 3iou n ASP 87 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 3iou n LYS 88 N -2.08 2.95 -3.73 -1.24 3.00 -0.39 -4.87 118.16 111.80 3iou n LYS 88 Ca 0.01 -2.49 -0.11 0.00 -0.00 0.00 0.00 58.31 55.72 3iou n LYS 88 Cb 0.17 -2.03 -0.07 0.00 0.00 0.00 0.00 35.03 33.10 3iou n LYS 88 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 3iou s LEU 89 N -2.49 0.78 0.26 3.14 0.20 -0.97 -4.02 118.68 115.59 3iou s LEU 89 Ca 0.45 -0.20 -0.30 0.00 0.69 0.00 0.00 54.13 54.78 3iou s LEU 89 Cb 0.37 1.45 -0.10 0.00 -0.43 0.00 0.00 46.19 47.48 3iou s LEU 89 CO 0.11 -0.66 1.42 -0.31 -0.29 0.00 0.00 176.35 176.62 3iou s TYR 90 N -2.75 3.01 0.40 5.38 2.02 -0.14 -4.86 117.35 120.40 3iou s TYR 90 Ca -0.04 1.08 0.07 0.00 -0.37 0.00 0.00 57.07 57.81 3iou s TYR 90 Cb -0.00 -3.81 0.83 0.00 -0.40 0.00 0.00 41.96 38.58 3iou s TYR 90 CO -0.05 -2.57 2.04 -1.00 -1.57 0.00 0.00 175.55 172.41 3iou h PRO 91 N 4.78 0.54 0.00 -1.71 0.13 -1.91 -2.91 132.00 130.92 3iou h PRO 91 Ca -0.46 -0.04 -0.11 0.00 -0.87 0.00 0.00 66.00 64.52 3iou h PRO 91 Cb 1.22 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 32.22 3iou h PRO 91 CO 0.76 0.38 -0.52 0.27 -0.23 0.00 0.00 178.00 178.66 3iou h PHE 92 N 0.55 0.00 -0.07 1.56 -5.15 -1.99 -3.09 116.94 108.76 3iou h PHE 92 Ca 0.15 0.00 -0.05 0.00 -0.20 0.00 0.00 57.97 57.87 3iou h PHE 92 Cb -0.02 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.14 3iou h PHE 92 CO 0.00 0.52 -0.19 1.79 -2.00 0.00 0.00 178.31 178.43 3iou h THR 93 N 0.00 1.17 0.00 0.88 1.35 -1.90 -0.96 112.91 113.44 3iou h THR 93 Ca -0.01 -0.79 0.00 0.00 -0.55 0.00 0.00 66.41 65.07 3iou h THR 93 Cb 1.19 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 68.95 3iou h THR 93 CO 0.07 0.23 0.00 0.79 -0.25 0.00 0.00 175.52 176.36 3iou n TRP 94 N -4.27 0.00 -1.20 4.73 7.02 -1.17 -0.12 117.44 122.43 3iou n TRP 94 Ca -0.02 0.00 -0.11 0.00 -1.02 0.00 0.00 57.50 56.35 3iou n TRP 94 Cb 0.28 -0.33 0.23 0.00 -2.42 0.00 0.00 31.31 29.07 3iou n TRP 94 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 3iou n ASP 95 N -1.33 3.84 0.00 -0.99 8.00 -0.37 -3.85 116.55 121.85 3iou n ASP 95 Ca 0.05 -3.48 0.00 0.00 0.71 0.00 0.00 54.79 52.07 3iou n ASP 95 Cb 0.11 -0.74 0.00 0.00 -0.02 0.00 0.00 41.12 40.47 3iou n ASP 95 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3iou n ALA 96 N -0.78 0.81 -2.00 2.24 0.00 0.83 -4.80 120.51 116.82 3iou n ALA 96 Ca 0.45 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.61 3iou n ALA 96 Cb 1.39 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.87 3iou n ALA 96 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3iou n VAL 97 N -0.55 2.82 -4.04 0.00 0.24 -0.99 -4.82 118.33 110.99 3iou n VAL 97 Ca 0.00 -4.17 -0.13 0.00 -2.04 0.00 0.00 64.34 58.00 3iou n VAL 97 Cb 0.00 -1.19 -0.13 0.00 -1.47 0.00 0.00 33.84 31.05 3iou n VAL 97 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3iou s ARG 98 N -3.68 0.37 -0.09 7.34 3.52 -1.25 -0.01 118.95 125.14 3iou s ARG 98 Ca 0.53 -0.43 -0.04 0.00 -0.13 0.00 0.00 55.73 55.66 3iou s ARG 98 Cb 0.43 -0.20 0.05 0.00 -1.56 0.00 0.00 34.95 33.67 3iou s ARG 98 CO -0.08 0.04 0.18 -0.47 -0.81 0.00 0.00 175.30 174.16 3iou s TYR 99 N -0.79 -0.23 0.00 5.12 5.04 0.18 -4.87 117.35 121.80 3iou s TYR 99 Ca -0.06 0.68 0.00 0.00 -2.44 0.00 0.00 57.07 55.25 3iou s TYR 99 Cb -0.06 -0.18 0.00 0.00 0.35 0.00 0.00 41.96 42.07 3iou s TYR 99 CO -0.00 -0.27 0.00 0.27 -1.34 0.00 0.00 175.55 174.20 3iou n ASN 100 N 5.16 0.00 0.00 4.32 2.04 -0.69 0.18 115.26 126.27 3iou n ASN 100 Ca -0.08 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.06 3iou n ASN 100 Cb 0.50 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.75 3iou n ASN 100 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3iou n GLY 101 N -0.43 2.83 3.63 4.83 0.00 -1.26 -5.04 105.19 109.75 3iou n GLY 101 Ca 0.00 -0.71 -0.43 0.00 0.00 0.00 0.00 46.02 44.88 3iou n GLY 101 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3iou s LYS 102 N 0.00 3.71 -0.74 1.61 1.02 0.47 -4.93 119.74 120.89 3iou s LYS 102 Ca 0.00 1.88 -0.26 0.00 0.02 0.00 0.00 55.97 57.61 3iou s LYS 102 Cb 0.00 -4.12 -0.00 0.00 -0.52 0.00 0.00 37.83 33.18 3iou s LYS 102 CO 0.00 -1.41 1.64 -1.17 -0.92 0.00 0.00 175.35 173.49 3iou s LEU 103 N 5.71 3.25 0.00 3.17 1.98 -1.26 0.51 118.68 132.04 3iou s LEU 103 Ca 0.80 -0.26 0.22 0.00 -2.89 0.00 0.00 54.13 52.00 3iou s LEU 103 Cb -0.29 -2.55 0.52 0.00 0.66 0.00 0.00 46.19 44.53 3iou s LEU 103 CO 0.32 -2.16 1.45 2.30 -1.89 0.00 0.00 176.35 176.37 3iou n ILE 104 N 7.00 0.59 -3.85 6.68 -6.64 0.99 -3.25 119.36 120.88 3iou n ILE 104 Ca 0.19 -0.74 0.02 0.00 -1.77 0.00 0.00 62.75 60.45 3iou n ILE 104 Cb 0.50 0.73 0.01 0.00 -1.44 0.00 0.00 39.64 39.44 3iou n ILE 104 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3iou s ALA 105 N -1.41 -2.37 -0.33 -1.28 0.00 -1.25 -4.73 121.76 110.39 3iou s ALA 105 Ca 0.40 0.27 -0.09 0.00 0.00 0.00 0.00 51.96 52.54 3iou s ALA 105 Cb 0.22 0.69 0.01 0.00 0.00 0.00 0.00 23.12 24.04 3iou s ALA 105 CO 0.30 -1.11 0.15 0.71 0.00 0.00 0.00 175.76 175.81 3iou s TYR 106 N -2.16 3.19 -0.06 0.00 2.02 0.01 -4.85 117.35 115.50 3iou s TYR 106 Ca 0.24 -0.79 -0.30 0.00 -0.37 0.00 0.00 57.07 55.85 3iou s TYR 106 Cb 0.02 -2.36 -0.02 0.00 -0.40 0.00 0.00 41.96 39.19 3iou s TYR 106 CO -0.02 -0.54 1.05 -1.25 -1.57 0.00 0.00 175.55 173.22 3iou s PRO 107 N 1.57 4.44 -0.11 -1.71 0.04 -1.26 0.11 135.00 138.07 3iou s PRO 107 Ca 0.03 1.48 -0.12 0.00 0.04 0.00 0.00 61.00 62.43 3iou s PRO 107 Cb -0.18 -3.51 -0.05 0.00 0.04 0.00 0.00 34.50 30.80 3iou s PRO 107 CO 0.06 -0.28 -0.25 -0.89 0.04 0.00 0.00 177.00 175.68 3iou n ILE 108 N 4.38 1.38 -4.02 0.56 2.08 0.49 -4.67 119.36 119.57 3iou n ILE 108 Ca 0.09 0.16 -0.20 0.00 0.56 0.00 0.00 62.75 63.35 3iou n ILE 108 Cb 0.49 -2.08 -0.17 0.00 -0.75 0.00 0.00 39.64 37.13 3iou n ILE 108 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3iou s ALA 109 N -2.61 0.63 -0.26 -1.39 0.00 -0.93 0.28 121.76 117.48 3iou s ALA 109 Ca -0.21 -0.05 -0.18 0.00 0.00 0.00 0.00 51.96 51.52 3iou s ALA 109 Cb 0.04 -0.50 -0.03 0.00 0.00 0.00 0.00 23.12 22.63 3iou s ALA 109 CO 0.31 -0.15 0.53 0.08 0.00 0.00 0.00 175.76 176.53 3iou s VAL 110 N 1.22 5.06 0.44 0.00 1.01 -1.17 0.51 120.40 127.48 3iou s VAL 110 Ca -0.06 0.91 0.08 0.00 0.00 0.00 0.00 61.98 62.90 3iou s VAL 110 Cb -0.14 -3.85 0.02 0.00 0.00 0.00 0.00 36.38 32.42 3iou s VAL 110 CO -0.02 0.07 0.60 -0.70 0.00 0.00 0.00 175.10 175.06 3iou s GLU 111 N 2.34 2.76 0.00 2.72 2.12 -0.10 -2.15 118.70 126.39 3iou s GLU 111 Ca 0.22 -1.26 0.00 0.00 0.36 0.00 0.00 54.97 54.29 3iou s GLU 111 Cb -0.16 -2.74 0.00 0.00 0.26 0.00 0.00 34.13 31.50 3iou s GLU 111 CO 0.09 -0.35 0.00 0.00 -0.54 0.00 0.00 175.26 174.46 3iou n ALA 112 N -1.91 0.00 -1.49 6.30 0.00 -1.26 -3.52 120.51 118.63 3iou n ALA 112 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.19 3iou n ALA 112 Cb 0.59 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.10 3iou n ALA 112 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3iou s LEU 113 N 0.00 3.40 0.29 0.00 1.43 -1.26 -4.37 118.68 118.17 3iou s LEU 113 Ca 0.00 2.15 -0.08 0.00 -1.03 0.00 0.00 54.13 55.17 3iou s LEU 113 Cb 0.00 -4.57 -0.00 0.00 0.03 0.00 0.00 46.19 41.65 3iou s LEU 113 CO 0.00 -1.82 0.46 -0.44 0.23 0.00 0.00 176.35 174.79 3iou s SER 114 N -2.29 0.33 -0.31 2.29 0.01 -0.87 -4.80 113.70 108.07 3iou s SER 114 Ca 0.70 -1.20 -0.09 0.00 1.31 0.00 0.00 55.95 56.67 3iou s SER 114 Cb -0.24 0.61 -0.00 0.00 0.21 0.00 0.00 66.02 66.60 3iou s SER 114 CO 0.41 -1.21 0.13 -0.22 0.41 0.00 0.00 173.24 172.76 3iou s LEU 115 N -3.12 4.03 -0.20 2.44 1.98 0.19 -2.03 118.68 121.97 3iou s LEU 115 Ca 0.27 -0.58 -0.05 0.00 -2.89 0.00 0.00 54.13 50.88 3iou s LEU 115 Cb -0.00 -1.97 -0.02 0.00 0.66 0.00 0.00 46.19 44.86 3iou s LEU 115 CO 0.14 -0.19 -0.00 -0.63 -1.89 0.00 0.00 176.35 173.77 3iou s ILE 116 N 1.58 3.91 0.47 6.68 1.01 0.06 0.73 121.20 135.64 3iou s ILE 116 Ca 0.04 -0.33 0.06 0.00 0.00 0.00 0.00 60.65 60.42 3iou s ILE 116 Cb -0.17 -2.77 -0.02 0.00 0.01 0.00 0.00 42.46 39.52 3iou s ILE 116 CO 0.05 0.43 0.24 -0.72 0.00 0.00 0.00 174.94 174.94 3iou s TYR 117 N 1.05 2.20 -0.95 3.97 1.13 0.04 0.18 117.35 124.96 3iou s TYR 117 Ca 0.02 -0.71 -0.09 0.00 -1.41 0.00 0.00 57.07 54.87 3iou s TYR 117 Cb -0.14 -1.91 0.24 0.00 -1.10 0.00 0.00 41.96 39.04 3iou s TYR 117 CO 0.01 -0.04 0.90 1.21 -2.51 0.00 0.00 175.55 175.12 3iou s ASN 118 N -4.04 6.80 0.38 -0.18 3.84 0.56 -2.43 114.94 119.87 3iou s ASN 118 Ca 0.34 -3.28 0.22 0.00 0.21 0.00 0.00 52.86 50.36 3iou s ASN 118 Cb 0.01 -2.14 1.32 0.00 -0.55 0.00 0.00 41.25 39.89 3iou s ASN 118 CO 0.20 -0.37 1.61 0.11 -2.79 0.00 0.00 177.10 175.86 3iou h LYS 119 N 6.95 0.09 0.00 0.43 1.57 -1.31 1.29 116.57 125.58 3iou h LYS 119 Ca 0.14 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.89 3iou h LYS 119 Cb 0.92 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.21 3iou h LYS 119 CO 0.88 0.06 -0.10 -0.44 -0.57 0.00 0.00 179.45 179.28 3iou h ASP 120 N 0.10 0.00 0.00 0.86 3.32 -1.90 -3.30 116.42 115.49 3iou h ASP 120 Ca 0.82 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.87 3iou h ASP 120 Cb 2.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.78 3iou h ASP 120 CO -0.63 0.10 0.00 0.18 -1.72 0.00 0.00 179.24 177.17 3iou n LEU 121 N -3.32 0.12 -4.34 1.55 4.77 0.43 -4.88 117.00 111.33 3iou n LEU 121 Ca -0.01 0.01 -0.45 0.00 -0.03 0.00 0.00 56.01 55.54 3iou n LEU 121 Cb 0.30 -0.21 -0.05 0.00 -2.33 0.00 0.00 43.42 41.14 3iou n LEU 121 CO 0.29 -0.21 0.26 -0.22 -1.33 0.00 0.00 177.39 176.18 3iou s LEU 122 N -3.72 5.84 0.29 2.23 0.20 -0.56 -4.95 118.68 118.00 3iou s LEU 122 Ca 0.00 -1.63 0.03 0.00 0.69 0.00 0.00 54.13 53.22 3iou s LEU 122 Cb 0.00 -2.25 0.43 0.00 -0.43 0.00 0.00 46.19 43.94 3iou s LEU 122 CO 0.00 -0.97 1.73 1.55 -0.29 0.00 0.00 176.35 178.38 3iou h PRO 123 N 9.02 0.48 -3.69 0.98 0.13 -1.79 -3.38 132.00 133.75 3iou h PRO 123 Ca -0.30 -0.17 -0.53 0.00 -0.87 0.00 0.00 66.00 64.13 3iou h PRO 123 Cb 1.09 -0.03 -0.40 0.00 0.13 0.00 0.00 31.00 31.80 3iou h PRO 123 CO 1.06 0.68 -0.77 -0.80 -0.23 0.00 0.00 178.00 177.95 3iou s ASN 124 N -6.81 3.06 0.88 1.44 0.01 -1.26 -4.84 114.94 107.42 3iou s ASN 124 Ca -0.07 -0.87 -0.11 0.00 -0.71 0.00 0.00 52.86 51.10 3iou s ASN 124 Cb 0.14 -0.70 0.12 0.00 0.41 0.00 0.00 41.25 41.23 3iou s ASN 124 CO 0.79 -0.29 1.11 -2.16 -1.51 0.00 0.00 177.10 175.04 3iou s PRO 125 N 1.78 1.33 0.34 -0.60 0.04 -1.26 -5.00 135.00 131.63 3iou s PRO 125 Ca -0.02 1.30 -0.27 0.00 0.04 0.00 0.00 61.00 62.05 3iou s PRO 125 Cb -0.17 -1.78 -0.09 0.00 0.04 0.00 0.00 34.50 32.49 3iou s PRO 125 CO -0.08 -2.33 1.16 -1.25 0.04 0.00 0.00 177.00 174.54 3iou s PRO 126 N -4.75 4.34 0.00 0.56 0.04 -1.26 -4.93 135.00 128.99 3iou s PRO 126 Ca 0.65 1.86 0.18 0.00 0.04 0.00 0.00 61.00 63.73 3iou s PRO 126 Cb -0.20 -2.92 0.49 0.00 0.04 0.00 0.00 34.50 31.91 3iou s PRO 126 CO 0.58 -0.08 1.41 1.63 0.04 0.00 0.00 177.00 180.57 3iou n LYS 127 N 0.60 2.70 -3.91 4.56 5.02 -1.26 -4.60 118.16 121.27 3iou n LYS 127 Ca 0.02 -2.38 -0.09 0.00 -2.02 0.00 0.00 58.31 53.84 3iou n LYS 127 Cb 0.45 -1.45 -0.09 0.00 -0.02 0.00 0.00 35.03 33.93 3iou n LYS 127 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3iou s THR 128 N -1.04 0.14 0.00 -0.18 -1.32 -1.26 -1.79 115.64 110.19 3iou s THR 128 Ca 0.38 -1.19 0.00 0.00 -1.21 0.00 0.00 61.69 59.67 3iou s THR 128 Cb 0.20 -1.14 0.00 0.00 -1.51 0.00 0.00 72.50 70.06 3iou s THR 128 CO 0.26 -0.66 0.09 0.79 -2.21 0.00 0.00 174.62 172.90 3iou n TRP 129 N 0.38 0.00 0.00 9.09 7.02 -0.14 -4.28 117.44 129.51 3iou n TRP 129 Ca -0.17 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.31 3iou n TRP 129 Cb 0.60 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.49 3iou n TRP 129 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 3iou n GLU 130 N -0.23 0.00 -0.01 -0.99 4.71 -1.26 0.27 120.64 123.13 3iou n GLU 130 Ca 0.00 0.00 0.10 0.00 -0.01 0.00 0.00 57.16 57.25 3iou n GLU 130 Cb 0.00 0.00 0.57 0.00 -1.01 0.00 0.00 31.44 31.00 3iou n GLU 130 CO 0.00 0.00 0.00 -0.85 0.09 0.00 0.00 177.13 176.37 3iou n GLU 131 N 0.00 1.05 -0.06 3.49 0.28 -1.26 -3.64 120.64 120.50 3iou n GLU 131 Ca 0.00 -0.08 -0.13 0.00 -0.16 0.00 0.00 57.16 56.79 3iou n GLU 131 Cb 0.00 -1.31 -0.06 0.00 1.43 0.00 0.00 31.44 31.49 3iou n GLU 131 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 3iou h ILE 132 N 0.17 1.32 -0.11 3.84 2.04 0.35 -0.14 117.51 124.98 3iou h ILE 132 Ca 0.00 -1.20 0.02 0.00 1.00 0.00 0.00 64.86 64.68 3iou h ILE 132 Cb 0.04 1.73 -0.04 0.00 -0.74 0.00 0.00 36.82 37.81 3iou h ILE 132 CO 0.00 0.36 -0.33 -0.65 0.00 0.00 0.00 178.15 177.53 3iou h PRO 133 N 0.06 -0.33 -1.03 2.37 0.11 -1.79 0.53 132.00 131.92 3iou h PRO 133 Ca 0.04 0.02 0.40 0.00 0.11 0.00 0.00 66.00 66.57 3iou h PRO 133 Cb 0.61 0.07 -0.17 0.00 0.11 0.00 0.00 31.00 31.63 3iou h PRO 133 CO 0.03 -0.22 0.57 0.00 -0.21 0.00 0.00 178.00 178.17 3iou h ALA 134 N -0.71 2.18 0.01 -0.75 0.00 -1.73 -0.77 119.26 117.48 3iou h ALA 134 Ca 0.02 0.24 -0.14 0.00 0.00 0.00 0.00 54.91 55.04 3iou h ALA 134 Cb 0.41 0.29 0.01 0.00 0.00 0.00 0.00 17.79 18.50 3iou h ALA 134 CO -0.28 -0.92 -0.55 -0.07 0.00 0.00 0.00 179.25 177.42 3iou h LEU 135 N 0.07 0.47 -0.12 0.00 4.07 0.44 -2.13 115.31 118.11 3iou h LEU 135 Ca 0.83 -0.78 0.04 0.00 0.08 0.00 0.00 57.88 58.05 3iou h LEU 135 Cb 2.18 -0.15 -0.04 0.00 1.08 0.00 0.00 40.66 43.73 3iou h LEU 135 CO -0.72 1.19 -0.11 -0.78 -1.08 0.00 0.00 178.44 176.94 3iou h ASP 136 N -0.19 -0.35 -0.61 -0.43 3.58 0.15 -0.99 116.42 117.57 3iou h ASP 136 Ca -0.07 0.07 0.03 0.00 0.42 0.00 0.00 57.03 57.48 3iou h ASP 136 Cb 1.28 0.17 -0.03 0.00 1.72 0.00 0.00 39.33 42.47 3iou h ASP 136 CO 0.11 -0.15 0.41 0.11 -2.88 0.00 0.00 179.24 176.83 3iou h LYS 137 N -0.13 0.72 0.96 0.28 1.57 -1.51 0.50 116.57 118.96 3iou h LYS 137 Ca 0.08 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.77 3iou h LYS 137 Cb 0.25 -0.16 0.01 0.00 0.08 0.00 0.00 32.23 32.41 3iou h LYS 137 CO -0.20 0.48 -0.46 1.49 -0.57 0.00 0.00 179.45 180.19 3iou h GLU 138 N 0.75 -1.24 -0.04 3.15 4.81 -0.53 -3.24 114.58 118.24 3iou h GLU 138 Ca 0.24 0.08 -0.12 0.00 -0.13 0.00 0.00 59.36 59.44 3iou h GLU 138 Cb 0.04 0.28 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 3iou h GLU 138 CO -0.06 -0.82 -0.52 -0.07 -0.73 0.00 0.00 179.01 176.80 3iou h LEU 139 N -1.31 0.11 -1.73 1.64 -0.00 -1.11 -3.09 115.31 109.81 3iou h LEU 139 Ca -0.13 -0.05 0.45 0.00 -0.00 0.00 0.00 57.88 58.14 3iou h LEU 139 Cb 0.99 -0.03 -0.09 0.00 -0.00 0.00 0.00 40.66 41.52 3iou h LEU 139 CO 0.22 0.61 1.03 0.11 -0.00 0.00 0.00 178.44 180.40 3iou h LYS 140 N 0.08 0.06 0.00 1.13 1.79 -0.73 2.89 116.57 121.79 3iou h LYS 140 Ca -0.00 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3iou h LYS 140 Cb 0.95 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.58 3iou h LYS 140 CO 0.07 0.04 0.00 0.00 -1.08 0.00 0.00 179.45 178.48 3iou n ALA 141 N -2.71 2.09 -0.07 3.86 0.00 -1.17 -0.65 120.51 121.87 3iou n ALA 141 Ca 0.36 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.74 3iou n ALA 141 Cb 1.54 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 19.84 3iou n ALA 141 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3iou n LYS 142 N -0.78 0.45 -1.05 0.00 4.01 0.97 -5.01 118.16 116.74 3iou n LYS 142 Ca 0.07 -0.82 -0.00 0.00 -0.51 0.00 0.00 58.31 57.05 3iou n LYS 142 Cb 0.03 -0.97 -0.00 0.00 -0.51 0.00 0.00 35.03 33.59 3iou n LYS 142 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3iou n GLY 143 N -0.17 0.38 3.34 0.72 0.00 0.18 -5.05 105.19 104.60 3iou n GLY 143 Ca 0.00 -1.09 -0.27 0.00 0.00 0.00 0.00 46.02 44.66 3iou n GLY 143 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3iou s LYS 144 N -2.10 1.33 0.98 1.61 -0.14 -1.24 -5.00 119.74 115.19 3iou s LYS 144 Ca 0.00 -1.24 -0.16 0.00 -1.36 0.00 0.00 55.97 53.21 3iou s LYS 144 Cb 0.00 -1.70 0.20 0.00 -1.68 0.00 0.00 37.83 34.65 3iou s LYS 144 CO 0.00 0.41 1.29 -1.54 -0.76 0.00 0.00 175.35 174.75 3iou s SER 145 N -1.89 2.92 -0.15 2.83 1.04 -0.79 -2.83 113.70 114.84 3iou s SER 145 Ca 0.11 0.34 -0.10 0.00 0.48 0.00 0.00 55.95 56.77 3iou s SER 145 Cb -0.10 -0.43 -0.07 0.00 0.10 0.00 0.00 66.02 65.53 3iou s SER 145 CO 0.05 -2.86 -0.24 0.00 0.98 0.00 0.00 173.24 171.17 3iou n ALA 146 N -3.86 1.74 -2.45 5.32 0.00 -1.26 -2.89 120.51 117.10 3iou n ALA 146 Ca 0.15 -0.67 -0.27 0.00 0.00 0.00 0.00 53.44 52.65 3iou n ALA 146 Cb 0.59 0.21 -0.14 0.00 0.00 0.00 0.00 19.45 20.12 3iou n ALA 146 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3iou s LEU 147 N -7.21 2.24 -0.23 0.00 2.96 -1.25 0.76 118.68 115.95 3iou s LEU 147 Ca -0.23 -0.63 -0.12 0.00 -0.22 0.00 0.00 54.13 52.93 3iou s LEU 147 Cb 0.07 -1.06 0.07 0.00 0.50 0.00 0.00 46.19 45.78 3iou s LEU 147 CO 0.31 0.15 0.54 -0.32 -1.32 0.00 0.00 176.35 175.71 3iou s MET 148 N -1.59 0.53 0.17 1.98 1.75 -0.72 -4.91 119.30 116.51 3iou s MET 148 Ca 0.09 1.03 -0.19 0.00 -1.25 0.00 0.00 55.69 55.38 3iou s MET 148 Cb -0.10 0.13 0.04 0.00 2.84 0.00 0.00 34.83 37.75 3iou s MET 148 CO 0.03 -0.17 0.52 -0.59 -0.65 0.00 0.00 175.02 174.17 3iou s PHE 149 N 1.70 -0.27 -0.80 4.11 -0.71 -1.26 -4.21 117.98 116.53 3iou s PHE 149 Ca -0.09 -0.03 -0.23 0.00 -1.04 0.00 0.00 56.93 55.54 3iou s PHE 149 Cb -0.08 0.42 -0.18 0.00 -1.21 0.00 0.00 43.02 41.98 3iou s PHE 149 CO -0.16 -0.86 2.38 -1.71 -1.34 0.00 0.00 175.22 173.53 3iou n ASN 150 N -0.33 1.06 -0.04 1.98 2.85 -1.24 -4.57 115.26 114.97 3iou n ASN 150 Ca -0.13 -0.97 -0.05 0.00 -0.11 0.00 0.00 54.58 53.31 3iou n ASN 150 Cb 0.63 -1.34 0.15 0.00 1.24 0.00 0.00 39.78 40.46 3iou n ASN 150 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 3iou h LEU 151 N 18.68 0.64 0.00 1.20 -0.00 -0.85 -3.18 115.31 131.81 3iou h LEU 151 Ca -0.04 -0.22 0.00 0.00 -0.00 0.00 0.00 57.88 57.62 3iou h LEU 151 Cb 1.10 -0.18 0.00 0.00 -0.00 0.00 0.00 40.66 41.59 3iou h LEU 151 CO 1.20 0.86 0.00 0.00 -0.00 0.00 0.00 178.44 180.50 3iou n GLN 152 N -4.12 0.04 -4.06 1.13 1.13 -1.25 -4.52 117.38 105.73 3iou n GLN 152 Ca 0.00 0.30 -0.32 0.00 -1.94 0.00 0.00 57.00 55.05 3iou n GLN 152 Cb 0.41 -1.50 -0.16 0.00 0.11 0.00 0.00 30.24 29.10 3iou n GLN 152 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 3iou s GLU 153 N -2.86 2.50 0.14 -1.09 2.56 -1.20 -5.00 118.70 113.75 3iou s GLU 153 Ca 0.06 -0.82 -0.19 0.00 0.00 0.00 0.00 54.97 54.01 3iou s GLU 153 Cb 0.06 -2.45 0.02 0.00 2.00 0.00 0.00 34.13 33.76 3iou s GLU 153 CO 0.15 -0.31 1.69 -1.35 -0.56 0.00 0.00 175.26 174.88 3iou h PRO 154 N 7.96 -0.02 -0.95 4.30 0.11 -1.86 -0.32 132.00 141.22 3iou h PRO 154 Ca -0.37 0.00 0.36 0.00 0.11 0.00 0.00 66.00 66.11 3iou h PRO 154 Cb 1.12 0.00 -0.17 0.00 0.11 0.00 0.00 31.00 32.06 3iou h PRO 154 CO 0.55 -0.01 0.38 0.98 -0.21 0.00 0.00 178.00 179.69 3iou n TYR 155 N -5.25 0.97 0.06 0.65 9.36 -1.26 0.37 117.16 122.07 3iou n TYR 155 Ca -0.01 1.13 -0.13 0.00 3.32 0.00 0.00 57.90 62.21 3iou n TYR 155 Cb 0.17 -1.44 -0.13 0.00 -0.63 0.00 0.00 39.34 37.30 3iou n TYR 155 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 3iou h PHE 156 N 0.00 0.28 0.00 2.98 -1.00 -1.46 -3.36 116.94 114.38 3iou h PHE 156 Ca 0.74 -0.20 -0.12 0.00 2.81 0.00 0.00 57.97 61.20 3iou h PHE 156 Cb 1.88 -0.01 -0.02 0.00 3.61 0.00 0.00 35.95 41.41 3iou h PHE 156 CO -0.14 1.20 -1.39 0.25 -1.61 0.00 0.00 178.31 176.62 3iou n THR 157 N -3.39 0.98 -0.12 -1.55 -2.24 0.24 -4.43 114.28 103.76 3iou n THR 157 Ca -0.10 -0.65 -0.05 0.00 -2.27 0.00 0.00 64.05 60.99 3iou n THR 157 Cb 1.01 -0.58 0.02 0.00 -2.10 0.00 0.00 70.33 68.68 3iou n THR 157 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 175.07 174.25 3iou h TRP 158 N 0.00 -0.13 -0.59 4.78 2.91 0.66 0.06 115.95 123.64 3iou h TRP 158 Ca -0.13 0.03 0.13 0.00 1.13 0.00 0.00 58.89 60.05 3iou h TRP 158 Cb 1.43 0.12 -0.11 0.00 -0.51 0.00 0.00 29.16 30.09 3iou h TRP 158 CO 0.00 -0.13 -0.12 -2.30 -1.03 0.00 0.00 178.44 174.86 3iou n PRO 159 N -5.26 -0.05 0.06 2.65 -0.02 -1.24 -0.64 135.00 130.50 3iou n PRO 159 Ca 0.02 0.91 -0.03 0.00 -2.02 0.00 0.00 63.50 62.39 3iou n PRO 159 Cb 0.22 -1.38 -0.01 0.00 -0.02 0.00 0.00 33.50 32.30 3iou n PRO 159 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3iou h LEU 160 N 0.00 -0.15 -0.68 2.45 6.46 -1.27 -1.92 115.31 120.20 3iou h LEU 160 Ca 0.30 0.01 0.12 0.00 -0.12 0.00 0.00 57.88 58.19 3iou h LEU 160 Cb 0.49 0.04 -0.12 0.00 -0.73 0.00 0.00 40.66 40.34 3iou h LEU 160 CO -0.60 -0.02 -0.21 -0.38 -0.62 0.00 0.00 178.44 176.61 3iou n ILE 161 N -2.93 -0.31 -0.20 4.05 5.41 -0.95 0.02 119.36 124.45 3iou n ILE 161 Ca -0.02 1.56 -0.09 0.00 1.00 0.00 0.00 62.75 65.20 3iou n ILE 161 Cb 0.07 -2.12 0.02 0.00 -0.71 0.00 0.00 39.64 36.90 3iou n ILE 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3iou h ALA 162 N 1.18 0.78 -0.37 -1.39 0.00 -0.95 -3.35 119.26 115.16 3iou h ALA 162 Ca 0.29 -0.29 0.07 0.00 0.00 0.00 0.00 54.91 54.98 3iou h ALA 162 Cb 0.46 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 17.96 3iou h ALA 162 CO -0.69 0.58 -0.10 0.00 0.00 0.00 0.00 179.25 179.04 3iou n ALA 163 N -2.46 0.07 0.85 0.00 0.00 0.10 -0.09 120.51 118.98 3iou n ALA 163 Ca 0.02 0.40 0.13 0.00 0.00 0.00 0.00 53.44 54.00 3iou n ALA 163 Cb 0.32 -0.23 0.44 0.00 0.00 0.00 0.00 19.45 19.98 3iou n ALA 163 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3iou n ASP 164 N -4.59 0.38 0.00 0.00 2.03 -1.26 -4.70 116.55 108.41 3iou n ASP 164 Ca 0.06 0.34 0.00 0.00 0.52 0.00 0.00 54.79 55.70 3iou n ASP 164 Cb 0.18 -0.36 0.00 0.00 -0.72 0.00 0.00 41.12 40.22 3iou n ASP 164 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3iou n GLY 165 N 1.43 -0.12 3.72 0.27 0.00 0.87 -4.53 105.19 106.83 3iou n GLY 165 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 3iou n GLY 165 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3iou s GLY 166 N 0.00 1.71 0.04 -0.02 0.00 -0.47 -4.66 107.32 103.92 3iou s GLY 166 Ca 0.00 0.44 -0.27 0.00 0.00 0.00 0.00 44.72 44.89 3iou s GLY 166 CO 0.00 0.82 0.75 -2.52 0.00 0.00 0.00 173.10 172.15 3iou s TYR 167 N -2.75 -0.49 0.00 1.90 -0.85 -0.53 -4.75 117.35 109.89 3iou s TYR 167 Ca 0.64 0.48 0.00 0.00 -0.52 0.00 0.00 57.07 57.67 3iou s TYR 167 Cb -0.20 0.51 0.00 0.00 0.38 0.00 0.00 41.96 42.65 3iou s TYR 167 CO 0.56 -0.66 0.04 0.00 -1.52 0.00 0.00 175.55 173.97 3iou n ALA 168 N 0.03 0.00 -2.43 9.51 0.00 -1.26 -1.82 120.51 124.53 3iou n ALA 168 Ca -0.14 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.09 3iou n ALA 168 Cb 0.62 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.96 3iou n ALA 168 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3iou s PHE 169 N -0.07 1.80 -0.82 0.00 0.08 -1.26 -1.89 117.98 115.81 3iou s PHE 169 Ca 0.00 -0.49 -0.26 0.00 0.12 0.00 0.00 56.93 56.30 3iou s PHE 169 Cb 0.00 -0.87 0.02 0.00 -0.57 0.00 0.00 43.02 41.60 3iou s PHE 169 CO 0.00 0.35 1.49 0.15 -0.10 0.00 0.00 175.22 177.10 3iou s LYS 170 N -3.04 3.16 0.43 0.44 -0.14 -1.23 -4.84 119.74 114.52 3iou s LYS 170 Ca 0.18 -0.37 -0.21 0.00 -1.36 0.00 0.00 55.97 54.20 3iou s LYS 170 Cb -0.04 -4.65 -0.11 0.00 -1.68 0.00 0.00 37.83 31.35 3iou s LYS 170 CO 0.07 -2.38 0.96 -0.47 -0.76 0.00 0.00 175.35 172.77 3iou s TYR 171 N 6.46 3.31 0.00 3.18 6.14 -1.26 -1.71 117.35 133.47 3iou s TYR 171 Ca 0.47 1.62 0.00 0.00 0.64 0.00 0.00 57.07 59.79 3iou s TYR 171 Cb -0.06 -2.87 0.00 0.00 0.42 0.00 0.00 41.96 39.45 3iou s TYR 171 CO 0.07 -0.15 0.00 -1.91 0.64 0.00 0.00 175.55 174.20 3iou n GLU 172 N -0.59 0.00 0.00 4.97 2.13 -0.82 -5.00 120.64 121.33 3iou n GLU 172 Ca 0.07 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.89 3iou n GLU 172 Cb 0.54 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.25 3iou n GLU 172 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 3iou n ASN 173 N 0.00 0.00 -2.23 4.31 6.94 -1.26 -4.91 115.26 118.10 3iou n ASN 173 Ca 0.00 0.00 -0.21 0.00 -0.02 0.00 0.00 54.58 54.35 3iou n ASN 173 Cb 0.23 0.00 -0.02 0.00 -2.36 0.00 0.00 39.78 37.63 3iou n ASN 173 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3iou n GLY 174 N 0.00 -0.09 3.12 4.83 0.00 -1.26 -4.56 105.19 107.24 3iou n GLY 174 Ca 0.00 -0.02 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 3iou n GLY 174 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3iou s LYS 175 N -4.82 0.26 -0.07 1.61 2.47 -1.26 -1.70 119.74 116.23 3iou s LYS 175 Ca 0.00 0.63 0.03 0.00 -1.56 0.00 0.00 55.97 55.06 3iou s LYS 175 Cb 0.00 -0.08 -0.02 0.00 -1.46 0.00 0.00 37.83 36.26 3iou s LYS 175 CO 0.00 -0.17 -0.14 0.71 0.16 0.00 0.00 175.35 175.91 3iou s TYR 176 N 1.36 2.72 -0.90 4.03 2.02 -1.26 -1.95 117.35 123.37 3iou s TYR 176 Ca -0.09 -0.29 -0.24 0.00 -0.37 0.00 0.00 57.07 56.07 3iou s TYR 176 Cb -0.10 -1.68 0.02 0.00 -0.40 0.00 0.00 41.96 39.80 3iou s TYR 176 CO -0.10 0.08 1.56 0.34 -1.57 0.00 0.00 175.55 175.86 3iou s ASP 177 N -0.44 6.02 0.38 2.29 -1.08 -0.69 -4.84 116.67 118.31 3iou s ASP 177 Ca 0.05 -0.92 0.09 0.00 -0.52 0.00 0.00 52.55 51.25 3iou s ASP 177 Cb -0.12 -2.56 0.83 0.00 -1.46 0.00 0.00 42.92 39.61 3iou s ASP 177 CO 0.02 -1.93 1.94 0.16 0.52 0.00 0.00 175.17 175.89 3iou h ILE 178 N 6.76 0.95 -0.30 4.11 -0.00 -1.97 -1.47 117.51 125.58 3iou h ILE 178 Ca 0.04 -0.23 -0.10 0.00 -0.00 0.00 0.00 64.86 64.57 3iou h ILE 178 Cb 1.03 0.23 -0.01 0.00 -0.00 0.00 0.00 36.82 38.07 3iou h ILE 178 CO 1.33 0.12 -0.21 0.11 -0.00 0.00 0.00 178.15 179.51 3iou h LYS 179 N 0.66 0.67 -6.01 0.16 1.79 -2.01 -3.40 116.57 108.44 3iou h LYS 179 Ca 0.34 -0.32 -0.62 0.00 -2.18 0.00 0.00 60.65 57.86 3iou h LYS 179 Cb 0.44 -0.01 -0.09 0.00 -1.58 0.00 0.00 32.23 30.99 3iou h LYS 179 CO -0.12 0.92 1.75 0.34 -1.08 0.00 0.00 179.45 181.26 3iou s ASP 180 N -6.43 6.60 0.48 0.86 2.15 -0.55 -4.98 116.67 114.80 3iou s ASP 180 Ca -0.13 -1.81 -0.14 0.00 0.43 0.00 0.00 52.55 50.90 3iou s ASP 180 Cb 0.09 -2.57 -0.07 0.00 -0.30 0.00 0.00 42.92 40.06 3iou s ASP 180 CO 0.81 -1.41 0.92 -0.69 -0.17 0.00 0.00 175.17 174.63 3iou s VAL 181 N 4.79 4.62 -0.41 1.11 1.01 -1.26 -3.49 120.40 126.78 3iou s VAL 181 Ca 0.49 1.01 0.07 0.00 0.00 0.00 0.00 61.98 63.55 3iou s VAL 181 Cb 0.01 -3.73 0.43 0.00 0.00 0.00 0.00 36.38 33.09 3iou s VAL 181 CO -0.03 -0.65 1.11 0.61 0.00 0.00 0.00 175.10 176.14 3iou n GLY 182 N -1.52 5.65 0.00 4.51 0.00 -0.76 -4.60 105.19 108.47 3iou n GLY 182 Ca 0.05 -2.62 0.07 0.00 0.00 0.00 0.00 46.02 43.52 3iou n GLY 182 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3iou n VAL 183 N -0.48 0.00 -0.26 1.61 0.24 -1.25 -1.45 118.33 116.74 3iou n VAL 183 Ca 0.37 -0.21 -0.03 0.00 -2.04 0.00 0.00 64.34 62.43 3iou n VAL 183 Cb 0.71 0.79 0.09 0.00 -1.47 0.00 0.00 33.84 33.96 3iou n VAL 183 CO 0.00 0.00 0.00 -0.78 -2.14 0.00 0.00 176.83 173.91 3iou h ASP 184 N 0.00 0.74 -3.67 -1.34 3.58 -1.81 -3.40 116.42 110.52 3iou h ASP 184 Ca 0.00 0.00 -0.43 0.00 0.42 0.00 0.00 57.03 57.03 3iou h ASP 184 Cb 0.41 -0.16 0.18 0.00 1.72 0.00 0.00 39.33 41.48 3iou h ASP 184 CO 0.00 0.51 0.18 0.54 -2.88 0.00 0.00 179.24 177.59 3iou s ASN 185 N -5.75 1.61 0.39 2.28 6.03 -1.26 -4.71 114.94 113.53 3iou s ASN 185 Ca -0.13 0.72 0.20 0.00 -1.03 0.00 0.00 52.86 52.61 3iou s ASN 185 Cb 0.16 -1.04 0.73 0.00 -3.03 0.00 0.00 41.25 38.07 3iou s ASN 185 CO 0.77 -3.71 1.76 0.00 -2.03 0.00 0.00 177.10 173.89 3iou h ALA 186 N -2.30 1.01 0.74 3.54 0.00 -1.94 -1.68 119.26 118.64 3iou h ALA 186 Ca -0.47 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.09 3iou h ALA 186 Cb 1.30 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 19.04 3iou h ALA 186 CO 0.41 0.43 -0.36 0.78 0.00 0.00 0.00 179.25 180.51 3iou h GLY 187 N 2.02 -1.04 2.00 0.00 0.00 -1.85 -3.02 103.07 101.19 3iou h GLY 187 Ca -0.00 0.39 -0.05 0.00 0.00 0.00 0.00 47.33 47.67 3iou h GLY 187 CO 0.04 -0.38 -0.22 0.00 0.00 0.00 0.00 176.54 175.98 3iou h ALA 188 N -1.47 1.51 0.25 3.60 0.00 -1.68 -2.57 119.26 118.89 3iou h ALA 188 Ca -0.10 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3iou h ALA 188 Cb 0.77 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 3iou h ALA 188 CO 0.17 0.28 -0.52 -0.22 0.00 0.00 0.00 179.25 178.96 3iou h LYS 189 N 0.00 -0.81 0.00 0.00 1.63 -1.30 -2.50 116.57 113.59 3iou h LYS 189 Ca -0.00 0.05 -0.05 0.00 -0.85 0.00 0.00 60.65 59.80 3iou h LYS 189 Cb 0.43 0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 32.23 3iou h LYS 189 CO 0.03 -0.54 -0.24 0.00 -3.45 0.00 0.00 179.45 175.25 3iou h ALA 190 N -0.67 1.04 -2.16 5.00 0.00 -1.42 -2.88 119.26 118.17 3iou h ALA 190 Ca -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3iou h ALA 190 Cb 0.80 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3iou h ALA 190 CO -0.21 0.31 0.00 0.41 0.00 0.00 0.00 179.25 179.75 3iou n GLY 191 N 0.09 -2.98 0.37 0.00 0.00 -0.98 -3.08 105.19 98.62 3iou n GLY 191 Ca -0.00 0.16 0.12 0.00 0.00 0.00 0.00 46.02 46.30 3iou n GLY 191 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3iou h LEU 192 N 0.00 0.65 -1.00 0.99 5.85 -1.55 -0.64 115.31 119.61 3iou h LEU 192 Ca 0.00 0.04 0.32 0.00 0.84 0.00 0.00 57.88 59.08 3iou h LEU 192 Cb 0.00 -0.09 -0.15 0.00 0.37 0.00 0.00 40.66 40.80 3iou h LEU 192 CO 0.00 0.33 0.57 0.74 -0.34 0.00 0.00 178.44 179.73 3iou h THR 193 N 0.69 0.31 0.67 1.05 2.02 -1.56 0.44 112.91 116.53 3iou h THR 193 Ca 0.45 -0.12 -0.03 0.00 0.77 0.00 0.00 66.41 67.48 3iou h THR 193 Cb 0.73 -0.06 0.01 0.00 -1.74 0.00 0.00 68.15 67.09 3iou h THR 193 CO -0.21 0.06 -0.32 0.15 0.37 0.00 0.00 175.52 175.57 3iou h PHE 194 N 0.34 -0.83 -0.63 3.16 3.57 -1.04 -2.08 116.94 119.43 3iou h PHE 194 Ca 0.73 -0.02 0.13 0.00 3.53 0.00 0.00 57.97 62.34 3iou h PHE 194 Cb 1.65 0.27 -0.11 0.00 2.79 0.00 0.00 35.95 40.56 3iou h PHE 194 CO -0.01 -0.52 -0.00 1.25 -2.23 0.00 0.00 178.31 176.80 3iou h LEU 195 N -1.12 -0.29 0.02 0.59 5.85 -1.02 0.32 115.31 119.66 3iou h LEU 195 Ca -0.09 0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.81 3iou h LEU 195 Cb 0.69 0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.94 3iou h LEU 195 CO 0.15 -0.12 -0.47 0.58 -0.34 0.00 0.00 178.44 178.24 3iou h VAL 196 N 0.11 0.09 -1.00 1.05 2.07 -0.29 -2.02 116.25 116.26 3iou h VAL 196 Ca 0.33 0.00 0.21 0.00 0.82 0.00 0.00 66.70 68.06 3iou h VAL 196 Cb 0.54 0.09 -0.11 0.00 -1.52 0.00 0.00 31.29 30.29 3iou h VAL 196 CO -0.55 0.00 0.61 0.44 0.02 0.00 0.00 177.57 178.09 3iou h ASP 197 N -0.63 0.71 -0.98 0.57 3.32 -0.28 -0.74 116.42 118.40 3iou h ASP 197 Ca 0.03 0.11 0.14 0.00 0.02 0.00 0.00 57.03 57.33 3iou h ASP 197 Cb 0.69 -0.01 -0.09 0.00 0.22 0.00 0.00 39.33 40.14 3iou h ASP 197 CO -0.32 0.20 0.62 -0.07 -1.72 0.00 0.00 179.24 177.95 3iou h LEU 198 N 0.67 0.83 0.21 1.55 3.38 -0.29 0.26 115.31 121.91 3iou h LEU 198 Ca 0.60 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.61 3iou h LEU 198 Cb 1.06 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.70 3iou h LEU 198 CO -0.40 0.41 -0.10 0.40 0.09 0.00 0.00 178.44 178.84 3iou h ILE 199 N 0.87 0.86 0.00 1.22 5.03 -1.02 -2.12 117.51 122.35 3iou h ILE 199 Ca 0.50 -0.82 -0.01 0.00 -0.12 0.00 0.00 64.86 64.41 3iou h ILE 199 Cb 0.63 1.31 -0.00 0.00 -3.03 0.00 0.00 36.82 35.73 3iou h ILE 199 CO -0.27 0.17 -0.03 0.07 -0.68 0.00 0.00 178.15 177.41 3iou h LYS 200 N -0.72 0.00 -0.75 2.37 2.10 -1.41 -0.78 116.57 117.38 3iou h LYS 200 Ca -0.03 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.62 3iou h LYS 200 Cb 0.50 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.83 3iou h LYS 200 CO 0.05 0.03 0.00 0.09 -2.00 0.00 0.00 179.45 177.62 3iou n ASN 201 N -3.13 0.75 0.00 7.07 5.03 0.88 -4.87 115.26 120.99 3iou n ASN 201 Ca 0.01 -1.98 0.00 0.00 0.87 0.00 0.00 54.58 53.48 3iou n ASN 201 Cb 0.36 -0.38 0.00 0.00 -1.02 0.00 0.00 39.78 38.75 3iou n ASN 201 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3iou n LYS 202 N -0.12 0.00 -0.21 3.52 4.76 -0.30 -4.82 118.16 120.99 3iou n LYS 202 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 3iou n LYS 202 Cb 0.19 -3.52 0.11 0.00 -1.84 0.00 0.00 35.03 29.97 3iou n LYS 202 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 3iou h HIS 203 N 0.00 0.47 -3.88 2.13 3.86 -1.54 -3.45 115.15 112.74 3iou h HIS 203 Ca 0.00 0.03 -0.10 0.00 -1.16 0.00 0.00 60.37 59.14 3iou h HIS 203 Cb 0.00 -0.12 -0.12 0.00 1.06 0.00 0.00 27.41 28.24 3iou h HIS 203 CO 0.00 0.15 -0.29 0.00 0.86 0.00 0.00 177.93 178.65 3iou s MET 204 N -6.08 1.26 0.44 2.45 0.23 -1.11 -4.83 119.30 111.66 3iou s MET 204 Ca -0.13 -1.22 0.08 0.00 -1.03 0.00 0.00 55.69 53.39 3iou s MET 204 Cb 0.17 0.39 0.01 0.00 -1.53 0.00 0.00 34.83 33.88 3iou s MET 204 CO 0.75 -0.48 0.56 -0.80 -2.03 0.00 0.00 175.02 173.02 3iou s ASN 205 N -2.99 5.47 -0.16 -1.18 0.01 -1.26 -4.08 114.94 110.74 3iou s ASN 205 Ca 0.20 -0.54 -0.25 0.00 -0.71 0.00 0.00 52.86 51.56 3iou s ASN 205 Cb 0.03 -0.52 -0.23 0.00 0.41 0.00 0.00 41.25 40.93 3iou s ASN 205 CO 0.03 -0.81 0.53 0.00 -1.51 0.00 0.00 177.10 175.35 3iou h ALA 206 N 0.66 0.12 -0.24 0.60 0.00 -1.94 -3.39 119.26 115.07 3iou h ALA 206 Ca -0.39 -0.82 -0.62 0.00 0.00 0.00 0.00 54.91 53.08 3iou h ALA 206 Cb 1.28 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 19.38 3iou h ALA 206 CO 0.47 0.33 2.33 -3.47 0.00 0.00 0.00 179.25 178.92 3iou n ASP 207 N -4.50 3.48 -3.51 0.00 2.03 -1.26 -4.67 116.55 108.12 3iou n ASP 207 Ca -0.20 -2.78 -0.28 0.00 0.52 0.00 0.00 54.79 52.05 3iou n ASP 207 Cb 0.59 -1.51 -0.11 0.00 -0.72 0.00 0.00 41.12 39.37 3iou n ASP 207 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 3iou s THR 208 N 5.35 0.72 0.53 5.18 2.01 -1.26 -5.00 115.64 123.16 3iou s THR 208 Ca 0.55 -2.56 0.03 0.00 0.31 0.00 0.00 61.69 60.02 3iou s THR 208 Cb 0.10 -1.50 0.01 0.00 0.01 0.00 0.00 72.50 71.12 3iou s THR 208 CO 0.05 -1.10 0.18 1.51 -0.69 0.00 0.00 174.62 174.57 3iou s ASP 209 N 0.21 4.35 0.12 3.53 -4.77 -1.26 -0.13 116.67 118.72 3iou s ASP 209 Ca 0.26 -1.49 -0.24 0.00 -3.30 0.00 0.00 52.55 47.78 3iou s ASP 209 Cb -0.08 0.50 -0.05 0.00 -1.09 0.00 0.00 42.92 42.20 3iou s ASP 209 CO -0.11 -0.98 1.31 0.00 0.70 0.00 0.00 175.17 176.10 3iou n TYR 210 N -1.49 -0.34 0.17 2.11 9.36 -1.26 -1.28 117.16 124.43 3iou n TYR 210 Ca -0.12 0.98 -0.16 0.00 3.32 0.00 0.00 57.90 61.91 3iou n TYR 210 Cb 0.66 -0.56 -0.09 0.00 -0.63 0.00 0.00 39.34 38.72 3iou n TYR 210 CO 0.00 0.00 0.00 0.77 0.22 0.00 0.00 176.86 177.85 3iou h SER 211 N 0.00 -1.38 -0.46 2.98 0.02 -1.98 0.68 113.55 113.40 3iou h SER 211 Ca 0.12 0.14 0.05 0.00 -0.84 0.00 0.00 61.79 61.26 3iou h SER 211 Cb 0.32 0.50 -0.04 0.00 0.14 0.00 0.00 62.40 63.31 3iou h SER 211 CO -0.73 -0.56 0.20 0.40 -1.14 0.00 0.00 176.83 175.00 3iou h ILE 212 N -0.79 0.92 -0.12 3.27 2.04 -1.90 -1.83 117.51 119.09 3iou h ILE 212 Ca -0.01 -0.14 -0.16 0.00 1.00 0.00 0.00 64.86 65.55 3iou h ILE 212 Cb 0.76 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 3iou h ILE 212 CO -0.20 0.07 -0.61 0.00 0.00 0.00 0.00 178.15 177.41 3iou h ALA 213 N 1.27 0.73 -0.10 1.87 0.00 -0.54 0.24 119.26 122.73 3iou h ALA 213 Ca 0.21 -0.55 -0.06 0.00 0.00 0.00 0.00 54.91 54.51 3iou h ALA 213 Cb 0.16 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 3iou h ALA 213 CO -0.18 0.72 -0.17 1.49 0.00 0.00 0.00 179.25 181.12 3iou h GLU 214 N 0.30 0.29 -0.56 0.00 4.81 0.40 -1.56 114.58 118.26 3iou h GLU 214 Ca -0.01 -0.18 0.09 0.00 -0.13 0.00 0.00 59.36 59.13 3iou h GLU 214 Cb 1.15 0.02 -0.07 0.00 0.63 0.00 0.00 28.75 30.48 3iou h GLU 214 CO 0.11 0.76 0.18 0.00 -0.73 0.00 0.00 179.01 179.32 3iou h ALA 215 N 0.53 0.69 -0.41 2.92 0.00 -1.21 0.13 119.26 121.90 3iou h ALA 215 Ca 0.01 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3iou h ALA 215 Cb 0.74 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 3iou h ALA 215 CO 0.04 -0.24 -0.00 0.00 0.00 0.00 0.00 179.25 179.05 3iou h ALA 216 N 1.40 1.22 0.18 0.00 0.00 -0.46 -2.89 119.26 118.70 3iou h ALA 216 Ca 0.28 -0.24 -0.26 0.00 0.00 0.00 0.00 54.91 54.69 3iou h ALA 216 Cb 0.35 -0.17 0.02 0.00 0.00 0.00 0.00 17.79 17.99 3iou h ALA 216 CO -0.31 0.52 -1.19 0.35 0.00 0.00 0.00 179.25 178.62 3iou h PHE 217 N 0.63 0.69 0.00 0.00 3.57 -0.90 0.42 116.94 121.35 3iou h PHE 217 Ca 0.13 -0.50 0.00 0.00 3.53 0.00 0.00 57.97 61.13 3iou h PHE 217 Cb 0.40 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.12 3iou h PHE 217 CO 0.02 1.46 0.00 0.09 -2.23 0.00 0.00 178.31 177.65 3iou n ASN 218 N -3.92 0.00 -0.07 0.41 5.03 0.41 -1.05 115.26 116.06 3iou n ASN 218 Ca -0.17 0.45 0.08 0.00 0.87 0.00 0.00 54.58 55.81 3iou n ASN 218 Cb 0.95 -0.48 -0.08 0.00 -1.02 0.00 0.00 39.78 39.15 3iou n ASN 218 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.26 176.60 3iou n LYS 219 N -1.48 1.29 -1.98 3.52 4.81 -1.10 -4.83 118.16 118.40 3iou n LYS 219 Ca 0.04 -0.16 -0.04 0.00 -0.87 0.00 0.00 58.31 57.29 3iou n LYS 219 Cb 0.19 -1.33 0.02 0.00 0.02 0.00 0.00 35.03 33.93 3iou n LYS 219 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3iou n GLY 220 N 1.38 0.40 0.18 3.14 0.00 -0.22 -4.99 105.19 105.08 3iou n GLY 220 Ca 0.04 -0.12 0.04 0.00 0.00 0.00 0.00 46.02 45.98 3iou n GLY 220 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3iou n GLU 221 N -1.88 2.26 -3.95 1.61 1.02 0.15 -5.02 120.64 114.83 3iou n GLU 221 Ca -0.03 -0.53 -0.09 0.00 -0.02 0.00 0.00 57.16 56.50 3iou n GLU 221 Cb 0.53 -1.02 -0.09 0.00 -0.02 0.00 0.00 31.44 30.84 3iou n GLU 221 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 3iou s THR 222 N -1.19 0.16 -0.01 2.62 -1.32 -1.15 -1.88 115.64 112.86 3iou s THR 222 Ca 0.07 -1.30 -0.04 0.00 -1.21 0.00 0.00 61.69 59.20 3iou s THR 222 Cb 0.06 -1.18 -0.28 0.00 -1.51 0.00 0.00 72.50 69.60 3iou s THR 222 CO 0.20 -0.72 0.80 0.00 -2.21 0.00 0.00 174.62 172.70 3iou h ALA 223 N 3.28 0.27 -2.99 11.08 0.00 -1.29 -3.44 119.26 126.18 3iou h ALA 223 Ca -0.33 -1.14 -0.15 0.00 0.00 0.00 0.00 54.91 53.29 3iou h ALA 223 Cb 1.18 0.33 -0.24 0.00 0.00 0.00 0.00 17.79 19.06 3iou h ALA 223 CO 0.56 1.14 -0.39 0.00 0.00 0.00 0.00 179.25 180.55 3iou s MET 224 N -2.61 0.37 0.09 0.00 0.23 0.23 0.21 119.30 117.82 3iou s MET 224 Ca -0.11 0.25 0.01 0.00 -1.03 0.00 0.00 55.69 54.81 3iou s MET 224 Cb 0.07 0.17 -0.04 0.00 -1.53 0.00 0.00 34.83 33.50 3iou s MET 224 CO 0.85 -0.06 -0.04 -0.08 -2.03 0.00 0.00 175.02 173.66 3iou s THR 225 N -0.14 0.51 -0.36 3.16 -1.32 0.13 -1.76 115.64 115.86 3iou s THR 225 Ca -0.03 -1.89 -0.09 0.00 -1.21 0.00 0.00 61.69 58.47 3iou s THR 225 Cb -0.03 -1.67 0.03 0.00 -1.51 0.00 0.00 72.50 69.32 3iou s THR 225 CO 0.01 -0.88 0.17 -0.63 -2.21 0.00 0.00 174.62 171.08 3iou s ILE 226 N -3.75 4.29 0.11 5.08 1.01 -1.26 -0.76 121.20 125.92 3iou s ILE 226 Ca 0.11 -0.95 -0.12 0.00 0.00 0.00 0.00 60.65 59.70 3iou s ILE 226 Cb 0.06 -3.40 0.01 0.00 0.01 0.00 0.00 42.46 39.15 3iou s ILE 226 CO -0.06 -0.21 0.28 0.21 0.00 0.00 0.00 174.94 175.17 3iou s ASN 227 N 1.50 -0.02 0.54 3.58 3.84 -0.86 -4.75 114.94 118.77 3iou s ASN 227 Ca 0.01 -0.55 -0.00 0.00 0.21 0.00 0.00 52.86 52.53 3iou s ASN 227 Cb -0.19 0.40 0.01 0.00 -0.55 0.00 0.00 41.25 40.93 3iou s ASN 227 CO 0.05 -0.80 0.10 0.61 -2.79 0.00 0.00 177.10 174.27 3iou n GLY 228 N -0.14 0.32 0.27 1.21 0.00 -1.26 -2.04 105.19 103.55 3iou n GLY 228 Ca -0.15 -1.90 0.13 0.00 0.00 0.00 0.00 46.02 44.10 3iou n GLY 228 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3iou h PRO 229 N 0.00 0.00 -0.40 1.61 0.11 -1.98 -3.09 132.00 128.25 3iou h PRO 229 Ca -0.03 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.08 3iou h PRO 229 Cb 0.11 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.20 3iou h PRO 229 CO 0.03 0.07 0.24 0.11 -0.21 0.00 0.00 178.00 178.24 3iou h TRP 230 N 0.00 0.51 0.00 0.65 0.09 -1.96 -1.69 115.95 113.55 3iou h TRP 230 Ca -0.00 0.01 0.00 0.00 0.09 0.00 0.00 58.89 58.99 3iou h TRP 230 Cb 0.18 -0.17 0.00 0.00 0.08 0.00 0.00 29.16 29.25 3iou h TRP 230 CO 0.00 0.34 0.00 0.00 0.09 0.00 0.00 178.44 178.87 3iou h ALA 231 N 1.72 1.00 -0.97 0.11 0.00 -1.92 -3.35 119.26 115.85 3iou h ALA 231 Ca 0.14 0.00 0.18 0.00 0.00 0.00 0.00 54.91 55.23 3iou h ALA 231 Cb -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 17.66 3iou h ALA 231 CO -0.03 0.00 0.57 -1.49 0.00 0.00 0.00 179.25 178.31 3iou h TRP 232 N 0.00 1.01 -0.65 0.00 6.55 -1.47 -0.94 115.95 120.45 3iou h TRP 232 Ca 0.00 0.03 0.05 0.00 0.95 0.00 0.00 58.89 59.92 3iou h TRP 232 Cb 0.61 -0.30 -0.05 0.00 -0.86 0.00 0.00 29.16 28.56 3iou h TRP 232 CO 0.00 0.22 0.38 0.66 -1.05 0.00 0.00 178.44 178.65 3iou h SER 233 N 0.73 0.58 0.68 -3.49 4.64 -1.78 -2.96 113.55 111.95 3iou h SER 233 Ca 0.56 0.02 -0.12 0.00 -0.47 0.00 0.00 61.79 61.77 3iou h SER 233 Cb 0.85 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.82 3iou h SER 233 CO -0.38 0.39 -0.58 0.78 -0.87 0.00 0.00 176.83 176.17 3iou h ASN 234 N 0.71 0.00 0.99 4.97 2.35 -1.44 -2.49 115.58 120.67 3iou h ASN 234 Ca 0.28 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.86 3iou h ASN 234 Cb 0.12 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.46 3iou h ASN 234 CO -0.15 0.58 -1.07 0.40 -1.65 0.00 0.00 177.43 175.53 3iou h ILE 235 N 0.00 0.92 -0.57 2.81 2.04 -1.53 -2.11 117.51 119.06 3iou h ILE 235 Ca -0.01 -2.46 -0.04 0.00 1.00 0.00 0.00 64.86 63.36 3iou h ILE 235 Cb 1.07 2.38 -0.03 0.00 -0.74 0.00 0.00 36.82 39.51 3iou h ILE 235 CO 0.08 0.52 0.22 0.44 0.00 0.00 0.00 178.15 179.41 3iou h ASP 236 N 0.00 0.80 -0.32 1.72 3.32 -1.39 -3.07 116.42 117.48 3iou h ASP 236 Ca -0.10 -0.18 -0.16 0.00 0.02 0.00 0.00 57.03 56.62 3iou h ASP 236 Cb 1.62 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.95 3iou h ASP 236 CO 0.07 0.76 -0.40 0.74 -1.72 0.00 0.00 179.24 178.70 3iou h THR 237 N 0.79 1.28 -0.08 0.35 2.02 -1.43 -2.98 112.91 112.85 3iou h THR 237 Ca 0.19 -1.57 -0.04 0.00 0.77 0.00 0.00 66.41 65.76 3iou h THR 237 Cb 0.21 1.42 -0.02 0.00 -1.74 0.00 0.00 68.15 68.02 3iou h THR 237 CO -0.01 0.52 0.05 -1.54 0.37 0.00 0.00 175.52 174.90 3iou n SER 238 N -4.05 2.70 -2.01 4.18 3.41 -0.80 -4.91 113.62 112.14 3iou n SER 238 Ca -0.02 -2.14 -0.09 0.00 -0.26 0.00 0.00 58.87 56.36 3iou n SER 238 Cb 0.55 -0.53 0.01 0.00 -0.26 0.00 0.00 64.21 63.97 3iou n SER 238 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3iou n LYS 239 N 0.28 -0.45 -4.48 4.33 4.01 -1.13 -4.85 118.16 115.87 3iou n LYS 239 Ca 0.05 0.30 -0.29 0.00 -0.51 0.00 0.00 58.31 57.86 3iou n LYS 239 Cb 0.55 -0.51 -0.13 0.00 -0.51 0.00 0.00 35.03 34.42 3iou n LYS 239 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 3iou s VAL 240 N -0.96 2.26 -1.02 -0.18 1.01 -1.17 -5.07 120.40 115.27 3iou s VAL 240 Ca 0.07 -1.69 -0.19 0.00 0.00 0.00 0.00 61.98 60.17 3iou s VAL 240 Cb -0.01 -1.98 0.12 0.00 0.00 0.00 0.00 36.38 34.51 3iou s VAL 240 CO 0.22 0.14 1.27 0.21 0.00 0.00 0.00 175.10 176.94 3iou s ASN 241 N -1.92 6.70 0.38 3.32 2.47 -1.26 -4.86 114.94 119.77 3iou s ASN 241 Ca 0.14 -2.13 0.07 0.00 0.42 0.00 0.00 52.86 51.36 3iou s ASN 241 Cb -0.10 -2.44 -0.00 0.00 -1.45 0.00 0.00 41.25 37.26 3iou s ASN 241 CO 0.05 -1.09 0.50 -0.72 -3.72 0.00 0.00 177.10 172.13 3iou s TYR 242 N 2.98 2.93 -0.18 0.43 1.13 -1.26 -1.17 117.35 122.21 3iou s TYR 242 Ca 0.38 -0.33 -0.08 0.00 -1.41 0.00 0.00 57.07 55.63 3iou s TYR 242 Cb -0.03 -2.18 0.07 0.00 -1.10 0.00 0.00 41.96 38.72 3iou s TYR 242 CO -0.07 -0.21 0.40 0.20 -2.51 0.00 0.00 175.55 173.37 3iou s GLY 243 N -4.25 -0.32 -0.10 5.49 0.00 -1.02 -4.76 107.32 102.37 3iou s GLY 243 Ca 0.50 1.48 -0.17 0.00 0.00 0.00 0.00 44.72 46.53 3iou s GLY 243 CO 0.32 1.92 0.43 0.14 0.00 0.00 0.00 173.10 175.91 3iou s VAL 244 N 1.84 5.16 0.22 1.40 1.01 -1.26 -0.78 120.40 127.99 3iou s VAL 244 Ca -0.06 0.86 -0.07 0.00 0.00 0.00 0.00 61.98 62.71 3iou s VAL 244 Cb -0.10 -3.76 -0.02 0.00 0.00 0.00 0.00 36.38 32.50 3iou s VAL 244 CO -0.12 0.40 0.29 0.28 0.00 0.00 0.00 175.10 175.94 3iou s THR 245 N 0.18 0.00 0.61 3.92 -1.32 0.22 -4.38 115.64 114.88 3iou s THR 245 Ca 0.24 -1.71 -0.18 0.00 -1.21 0.00 0.00 61.69 58.83 3iou s THR 245 Cb -0.15 -2.34 -0.06 0.00 -1.51 0.00 0.00 72.50 68.44 3iou s THR 245 CO 0.10 -0.02 0.80 0.55 -2.21 0.00 0.00 174.62 173.85 3iou n VAL 246 N -0.32 3.20 -2.48 5.08 3.14 -1.26 -0.63 118.33 125.05 3iou n VAL 246 Ca -0.00 -0.49 -0.35 0.00 -2.96 0.00 0.00 64.34 60.54 3iou n VAL 246 Cb 0.64 -0.97 -0.03 0.00 -1.06 0.00 0.00 33.84 32.42 3iou n VAL 246 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 3iou s LEU 247 N -1.15 3.87 0.36 6.55 1.43 -1.26 -4.53 118.68 123.95 3iou s LEU 247 Ca 0.74 2.00 -0.28 0.00 -1.03 0.00 0.00 54.13 55.56 3iou s LEU 247 Cb -0.42 -4.51 -0.12 0.00 0.03 0.00 0.00 46.19 41.18 3iou s LEU 247 CO 0.49 -0.84 1.40 -2.65 0.23 0.00 0.00 176.35 174.99 3iou n PRO 248 N -0.91 2.43 -2.98 1.29 -0.02 -1.26 -4.63 135.00 128.91 3iou n PRO 248 Ca 0.09 0.85 -0.29 0.00 -2.02 0.00 0.00 63.50 62.13 3iou n PRO 248 Cb 0.52 -2.52 -0.03 0.00 -0.02 0.00 0.00 33.50 31.45 3iou n PRO 248 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3iou s THR 249 N -1.07 4.88 0.01 3.45 -4.23 -0.74 -4.12 115.64 113.81 3iou s THR 249 Ca 0.55 0.38 0.03 0.00 -1.18 0.00 0.00 61.69 61.47 3iou s THR 249 Cb -0.52 -3.75 -0.01 0.00 1.34 0.00 0.00 72.50 69.56 3iou s THR 249 CO 0.63 -0.50 -0.10 0.12 -0.54 0.00 0.00 174.62 174.23 3iou s PHE 250 N -2.33 0.88 -1.23 3.99 5.36 -0.85 -0.96 117.98 122.84 3iou s PHE 250 Ca 0.48 -0.23 0.00 0.00 -0.96 0.00 0.00 56.93 56.23 3iou s PHE 250 Cb -0.10 -0.55 0.00 0.00 -0.34 0.00 0.00 43.02 42.02 3iou s PHE 250 CO 0.33 -0.01 0.00 1.17 -1.46 0.00 0.00 175.22 175.24 3iou n LYS 251 N 2.53 -1.47 -0.57 10.12 4.81 -1.26 -1.34 118.16 130.98 3iou n LYS 251 Ca -0.15 0.68 0.00 0.00 -0.87 0.00 0.00 58.31 57.97 3iou n LYS 251 Cb 0.56 -4.99 0.00 0.00 0.02 0.00 0.00 35.03 30.63 3iou n LYS 251 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3iou n GLY 252 N -0.34 0.70 3.34 3.14 0.00 -1.26 -5.06 105.19 105.71 3iou n GLY 252 Ca -0.13 -0.13 -0.28 0.00 0.00 0.00 0.00 46.02 45.48 3iou n GLY 252 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3iou s GLN 253 N -0.58 1.51 0.55 1.61 -1.52 -0.45 -5.12 119.66 115.66 3iou s GLN 253 Ca 0.00 -1.18 -0.22 0.00 -1.95 0.00 0.00 55.36 52.01 3iou s GLN 253 Cb 0.00 -1.81 -0.05 0.00 -0.22 0.00 0.00 33.01 30.94 3iou s GLN 253 CO 0.00 0.45 1.37 -2.14 -0.25 0.00 0.00 175.29 174.72 3iou s PRO 254 N -1.62 3.12 0.21 2.91 0.02 -1.26 -2.01 135.00 136.38 3iou s PRO 254 Ca 0.11 2.27 -0.30 0.00 0.02 0.00 0.00 61.00 63.10 3iou s PRO 254 Cb -0.10 -2.26 -0.09 0.00 0.02 0.00 0.00 34.50 32.07 3iou s PRO 254 CO 0.04 -1.22 1.36 -1.12 -0.33 0.00 0.00 177.00 175.73 3iou s SER 255 N -0.91 6.81 -0.87 2.53 0.01 -1.26 -4.65 113.70 115.36 3iou s SER 255 Ca 0.72 2.48 -0.15 0.00 1.31 0.00 0.00 55.95 60.31 3iou s SER 255 Cb -0.41 -2.61 0.20 0.00 0.21 0.00 0.00 66.02 63.40 3iou s SER 255 CO 0.49 -0.59 0.89 -0.54 0.41 0.00 0.00 173.24 173.90 3iou s LYS 256 N -0.14 3.63 1.11 12.44 3.01 -1.10 -4.50 119.74 134.19 3iou s LYS 256 Ca 0.58 -2.28 -0.18 0.00 -1.01 0.00 0.00 55.97 53.07 3iou s LYS 256 Cb -0.38 -4.58 0.26 0.00 -1.01 0.00 0.00 37.83 32.11 3iou s LYS 256 CO 0.39 -1.43 1.21 -1.25 0.51 0.00 0.00 175.35 174.78 3iou s PRO 257 N 0.87 -0.54 -0.32 -1.68 0.04 -1.26 -3.62 135.00 128.49 3iou s PRO 257 Ca 0.23 -0.27 -0.12 0.00 0.04 0.00 0.00 61.00 60.88 3iou s PRO 257 Cb -0.08 -1.69 -0.03 0.00 0.04 0.00 0.00 34.50 32.73 3iou s PRO 257 CO -0.09 -3.22 0.23 -0.06 0.04 0.00 0.00 177.00 173.90 3iou s PHE 258 N -3.41 3.22 -0.29 0.56 0.08 -1.26 -1.91 117.98 114.97 3iou s PHE 258 Ca 0.73 -0.05 -0.23 0.00 0.12 0.00 0.00 56.93 57.50 3iou s PHE 258 Cb -0.06 -2.46 -0.00 0.00 -0.57 0.00 0.00 43.02 39.93 3iou s PHE 258 CO 0.55 -0.29 0.75 0.08 -0.10 0.00 0.00 175.22 176.21 3iou s VAL 259 N 1.77 4.84 -0.22 -0.44 1.01 -0.88 -4.47 120.40 122.01 3iou s VAL 259 Ca 0.07 1.16 -0.01 0.00 0.00 0.00 0.00 61.98 63.20 3iou s VAL 259 Cb -0.17 -4.09 0.02 0.00 0.00 0.00 0.00 36.38 32.14 3iou s VAL 259 CO 0.11 -0.18 -0.12 -0.83 0.00 0.00 0.00 175.10 174.08 3iou s GLY 260 N 1.58 1.53 -0.25 4.51 0.00 -1.23 -0.73 107.32 112.73 3iou s GLY 260 Ca 0.31 -1.34 -0.04 0.00 0.00 0.00 0.00 44.72 43.64 3iou s GLY 260 CO 0.11 0.42 -0.01 0.14 0.00 0.00 0.00 173.10 173.76 3iou s VAL 261 N 1.32 3.40 -0.10 1.40 1.01 -1.26 -0.92 120.40 125.24 3iou s VAL 261 Ca 0.02 -0.74 -0.29 0.00 0.00 0.00 0.00 61.98 60.97 3iou s VAL 261 Cb -0.15 -2.68 -0.06 0.00 0.00 0.00 0.00 36.38 33.49 3iou s VAL 261 CO -0.08 0.23 1.88 -0.22 0.00 0.00 0.00 175.10 176.92 3iou s LEU 262 N 1.43 4.06 0.21 3.92 2.96 0.18 -1.75 118.68 129.70 3iou s LEU 262 Ca 0.03 2.17 0.09 0.00 -0.22 0.00 0.00 54.13 56.19 3iou s LEU 262 Cb -0.16 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 42.96 3iou s LEU 262 CO -0.02 -1.29 -0.03 -0.44 -1.32 0.00 0.00 176.35 173.26 3iou s SER 263 N 5.06 4.54 -0.19 3.68 0.01 0.14 0.19 113.70 127.13 3iou s SER 263 Ca 0.84 -0.54 0.01 0.00 1.31 0.00 0.00 55.95 57.57 3iou s SER 263 Cb -0.35 -0.87 0.04 0.00 0.21 0.00 0.00 66.02 65.06 3iou s SER 263 CO 0.35 0.06 -0.12 0.00 0.41 0.00 0.00 173.24 173.94 3iou s ALA 264 N -1.95 2.02 0.53 1.44 0.00 0.30 -0.74 121.76 123.36 3iou s ALA 264 Ca 0.28 -1.17 0.07 0.00 0.00 0.00 0.00 51.96 51.14 3iou s ALA 264 Cb -0.08 -1.24 0.04 0.00 0.00 0.00 0.00 23.12 21.84 3iou s ALA 264 CO 0.18 -0.72 0.50 0.20 0.00 0.00 0.00 175.76 175.92 3iou s GLY 265 N 1.39 2.18 -0.11 0.00 0.00 0.14 -0.81 107.32 110.11 3iou s GLY 265 Ca -0.00 -1.58 0.00 0.00 0.00 0.00 0.00 44.72 43.15 3iou s GLY 265 CO -0.09 -1.84 -0.10 -0.42 0.00 0.00 0.00 173.10 170.65 3iou s ILE 266 N -2.70 1.15 -0.31 0.90 1.01 -1.26 -0.38 121.20 119.60 3iou s ILE 266 Ca 0.43 -0.39 -0.40 0.00 0.00 0.00 0.00 60.65 60.29 3iou s ILE 266 Cb -0.03 -1.12 -0.16 0.00 0.01 0.00 0.00 42.46 41.16 3iou s ILE 266 CO 0.27 0.38 1.81 -3.20 0.00 0.00 0.00 174.94 174.20 3iou n ASN 267 N 4.66 2.23 0.13 3.58 2.85 -0.47 -1.84 115.26 126.41 3iou n ASN 267 Ca -0.16 0.99 0.12 0.00 -0.11 0.00 0.00 54.58 55.42 3iou n ASN 267 Cb 0.50 -1.13 0.50 0.00 1.24 0.00 0.00 39.78 40.89 3iou n ASN 267 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3iou n ALA 268 N 5.94 1.59 0.10 5.20 0.00 0.31 -2.29 120.51 131.36 3iou n ALA 268 Ca 0.30 0.10 0.11 0.00 0.00 0.00 0.00 53.44 53.94 3iou n ALA 268 Cb 0.12 -1.38 -0.00 0.00 0.00 0.00 0.00 19.45 18.19 3iou n ALA 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3iou h ALA 269 N 2.24 0.52 -2.80 0.00 0.00 -1.88 -3.48 119.26 113.87 3iou h ALA 269 Ca 0.00 -0.06 -0.53 0.00 0.00 0.00 0.00 54.91 54.32 3iou h ALA 269 Cb 0.33 0.02 0.07 0.00 0.00 0.00 0.00 17.79 18.21 3iou h ALA 269 CO 0.00 0.07 0.79 -1.54 0.00 0.00 0.00 179.25 178.57 3iou s SER 270 N -5.41 6.54 0.27 0.00 1.04 -0.97 -4.94 113.70 110.24 3iou s SER 270 Ca -0.01 2.80 -0.02 0.00 0.48 0.00 0.00 55.95 59.21 3iou s SER 270 Cb 0.09 -2.63 0.38 0.00 0.10 0.00 0.00 66.02 63.96 3iou s SER 270 CO 0.79 -0.78 1.83 -0.65 0.98 0.00 0.00 173.24 175.41 3iou h PRO 271 N 4.63 0.87 -3.40 4.02 0.11 -1.90 -3.38 132.00 132.96 3iou h PRO 271 Ca -0.47 -0.17 -0.68 0.00 0.11 0.00 0.00 66.00 64.79 3iou h PRO 271 Cb 1.22 -0.14 -0.37 0.00 0.11 0.00 0.00 31.00 31.82 3iou h PRO 271 CO 0.76 0.77 -0.37 0.54 -0.21 0.00 0.00 178.00 179.48 3iou s ASN 272 N -6.55 5.19 -0.07 -2.05 6.03 -1.26 -4.85 114.94 111.38 3iou s ASN 272 Ca -0.10 -3.24 0.01 0.00 -1.03 0.00 0.00 52.86 48.50 3iou s ASN 272 Cb 0.16 -1.80 -0.25 0.00 -3.03 0.00 0.00 41.25 36.32 3iou s ASN 272 CO 0.80 -0.26 0.55 0.11 -2.03 0.00 0.00 177.10 176.28 3iou h LYS 273 N 6.45 0.16 -1.10 3.55 1.57 -1.93 -3.38 116.57 121.89 3iou h LYS 273 Ca 0.04 -0.27 0.32 0.00 -1.87 0.00 0.00 60.65 58.86 3iou h LYS 273 Cb 0.88 0.10 -0.05 0.00 0.08 0.00 0.00 32.23 33.24 3iou h LYS 273 CO 0.74 0.92 0.78 0.93 -0.57 0.00 0.00 179.45 182.25 3iou h GLU 274 N 0.04 0.03 -0.11 3.15 4.39 -1.96 -0.54 114.58 119.59 3iou h GLU 274 Ca -0.34 -0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.25 3iou h GLU 274 Cb 2.02 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 30.67 3iou h GLU 274 CO 0.10 0.02 -0.35 -0.07 -1.16 0.00 0.00 179.01 177.55 3iou h LEU 275 N 0.03 0.50 -1.36 1.33 3.38 -1.99 -2.36 115.31 114.83 3iou h LEU 275 Ca 0.53 -0.60 0.09 0.00 0.09 0.00 0.00 57.88 57.98 3iou h LEU 275 Cb 2.06 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 42.61 3iou h LEU 275 CO -0.03 1.02 0.50 0.00 0.09 0.00 0.00 178.44 180.02 3iou h ALA 276 N 0.49 1.75 0.00 1.53 0.00 -1.32 2.09 119.26 123.81 3iou h ALA 276 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3iou h ALA 276 Cb 0.97 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.59 3iou h ALA 276 CO 0.07 0.10 0.00 1.17 0.00 0.00 0.00 179.25 180.59 3iou n LYS 277 N -4.50 0.05 -0.09 0.00 4.81 -0.96 0.11 118.16 117.57 3iou n LYS 277 Ca 0.12 0.11 -0.20 0.00 -0.87 0.00 0.00 58.31 57.48 3iou n LYS 277 Cb 0.30 -1.57 -0.12 0.00 0.02 0.00 0.00 35.03 33.66 3iou n LYS 277 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 3iou n GLU 278 N -1.65 0.67 0.41 1.64 4.71 0.50 -3.68 120.64 123.23 3iou n GLU 278 Ca 0.06 0.20 -0.18 0.00 -0.01 0.00 0.00 57.16 57.22 3iou n GLU 278 Cb 0.31 -1.57 -0.09 0.00 -1.01 0.00 0.00 31.44 29.07 3iou n GLU 278 CO 0.00 0.00 0.00 0.35 0.09 0.00 0.00 177.13 177.57 3iou h PHE 279 N -0.07 -0.95 0.01 -0.32 3.57 0.34 0.05 116.94 119.56 3iou h PHE 279 Ca -0.54 -0.02 -0.08 0.00 3.53 0.00 0.00 57.97 60.86 3iou h PHE 279 Cb 1.90 0.32 0.01 0.00 2.79 0.00 0.00 35.95 40.97 3iou h PHE 279 CO 0.04 -0.58 -0.31 -0.07 -2.23 0.00 0.00 178.31 175.15 3iou h LEU 280 N -1.08 0.26 -0.87 0.59 3.38 0.56 0.14 115.31 118.30 3iou h LEU 280 Ca -0.11 -0.79 -0.12 0.00 0.09 0.00 0.00 57.88 56.95 3iou h LEU 280 Cb 0.80 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 3iou h LEU 280 CO 0.17 1.02 -0.46 -0.33 0.09 0.00 0.00 178.44 178.94 3iou h GLU 281 N -0.47 0.25 0.00 1.13 5.08 -1.63 -2.74 114.58 116.19 3iou h GLU 281 Ca -0.04 -0.13 -0.31 0.00 -1.00 0.00 0.00 59.36 57.89 3iou h GLU 281 Cb 1.08 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.27 3iou h GLU 281 CO 0.06 0.66 -2.22 0.09 -1.00 0.00 0.00 179.01 176.60 3iou n ASN 282 N -3.99 0.51 -0.00 1.42 3.02 -0.01 -4.76 115.26 111.45 3iou n ASN 282 Ca -0.02 0.00 -0.03 0.00 -0.03 0.00 0.00 54.58 54.50 3iou n ASN 282 Cb 0.51 1.03 -0.01 0.00 -0.61 0.00 0.00 39.78 40.70 3iou n ASN 282 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3iou n TYR 283 N -2.63 0.00 0.11 3.10 4.02 0.25 -4.81 117.16 117.20 3iou n TYR 283 Ca -0.28 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.60 3iou n TYR 283 Cb 1.05 -0.12 0.24 0.00 -0.02 0.00 0.00 39.34 40.49 3iou n TYR 283 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 3iou h LEU 284 N -0.14 0.18 -5.96 7.72 5.85 -0.93 -3.21 115.31 118.81 3iou h LEU 284 Ca -0.06 -0.08 -0.78 0.00 0.84 0.00 0.00 57.88 57.80 3iou h LEU 284 Cb 0.74 -0.05 -0.22 0.00 0.37 0.00 0.00 40.66 41.50 3iou h LEU 284 CO -0.04 0.60 1.48 0.18 -0.34 0.00 0.00 178.44 180.32 3iou n LEU 285 N -4.01 7.58 0.00 2.25 4.77 -1.04 -2.67 117.00 123.89 3iou n LEU 285 Ca -0.02 -5.18 0.00 0.00 -0.03 0.00 0.00 56.01 50.79 3iou n LEU 285 Cb 0.49 -1.23 0.00 0.00 -2.33 0.00 0.00 43.42 40.35 3iou n LEU 285 CO 0.41 2.04 0.00 0.35 -1.33 0.00 0.00 177.39 178.86 3iou n THR 286 N 0.53 0.00 0.05 -5.08 -2.24 -1.21 -4.94 114.28 101.39 3iou n THR 286 Ca 0.52 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 62.24 3iou n THR 286 Cb 0.26 -0.06 -0.05 0.00 -2.10 0.00 0.00 70.33 68.39 3iou n THR 286 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 3iou h ASP 287 N 0.00 -0.20 -0.35 3.42 1.82 -1.91 -3.07 116.42 116.13 3iou h ASP 287 Ca 0.00 -0.18 0.00 0.00 -0.39 0.00 0.00 57.03 56.46 3iou h ASP 287 Cb 0.00 0.05 0.00 0.00 0.68 0.00 0.00 39.33 40.06 3iou h ASP 287 CO 0.00 0.34 0.00 -0.62 -1.61 0.00 0.00 179.24 177.35 3iou n GLU 288 N -4.92 1.92 -0.03 0.28 1.02 -1.26 -1.56 120.64 116.09 3iou n GLU 288 Ca -0.05 -1.42 -0.01 0.00 -0.02 0.00 0.00 57.16 55.66 3iou n GLU 288 Cb 0.19 -1.35 -0.00 0.00 -0.02 0.00 0.00 31.44 30.25 3iou n GLU 288 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 3iou h GLY 289 N 5.05 0.00 0.75 0.62 0.00 -1.76 -3.29 103.07 104.45 3iou h GLY 289 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.39 3iou h GLY 289 CO 0.00 0.00 0.54 1.41 0.00 0.00 0.00 176.54 178.49 3iou h LEU 290 N -0.52 0.85 -0.29 3.11 3.38 -1.41 -2.91 115.31 117.54 3iou h LEU 290 Ca 0.00 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.02 3iou h LEU 290 Cb 0.11 -0.17 -0.07 0.00 0.09 0.00 0.00 40.66 40.62 3iou h LEU 290 CO 0.00 0.55 -0.51 -0.08 0.09 0.00 0.00 178.44 178.49 3iou h GLU 291 N 0.99 -0.41 -0.50 1.13 4.81 -1.48 0.35 114.58 119.47 3iou h GLU 291 Ca 0.37 0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.70 3iou h GLU 291 Cb 0.14 0.09 -0.06 0.00 0.63 0.00 0.00 28.75 29.55 3iou h GLU 291 CO -0.16 -0.28 0.15 0.00 -0.73 0.00 0.00 179.01 177.99 3iou h ALA 292 N -0.24 0.59 -0.09 2.92 0.00 -1.60 0.37 119.26 121.21 3iou h ALA 292 Ca 0.05 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.06 3iou h ALA 292 Cb 0.58 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 3iou h ALA 292 CO -0.50 -0.25 -0.03 0.28 0.00 0.00 0.00 179.25 178.75 3iou h VAL 293 N 0.31 0.88 -0.61 0.00 2.07 -1.20 -1.96 116.25 115.73 3iou h VAL 293 Ca 0.24 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.81 3iou h VAL 293 Cb 0.29 0.88 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 3iou h VAL 293 CO -0.27 0.00 0.34 -1.13 0.02 0.00 0.00 177.57 176.52 3iou h ASN 294 N -0.02 0.50 0.53 0.57 -1.24 0.25 -3.00 115.58 113.18 3iou h ASN 294 Ca 0.05 0.03 0.00 0.00 0.71 0.00 0.00 56.30 57.08 3iou h ASN 294 Cb 0.09 -0.07 0.00 0.00 0.73 0.00 0.00 38.32 39.07 3iou h ASN 294 CO -0.11 0.33 0.00 0.11 -1.29 0.00 0.00 177.43 176.48 3iou h LYS 295 N 0.64 0.00 0.00 6.67 1.57 0.47 -2.47 116.57 123.45 3iou h LYS 295 Ca 0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 3iou h LYS 295 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 3iou h LYS 295 CO -0.16 0.00 0.00 -3.47 -0.57 0.00 0.00 179.45 175.25 3iou n ASP 296 N -2.80 0.00 -3.93 0.86 2.03 -0.95 -4.87 116.55 106.89 3iou n ASP 296 Ca -0.00 0.52 -0.23 0.00 0.52 0.00 0.00 54.79 55.59 3iou n ASP 296 Cb 0.18 -0.27 -0.17 0.00 -0.72 0.00 0.00 41.12 40.14 3iou n ASP 296 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 3iou s LYS 297 N -1.32 1.27 0.00 -0.67 2.47 -1.06 -4.95 119.74 115.49 3iou s LYS 297 Ca 0.00 -0.22 -0.38 0.00 -1.56 0.00 0.00 55.97 53.80 3iou s LYS 297 Cb 0.00 -1.22 -0.17 0.00 -1.46 0.00 0.00 37.83 34.98 3iou s LYS 297 CO 0.00 -0.11 1.35 -2.30 0.16 0.00 0.00 175.35 174.45 3iou n PRO 298 N 4.28 0.89 0.29 4.03 -0.02 -0.96 -4.02 135.00 139.49 3iou n PRO 298 Ca -0.20 0.32 0.18 0.00 -2.02 0.00 0.00 63.50 61.79 3iou n PRO 298 Cb 0.51 -1.94 0.79 0.00 -0.02 0.00 0.00 33.50 32.84 3iou n PRO 298 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3iou h LEU 299 N 4.61 0.00 0.00 2.45 3.38 -1.87 -3.48 115.31 120.41 3iou h LEU 299 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 3iou h LEU 299 Cb 1.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.10 3iou h LEU 299 CO 0.78 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.92 3iou n GLY 300 N -0.19 0.74 2.29 0.83 0.00 -1.26 -4.72 105.19 102.87 3iou n GLY 300 Ca -0.00 -1.51 -0.14 0.00 0.00 0.00 0.00 46.02 44.36 3iou n GLY 300 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iou n ALA 301 N 0.88 -0.04 -2.67 4.61 0.00 -0.91 -4.97 120.51 117.40 3iou n ALA 301 Ca 0.00 -1.14 -0.19 0.00 0.00 0.00 0.00 53.44 52.11 3iou n ALA 301 Cb 0.00 0.15 -0.14 0.00 0.00 0.00 0.00 19.45 19.46 3iou n ALA 301 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3iou s VAL 302 N -1.88 0.86 0.50 0.00 -7.23 -1.26 -3.02 120.40 108.37 3iou s VAL 302 Ca 0.40 -0.63 0.36 0.00 -1.81 0.00 0.00 61.98 60.30 3iou s VAL 302 Cb -0.02 -0.75 0.39 0.00 0.56 0.00 0.00 36.38 36.55 3iou s VAL 302 CO 0.27 0.12 2.22 0.00 -0.31 0.00 0.00 175.10 177.40 3iou h ALA 303 N 5.53 1.16 -2.70 1.32 0.00 -0.44 -3.43 119.26 120.69 3iou h ALA 303 Ca -0.33 -0.03 -0.50 0.00 0.00 0.00 0.00 54.91 54.05 3iou h ALA 303 Cb 1.18 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 3iou h ALA 303 CO 0.47 0.04 0.36 -0.51 0.00 0.00 0.00 179.25 179.61 3iou s LEU 304 N -6.70 4.60 0.18 0.00 1.02 -1.26 -0.97 118.68 115.56 3iou s LEU 304 Ca -0.03 1.93 -0.06 0.00 0.02 0.00 0.00 54.13 55.98 3iou s LEU 304 Cb 0.13 -3.61 0.07 0.00 0.02 0.00 0.00 46.19 42.81 3iou s LEU 304 CO 0.50 0.08 1.51 0.11 0.02 0.00 0.00 176.35 178.57 3iou h LYS 305 N 4.52 0.70 0.52 1.70 1.57 -1.84 -2.85 116.57 120.90 3iou h LYS 305 Ca -0.45 -0.40 -0.03 0.00 -1.87 0.00 0.00 60.65 57.91 3iou h LYS 305 Cb 1.20 0.03 0.01 0.00 0.08 0.00 0.00 32.23 33.55 3iou h LYS 305 CO 0.69 1.02 -0.25 1.03 -0.57 0.00 0.00 179.45 181.37 3iou h SER 306 N 0.56 -0.59 0.67 0.86 0.87 -1.94 -2.95 113.55 111.04 3iou h SER 306 Ca 0.03 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 3iou h SER 306 Cb 1.02 0.15 0.00 0.00 -0.44 0.00 0.00 62.40 63.13 3iou h SER 306 CO 0.10 -0.18 0.00 0.00 -0.53 0.00 0.00 176.83 176.22 3iou n TYR 307 N -5.24 0.00 0.05 2.24 9.36 -1.26 -2.34 117.16 119.97 3iou n TYR 307 Ca -0.09 0.00 -0.13 0.00 3.32 0.00 0.00 57.90 61.00 3iou n TYR 307 Cb 0.29 -0.40 -0.09 0.00 -0.63 0.00 0.00 39.34 38.51 3iou n TYR 307 CO 0.00 0.00 0.00 1.49 0.22 0.00 0.00 176.86 178.57 3iou h GLU 308 N 0.00 -0.12 -0.41 2.98 4.57 -1.49 -1.72 114.58 118.39 3iou h GLU 308 Ca 0.00 0.01 0.09 0.00 -1.18 0.00 0.00 59.36 58.27 3iou h GLU 308 Cb 0.34 0.03 -0.09 0.00 -0.16 0.00 0.00 28.75 28.87 3iou h GLU 308 CO 0.00 0.22 -0.18 0.93 -1.18 0.00 0.00 179.01 178.81 3iou h GLU 309 N -0.47 -0.09 -0.92 1.92 5.08 -1.28 1.45 114.58 120.27 3iou h GLU 309 Ca -0.01 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.42 3iou h GLU 309 Cb 0.39 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.60 3iou h GLU 309 CO 0.02 -0.06 0.60 1.49 -1.00 0.00 0.00 179.01 180.06 3iou h GLU 310 N -0.10 1.02 0.00 2.33 4.81 -1.51 -2.14 114.58 118.99 3iou h GLU 310 Ca 0.20 -0.06 -0.21 0.00 -0.13 0.00 0.00 59.36 59.16 3iou h GLU 310 Cb 0.41 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 3iou h GLU 310 CO -0.48 0.67 -1.07 -0.07 -0.73 0.00 0.00 179.01 177.34 3iou h LEU 311 N 1.05 0.00 -1.74 1.64 3.38 -0.46 -3.33 115.31 115.85 3iou h LEU 311 Ca 0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.37 3iou h LEU 311 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3iou h LEU 311 CO -0.15 0.93 0.00 0.00 0.09 0.00 0.00 178.44 179.31 3iou h ALA 312 N 1.07 1.00 -0.70 1.53 0.00 0.27 -1.89 119.26 120.54 3iou h ALA 312 Ca -0.06 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 3iou h ALA 312 Cb 1.76 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.52 3iou h ALA 312 CO 0.11 -0.00 0.34 0.87 0.00 0.00 0.00 179.25 180.57 3iou h LYS 313 N 0.00 1.00 -6.41 0.00 1.57 -1.66 -3.38 116.57 107.69 3iou h LYS 313 Ca 0.00 -0.13 -0.57 0.00 -1.87 0.00 0.00 60.65 58.08 3iou h LYS 313 Cb 0.01 -0.19 -0.05 0.00 0.08 0.00 0.00 32.23 32.08 3iou h LYS 313 CO 0.00 0.77 1.03 0.34 -0.57 0.00 0.00 179.45 181.02 3iou s ASP 314 N -6.42 6.51 0.18 0.86 2.15 -0.71 -4.93 116.67 114.31 3iou s ASP 314 Ca -0.11 1.10 -0.13 0.00 0.43 0.00 0.00 52.55 53.84 3iou s ASP 314 Cb 0.17 -2.54 0.15 0.00 -0.30 0.00 0.00 42.92 40.40 3iou s ASP 314 CO 0.80 -1.24 1.75 -0.65 -0.17 0.00 0.00 175.17 175.67 3iou h PRO 315 N 10.00 0.34 -0.91 4.34 0.11 -1.86 -2.06 132.00 141.97 3iou h PRO 315 Ca -0.27 -0.02 0.18 0.00 0.11 0.00 0.00 66.00 65.99 3iou h PRO 315 Cb 1.11 -0.08 -0.17 0.00 0.11 0.00 0.00 31.00 31.97 3iou h PRO 315 CO 1.05 0.23 -0.25 0.00 -0.21 0.00 0.00 178.00 178.82 3iou h ARG 316 N 0.35 -0.01 0.74 1.05 3.08 -1.92 0.90 114.38 118.58 3iou h ARG 316 Ca 0.23 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.24 3iou h ARG 316 Cb 0.23 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.29 3iou h ARG 316 CO -0.23 -0.00 -0.35 0.82 -1.07 0.00 0.00 179.97 179.14 3iou h ILE 317 N -0.01 0.20 -1.01 2.04 5.03 -1.72 -2.29 117.51 119.76 3iou h ILE 317 Ca 0.42 -0.14 0.27 0.00 -0.12 0.00 0.00 64.86 65.29 3iou h ILE 317 Cb 0.65 0.24 -0.06 0.00 -3.03 0.00 0.00 36.82 34.62 3iou h ILE 317 CO -0.93 0.01 0.70 0.00 -0.68 0.00 0.00 178.15 177.24 3iou h ALA 318 N -0.91 2.64 -0.15 1.87 0.00 -0.12 0.25 119.26 122.83 3iou h ALA 318 Ca -0.10 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 3iou h ALA 318 Cb 0.78 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 3iou h ALA 318 CO 0.17 -0.96 -0.21 0.00 0.00 0.00 0.00 179.25 178.25 3iou h ALA 319 N 1.55 0.22 -0.13 0.00 0.00 0.75 -1.11 119.26 120.54 3iou h ALA 319 Ca 0.51 -0.36 0.03 0.00 0.00 0.00 0.00 54.91 55.10 3iou h ALA 319 Cb 1.70 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.42 3iou h ALA 319 CO -0.12 0.16 -0.08 1.15 0.00 0.00 0.00 179.25 180.37 3iou h THR 320 N 0.01 0.76 -0.38 0.00 2.02 -0.02 0.21 112.91 115.52 3iou h THR 320 Ca 0.02 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.24 3iou h THR 320 Cb 0.77 0.76 -0.04 0.00 -1.74 0.00 0.00 68.15 67.90 3iou h THR 320 CO 0.05 0.00 0.15 -0.03 0.37 0.00 0.00 175.52 176.06 3iou h MET 321 N -0.07 0.31 -0.58 6.66 -1.53 -1.00 -1.91 114.93 116.80 3iou h MET 321 Ca 0.08 -0.02 -0.04 0.00 -3.44 0.00 0.00 59.70 56.28 3iou h MET 321 Cb 0.19 -0.07 -0.03 0.00 -0.55 0.00 0.00 31.60 31.14 3iou h MET 321 CO -0.18 0.20 0.22 1.49 0.14 0.00 0.00 176.91 178.78 3iou h GLU 322 N 0.32 0.89 -0.84 0.39 4.81 -0.89 -2.50 114.58 116.75 3iou h GLU 322 Ca 0.17 -0.17 0.05 0.00 -0.13 0.00 0.00 59.36 59.28 3iou h GLU 322 Cb 0.13 -0.14 -0.06 0.00 0.63 0.00 0.00 28.75 29.32 3iou h GLU 322 CO -0.16 0.77 0.53 -0.91 -0.73 0.00 0.00 179.01 178.51 3iou h ASN 323 N 0.81 0.85 -0.78 1.04 2.35 -0.29 -2.15 115.58 117.41 3iou h ASN 323 Ca 0.19 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.94 3iou h ASN 323 Cb 0.23 -0.17 -0.04 0.00 0.05 0.00 0.00 38.32 38.39 3iou h ASN 323 CO -0.01 0.56 0.46 0.00 -1.65 0.00 0.00 177.43 176.78 3iou h ALA 324 N 1.38 0.99 0.00 -0.83 0.00 -1.12 -1.61 119.26 118.08 3iou h ALA 324 Ca 0.36 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3iou h ALA 324 Cb 0.11 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.59 3iou h ALA 324 CO -0.15 0.47 0.00 1.04 0.00 0.00 0.00 179.25 180.61 3iou n GLN 325 N -4.47 0.63 0.00 0.00 6.02 -0.84 -0.77 117.38 117.96 3iou n GLN 325 Ca 0.07 0.00 0.05 0.00 -0.01 0.00 0.00 57.00 57.12 3iou n GLN 325 Cb 0.07 -1.47 -0.04 0.00 1.02 0.00 0.00 30.24 29.82 3iou n GLN 325 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3iou n LYS 326 N -0.97 2.92 -0.04 -1.09 4.01 -0.66 -5.06 118.16 117.27 3iou n LYS 326 Ca 0.14 -0.26 0.00 0.00 -0.51 0.00 0.00 58.31 57.69 3iou n LYS 326 Cb 0.07 -1.04 0.00 0.00 -0.51 0.00 0.00 35.03 33.54 3iou n LYS 326 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3iou n GLY 327 N 1.12 1.42 2.93 0.72 0.00 0.05 -4.13 105.19 107.31 3iou n GLY 327 Ca 0.03 -1.97 -0.27 0.00 0.00 0.00 0.00 46.02 43.81 3iou n GLY 327 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3iou s GLU 328 N 2.23 1.69 -1.00 1.61 2.12 -0.80 -4.88 118.70 119.67 3iou s GLU 328 Ca 0.00 -0.32 -0.25 0.00 0.36 0.00 0.00 54.97 54.76 3iou s GLU 328 Cb 0.00 -1.70 -0.12 0.00 0.26 0.00 0.00 34.13 32.57 3iou s GLU 328 CO 0.00 -0.26 2.08 0.42 -0.54 0.00 0.00 175.26 176.96 3iou s ILE 329 N 1.65 3.29 -0.34 -3.70 1.09 -1.26 -2.08 121.20 119.85 3iou s ILE 329 Ca 0.05 -0.38 -0.32 0.00 -1.10 0.00 0.00 60.65 58.91 3iou s ILE 329 Cb -0.13 -3.96 -0.13 0.00 -1.06 0.00 0.00 42.46 37.18 3iou s ILE 329 CO -0.09 -0.56 1.11 0.80 -0.10 0.00 0.00 174.94 176.10 3iou n MET 330 N 8.52 0.00 -1.64 2.79 1.56 0.10 -4.75 117.12 123.71 3iou n MET 330 Ca 0.43 0.00 -0.58 0.00 -0.27 0.00 0.00 57.70 57.28 3iou n MET 330 Cb 0.46 -1.01 -0.07 0.00 2.15 0.00 0.00 33.22 34.74 3iou n MET 330 CO 0.00 0.00 0.00 -2.30 -0.73 0.00 0.00 175.97 172.94 3iou n PRO 331 N 2.88 0.71 0.05 2.12 -0.02 -1.26 -4.67 135.00 134.80 3iou n PRO 331 Ca 0.22 0.26 0.12 0.00 -2.02 0.00 0.00 63.50 62.08 3iou n PRO 331 Cb -0.04 -1.86 0.13 0.00 -0.02 0.00 0.00 33.50 31.71 3iou n PRO 331 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 3iou n ASN 332 N 3.46 0.66 -4.59 2.55 6.94 -1.26 -4.85 115.26 118.16 3iou n ASN 332 Ca 0.23 0.01 -0.39 0.00 -0.02 0.00 0.00 54.58 54.42 3iou n ASN 332 Cb 0.10 0.35 0.04 0.00 -2.36 0.00 0.00 39.78 37.91 3iou n ASN 332 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 177.26 178.53 3iou n ILE 333 N -2.05 3.06 0.24 1.53 -5.35 -1.26 -4.25 119.36 111.28 3iou n ILE 333 Ca 0.03 -0.50 0.13 0.00 -0.27 0.00 0.00 62.75 62.14 3iou n ILE 333 Cb 0.44 -1.10 0.42 0.00 -1.74 0.00 0.00 39.64 37.66 3iou n ILE 333 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 3iou h PRO 334 N 0.82 0.00 -0.25 6.28 0.13 -1.94 -2.27 132.00 134.77 3iou h PRO 334 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3iou h PRO 334 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 3iou h PRO 334 CO 0.52 0.09 0.00 1.04 -0.23 0.00 0.00 178.00 179.42 3iou n GLN 335 N -3.16 1.52 -0.02 0.86 3.00 -1.26 -3.30 117.38 115.02 3iou n GLN 335 Ca 0.02 -0.75 -0.06 0.00 -0.01 0.00 0.00 57.00 56.19 3iou n GLN 335 Cb 0.44 -1.20 0.13 0.00 0.00 0.00 0.00 30.24 29.60 3iou n GLN 335 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.06 179.04 3iou h MET 336 N 1.20 0.58 -0.79 -1.09 4.05 -1.75 -1.65 114.93 115.48 3iou h MET 336 Ca 0.00 -0.26 0.03 0.00 -0.28 0.00 0.00 59.70 59.18 3iou h MET 336 Cb 0.32 -0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 31.06 3iou h MET 336 CO 0.01 0.84 0.51 0.66 0.23 0.00 0.00 176.91 179.15 3iou h SER 337 N 0.49 0.84 -0.34 1.39 4.64 -1.78 0.75 113.55 119.55 3iou h SER 337 Ca 0.06 -0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 61.29 3iou h SER 337 Cb 0.82 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.70 3iou h SER 337 CO 0.07 0.59 -0.09 0.00 -0.87 0.00 0.00 176.83 176.53 3iou h ALA 338 N 1.32 0.47 -0.21 5.18 0.00 -1.75 -3.17 119.26 121.10 3iou h ALA 338 Ca 0.31 -0.30 0.06 0.00 0.00 0.00 0.00 54.91 54.98 3iou h ALA 338 Cb -0.01 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 17.59 3iou h ALA 338 CO -0.10 0.32 -0.25 0.35 0.00 0.00 0.00 179.25 179.57 3iou h PHE 339 N 0.45 -0.67 -0.23 0.00 3.04 -0.81 -2.99 116.94 115.73 3iou h PHE 339 Ca 0.09 0.04 0.02 0.00 3.98 0.00 0.00 57.97 62.10 3iou h PHE 339 Cb 0.59 0.33 -0.03 0.00 2.56 0.00 0.00 35.95 39.40 3iou h PHE 339 CO 0.05 -0.33 -0.18 -1.49 -2.02 0.00 0.00 178.31 174.34 3iou h TRP 340 N -0.27 -0.58 0.00 0.41 -0.00 -0.84 -2.87 115.95 111.79 3iou h TRP 340 Ca 0.13 0.03 -0.05 0.00 -0.00 0.00 0.00 58.89 59.00 3iou h TRP 340 Cb 0.47 0.28 -0.01 0.00 -0.00 0.00 0.00 29.16 29.91 3iou h TRP 340 CO -0.39 -0.14 -0.26 -0.92 -0.00 0.00 0.00 178.44 176.73 3iou h TYR 341 N -0.06 0.00 -0.02 0.49 5.03 -1.54 -2.04 116.97 118.84 3iou h TYR 341 Ca 0.04 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.35 3iou h TYR 341 Cb 0.16 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.44 3iou h TYR 341 CO -0.81 0.26 0.00 0.00 -1.32 0.00 0.00 178.16 176.28 3iou n ALA 342 N -2.39 2.64 -0.07 1.82 0.00 -1.09 -2.19 120.51 119.23 3iou n ALA 342 Ca -0.02 -0.24 -0.09 0.00 0.00 0.00 0.00 53.44 53.09 3iou n ALA 342 Cb 0.34 -1.37 -0.07 0.00 0.00 0.00 0.00 19.45 18.35 3iou n ALA 342 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3iou n VAL 343 N -0.65 0.83 0.28 0.00 0.31 -0.80 -3.72 118.33 114.59 3iou n VAL 343 Ca 0.20 -0.37 0.16 0.00 -0.01 0.00 0.00 64.34 64.32 3iou n VAL 343 Cb 0.15 -0.93 0.77 0.00 -0.91 0.00 0.00 33.84 32.92 3iou n VAL 343 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 3iou h ARG 344 N 0.00 0.00 0.00 5.55 2.43 -1.33 0.48 114.38 121.51 3iou h ARG 344 Ca -0.32 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 58.79 3iou h ARG 344 Cb 1.57 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 31.11 3iou h ARG 344 CO -0.03 0.00 -0.38 1.15 -1.51 0.00 0.00 179.97 179.19 3iou h THR 345 N 0.00 0.78 -0.15 0.20 2.02 -1.63 -3.36 112.91 110.76 3iou h THR 345 Ca 0.05 -1.69 0.04 0.00 0.77 0.00 0.00 66.41 65.58 3iou h THR 345 Cb 0.82 1.58 -0.05 0.00 -1.74 0.00 0.00 68.15 68.76 3iou h THR 345 CO -0.00 0.26 -0.15 0.00 0.37 0.00 0.00 175.52 176.01 3iou h ALA 346 N -0.57 -0.04 0.00 6.16 0.00 -0.98 -2.35 119.26 121.47 3iou h ALA 346 Ca -0.08 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3iou h ALA 346 Cb 0.71 0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 3iou h ALA 346 CO -0.05 -0.59 -0.15 -0.24 0.00 0.00 0.00 179.25 178.22 3iou h VAL 347 N -0.17 0.52 0.05 0.00 3.04 -0.40 -2.56 116.25 116.73 3iou h VAL 347 Ca 0.10 -0.75 -0.00 0.00 -1.01 0.00 0.00 66.70 65.04 3iou h VAL 347 Cb 0.32 1.50 0.00 0.00 -2.01 0.00 0.00 31.29 31.10 3iou h VAL 347 CO -0.25 0.15 -0.02 0.40 -1.01 0.00 0.00 177.57 176.84 3iou h ILE 348 N 0.00 0.88 -0.99 3.17 1.08 -1.58 -1.93 117.51 118.13 3iou h ILE 348 Ca -0.00 -1.53 0.08 0.00 -0.39 0.00 0.00 64.86 63.02 3iou h ILE 348 Cb 0.49 1.62 -0.07 0.00 -3.07 0.00 0.00 36.82 35.79 3iou h ILE 348 CO 0.02 0.28 0.64 0.78 -0.69 0.00 0.00 178.15 179.18 3iou h ASN 349 N -0.97 0.99 -0.27 1.72 4.21 -1.46 0.35 115.58 120.15 3iou h ASN 349 Ca -0.01 0.02 -0.09 0.00 1.21 0.00 0.00 56.30 57.43 3iou h ASN 349 Cb 0.51 -0.19 -0.02 0.00 -1.12 0.00 0.00 38.32 37.50 3iou h ASN 349 CO 0.01 0.61 -0.14 0.00 -1.29 0.00 0.00 177.43 176.62 3iou h ALA 350 N 1.48 1.03 -0.14 -0.83 0.00 -1.57 0.75 119.26 119.98 3iou h ALA 350 Ca 0.44 -0.32 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 3iou h ALA 350 Cb 0.24 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3iou h ALA 350 CO -0.19 0.58 -0.37 0.00 0.00 0.00 0.00 179.25 179.28 3iou h ALA 351 N 1.21 0.23 0.00 0.00 0.00 -0.18 -3.11 119.26 117.41 3iou h ALA 351 Ca 0.10 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3iou h ALA 351 Cb 0.60 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3iou h ALA 351 CO 0.04 0.31 0.00 -1.13 0.00 0.00 0.00 179.25 178.47 3iou n SER 352 N -4.33 0.52 0.00 0.00 3.41 0.10 -4.83 113.62 108.50 3iou n SER 352 Ca -0.07 0.67 0.00 0.00 -0.26 0.00 0.00 58.87 59.21 3iou n SER 352 Cb 0.52 -0.77 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 3iou n SER 352 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3iou n GLY 353 N -0.59 1.16 0.25 5.00 0.00 -1.15 -4.90 105.19 104.95 3iou n GLY 353 Ca 0.01 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.12 3iou n GLY 353 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3iou h ARG 354 N 3.40 0.00 -4.48 1.61 0.11 -1.58 -3.45 114.38 110.00 3iou h ARG 354 Ca 0.00 0.00 -0.23 0.00 0.10 0.00 0.00 59.98 59.85 3iou h ARG 354 Cb 0.00 0.00 -0.14 0.00 1.11 0.00 0.00 29.97 30.94 3iou h ARG 354 CO 0.00 0.13 -0.55 -0.65 0.10 0.00 0.00 179.97 179.01 3iou s GLN 355 N -4.51 1.28 0.39 0.08 -0.21 0.17 -4.96 119.66 111.89 3iou s GLN 355 Ca -0.04 -1.60 0.08 0.00 0.02 0.00 0.00 55.36 53.82 3iou s GLN 355 Cb 0.15 0.30 0.00 0.00 1.00 0.00 0.00 33.01 34.46 3iou s GLN 355 CO 0.64 -0.44 0.52 -0.08 -2.12 0.00 0.00 175.29 173.81 3iou s THR 356 N -4.10 3.32 0.12 -0.19 -1.32 -1.26 -4.11 115.64 108.09 3iou s THR 356 Ca 0.37 -1.04 -0.27 0.00 -1.21 0.00 0.00 61.69 59.55 3iou s THR 356 Cb 0.06 -3.13 -0.07 0.00 -1.51 0.00 0.00 72.50 67.85 3iou s THR 356 CO 0.12 -0.05 1.64 0.58 -2.21 0.00 0.00 174.62 174.70 3iou h VAL 357 N 0.76 0.41 0.00 5.08 2.07 -1.93 -2.51 116.25 120.13 3iou h VAL 357 Ca -0.42 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.07 3iou h VAL 357 Cb 1.27 0.41 -0.00 0.00 -1.52 0.00 0.00 31.29 31.45 3iou h VAL 357 CO 0.49 0.00 -0.15 0.44 0.02 0.00 0.00 177.57 178.37 3iou h ASP 358 N -0.44 0.00 0.06 0.57 3.45 -1.96 -2.94 116.42 115.16 3iou h ASP 358 Ca 0.04 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.50 3iou h ASP 358 Cb 0.50 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.27 3iou h ASP 358 CO -0.19 0.15 -0.03 0.00 -1.57 0.00 0.00 179.24 177.60 3iou h ALA 359 N 1.85 -0.35 -2.27 3.45 0.00 -1.92 -3.29 119.26 116.73 3iou h ALA 359 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3iou h ALA 359 Cb 0.28 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3iou h ALA 359 CO 0.02 -0.34 0.00 0.00 0.00 0.00 0.00 179.25 178.93 3iou n ALA 360 N -2.14 -0.02 -0.20 0.00 0.00 -0.96 -1.50 120.51 115.70 3iou n ALA 360 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.42 3iou n ALA 360 Cb 0.03 0.27 0.02 0.00 0.00 0.00 0.00 19.45 19.77 3iou n ALA 360 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3iou n LEU 361 N -1.40 -0.33 0.07 0.00 4.77 -1.11 0.11 117.00 119.11 3iou n LEU 361 Ca 0.00 0.89 -0.12 0.00 -0.03 0.00 0.00 56.01 56.75 3iou n LEU 361 Cb 0.00 -0.20 -0.05 0.00 -2.33 0.00 0.00 43.42 40.84 3iou n LEU 361 CO 0.00 -0.79 0.66 0.00 -1.33 0.00 0.00 177.39 175.93 3iou h ALA 362 N 0.69 -0.44 -0.30 -1.18 0.00 -1.50 -0.82 119.26 115.71 3iou h ALA 362 Ca 0.17 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.15 3iou h ALA 362 Cb 0.30 0.52 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 3iou h ALA 362 CO -0.50 -0.81 0.24 0.00 0.00 0.00 0.00 179.25 178.17 3iou h ALA 363 N 0.29 2.19 -0.93 0.00 0.00 0.19 -1.58 119.26 119.42 3iou h ALA 363 Ca 0.06 -0.01 0.19 0.00 0.00 0.00 0.00 54.91 55.15 3iou h ALA 363 Cb 0.53 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.27 3iou h ALA 363 CO -0.24 -0.40 0.60 0.00 0.00 0.00 0.00 179.25 179.22 3iou h ALA 364 N 1.81 2.02 -0.97 0.00 0.00 0.72 0.37 119.26 123.21 3iou h ALA 364 Ca 0.14 0.03 0.18 0.00 0.00 0.00 0.00 54.91 55.27 3iou h ALA 364 Cb 0.62 -0.06 -0.09 0.00 0.00 0.00 0.00 17.79 18.27 3iou h ALA 364 CO -0.00 -0.32 0.61 0.37 0.00 0.00 0.00 179.25 179.91 3iou h GLN 365 N 0.54 0.67 -0.14 0.00 5.75 -1.28 0.23 115.11 120.88 3iou h GLN 365 Ca 0.50 -0.04 -0.20 0.00 -0.15 0.00 0.00 58.65 58.75 3iou h GLN 365 Cb 1.04 -0.15 0.00 0.00 1.07 0.00 0.00 27.48 29.44 3iou h GLN 365 CO -0.23 0.44 -0.72 1.15 -2.65 0.00 0.00 178.83 176.82 3iou h THR 366 N 0.69 1.32 -0.04 2.39 2.02 -0.47 -0.37 112.91 118.45 3iou h THR 366 Ca 0.52 -1.99 0.02 0.00 0.77 0.00 0.00 66.41 65.73 3iou h THR 366 Cb 0.90 1.97 -0.02 0.00 -1.74 0.00 0.00 68.15 69.26 3iou h THR 366 CO -0.29 0.62 -0.08 0.78 0.37 0.00 0.00 175.52 176.92 3iou h ASN 367 N 0.45 -0.23 0.08 4.18 2.35 0.14 -3.26 115.58 119.28 3iou h ASN 367 Ca -0.03 0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3iou h ASN 367 Cb 1.32 0.11 0.00 0.00 0.05 0.00 0.00 38.32 39.80 3iou h ASN 367 CO 0.14 -0.11 -0.04 0.00 -1.65 0.00 0.00 177.43 175.77 3iou h ALA 368 N 0.90 -0.16 0.00 -0.83 0.00 -0.71 -3.28 119.26 115.18 3iou h ALA 368 Ca 0.04 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3iou h ALA 368 Cb 0.18 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 3iou h ALA 368 CO -0.11 -0.15 -0.02 0.00 0.00 0.00 0.00 179.25 178.97 3iou h ALA 369 N -1.41 1.04 0.00 0.00 0.00 -1.18 0.42 119.26 118.12 3iou h ALA 369 Ca -0.01 -0.02 -0.35 0.00 0.00 0.00 0.00 54.91 54.53 3iou h ALA 369 Cb 0.09 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.81 3iou h ALA 369 CO 0.02 0.02 -2.31 0.00 0.00 0.00 0.00 179.25 176.98 3iou n ALA 370 N -2.11 1.52 0.26 0.00 0.00 -1.23 -4.12 120.51 114.83 3iou n ALA 370 Ca -0.01 -1.16 0.14 0.00 0.00 0.00 0.00 53.44 52.40 3iou n ALA 370 Cb 0.21 -0.12 0.71 0.00 0.00 0.00 0.00 19.45 20.26 3iou n ALA 370 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 3iou h MET 371 N 0.00 0.00 0.12 0.00 2.07 -1.41 -1.25 114.93 114.46 3iou h MET 371 Ca -0.52 0.00 -0.01 0.00 -2.07 0.00 0.00 59.70 57.11 3iou h MET 371 Cb 2.04 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 31.77 3iou h MET 371 CO -0.01 0.11 -0.06 0.00 1.07 0.00 0.00 176.91 178.03 3iou h ALA 372 N 1.89 -0.16 -0.37 6.32 0.00 -0.35 0.32 119.26 126.91 3iou h ALA 372 Ca -0.00 -0.07 -0.15 0.00 0.00 0.00 0.00 54.91 54.69 3iou h ALA 372 Cb 0.41 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 3iou h ALA 372 CO 0.01 -0.55 -0.37 0.00 0.00 0.00 0.00 179.25 178.34 3iou h THR 373 N -0.24 1.27 -0.71 0.00 1.03 -1.67 -2.78 112.91 109.81 3iou h THR 373 Ca -0.02 -1.55 -0.07 0.00 -0.01 0.00 0.00 66.41 64.77 3iou h THR 373 Cb 0.19 1.38 -0.03 0.00 -1.07 0.00 0.00 68.15 68.62 3iou h THR 373 CO 0.03 0.52 0.18 -0.07 -0.01 0.00 0.00 175.52 176.16 3iou h LEU 374 N 0.73 1.08 0.26 0.00 3.38 -1.16 0.82 115.31 120.42 3iou h LEU 374 Ca 0.06 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 3iou h LEU 374 Cb 0.95 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.42 3iou h LEU 374 CO 0.09 1.03 -0.12 -0.08 0.09 0.00 0.00 178.44 179.44 3iou h GLU 375 N 1.08 -0.33 -0.03 1.13 4.57 -0.32 0.67 114.58 121.34 3iou h GLU 375 Ca 0.23 0.02 -0.18 0.00 -1.18 0.00 0.00 59.36 58.25 3iou h GLU 375 Cb 0.36 0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.02 3iou h GLU 375 CO 0.00 -0.13 -0.76 0.87 -1.18 0.00 0.00 179.01 177.81 3iou h LYS 376 N -0.47 0.24 -0.14 1.92 1.57 -1.46 -2.54 116.57 115.68 3iou h LYS 376 Ca -0.04 -0.21 -0.19 0.00 -1.87 0.00 0.00 60.65 58.35 3iou h LYS 376 Cb 0.36 0.05 0.01 0.00 0.08 0.00 0.00 32.23 32.72 3iou h LYS 376 CO 0.06 0.89 -0.64 1.37 -0.57 0.00 0.00 179.45 180.55 3iou h LEU 377 N 0.15 0.81 -1.50 2.94 8.10 0.74 -1.28 115.31 125.27 3iou h LEU 377 Ca -0.03 -0.63 -0.03 0.00 0.11 0.00 0.00 57.88 57.30 3iou h LEU 377 Cb 1.34 -0.24 -0.01 0.00 -0.44 0.00 0.00 40.66 41.31 3iou h LEU 377 CO 0.12 1.30 -0.04 0.24 -4.11 0.00 0.00 178.44 175.95 3iou h MET 378 N 0.36 0.28 -0.12 0.17 2.86 0.33 -0.85 114.93 117.96 3iou h MET 378 Ca -0.04 -0.05 -0.17 0.00 -2.06 0.00 0.00 59.70 57.39 3iou h MET 378 Cb 1.28 -0.05 0.01 0.00 0.06 0.00 0.00 31.60 32.90 3iou h MET 378 CO 0.13 0.34 -0.57 0.87 1.06 0.00 0.00 176.91 178.74 3iou h LYS 379 N 0.27 0.60 -0.77 1.72 1.79 -1.36 -3.28 116.57 115.54 3iou h LYS 379 Ca 0.06 -0.49 -0.05 0.00 -2.18 0.00 0.00 60.65 58.00 3iou h LYS 379 Cb 0.25 0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 30.96 3iou h LYS 379 CO 0.01 1.11 0.30 0.00 -1.08 0.00 0.00 179.45 179.79 3iou h ALA 380 N 0.50 1.01 -0.76 3.86 0.00 -0.83 -2.86 119.26 120.18 3iou h ALA 380 Ca -0.04 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 54.80 3iou h ALA 380 Cb 1.21 -0.30 -0.09 0.00 0.00 0.00 0.00 17.79 18.61 3iou h ALA 380 CO 0.12 0.64 0.35 0.27 0.00 0.00 0.00 179.25 180.63 3iou h PHE 381 N 1.12 0.61 -0.01 0.00 -5.15 -1.23 -1.19 116.94 111.10 3iou h PHE 381 Ca 0.26 0.03 -0.00 0.00 -0.20 0.00 0.00 57.97 58.06 3iou h PHE 381 Cb 0.23 -0.16 -0.00 0.00 0.22 0.00 0.00 35.95 36.24 3iou h PHE 381 CO 0.02 0.15 -0.00 1.05 -2.00 0.00 0.00 178.31 177.53 3iou h GLU 382 N 0.54 0.02 -0.91 6.09 4.11 -1.59 0.13 114.58 122.97 3iou h GLU 382 Ca 0.40 -0.01 0.15 0.00 0.07 0.00 0.00 59.36 59.97 3iou h GLU 382 Cb 0.54 -0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.72 3iou h GLU 382 CO -0.35 0.43 0.58 0.77 0.07 0.00 0.00 179.01 180.51 3iou h SER 383 N -0.39 0.68 0.11 3.06 0.02 -1.22 3.89 113.55 119.70 3iou h SER 383 Ca 0.00 0.04 -0.15 0.00 -0.84 0.00 0.00 61.79 60.85 3iou h SER 383 Cb 0.42 -0.09 0.02 0.00 0.14 0.00 0.00 62.40 62.89 3iou h SER 383 CO 0.00 0.34 -0.65 -0.07 -1.14 0.00 0.00 176.83 175.31 3iou h LEU 384 N 0.72 0.38 -0.23 5.07 3.38 -1.19 -3.11 115.31 120.33 3iou h LEU 384 Ca 0.46 -0.96 0.00 0.00 0.09 0.00 0.00 57.88 57.47 3iou h LEU 384 Cb 0.72 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.35 3iou h LEU 384 CO -0.22 1.31 -0.18 2.29 0.09 0.00 0.00 178.44 181.73 3iou n LYS 385 N -4.22 0.55 0.00 1.13 2.85 0.03 -3.61 118.16 114.89 3iou n LYS 385 Ca -0.13 -0.23 0.00 0.00 -1.05 0.00 0.00 58.31 56.90 3iou n LYS 385 Cb 0.75 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.64 3iou n LYS 385 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 3iou n SER 386 N -1.02 0.00 0.00 -5.58 3.41 1.28 -4.73 113.62 106.98 3iou n SER 386 Ca 0.12 0.21 -0.00 0.00 -0.26 0.00 0.00 58.87 58.94 3iou n SER 386 Cb 0.30 -0.35 -0.00 0.00 -0.26 0.00 0.00 64.21 63.90 3iou n SER 386 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 3iou h PHE 387 N 0.00 -0.02 0.00 7.33 0.05 -1.69 -3.50 116.94 119.11 3iou h PHE 387 Ca 0.00 -0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.79 3iou h PHE 387 Cb 0.00 0.01 0.00 0.00 2.00 0.00 0.00 35.95 37.96 3iou h PHE 387 CO 0.00 -0.01 0.00 0.00 -0.18 0.00 0.00 178.31 178.12 3iou n GLN 388 N -2.22 0.00 -1.53 1.51 10.64 -1.24 -5.12 117.38 119.42 3iou n GLN 388 Ca -0.00 0.00 -0.25 0.00 -1.83 0.00 0.00 57.00 54.92 3iou n GLN 388 Cb 0.01 0.00 -0.11 0.00 -0.86 0.00 0.00 30.24 29.28 3iou n GLN 388 CO 0.00 0.00 0.00 0.94 -1.83 0.00 0.00 177.06 176.17 3iou n GLN 403 N 0.00 0.46 -2.81 2.61 0.00 -1.26 -4.91 117.38 111.47 3iou n GLN 403 Ca 0.00 -0.31 -0.02 0.00 -0.00 0.00 0.00 57.00 56.67 3iou n GLN 403 Cb 0.00 -2.68 -0.01 0.00 0.00 0.00 0.00 30.24 27.55 3iou n GLN 403 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 3iou n GLN 404 N 8.06 -2.38 -1.22 3.69 1.13 -1.26 -4.68 117.38 120.72 3iou n GLN 404 Ca 0.52 1.93 -0.15 0.00 -1.94 0.00 0.00 57.00 57.36 3iou n GLN 404 Cb 0.33 -2.25 0.10 0.00 0.11 0.00 0.00 30.24 28.52 3iou n GLN 404 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 3iou n PRO 405 N 2.22 -0.44 -1.91 -1.09 -0.04 -1.26 -5.01 135.00 127.48 3iou n PRO 405 Ca -0.13 -1.23 -0.36 0.00 -0.04 0.00 0.00 63.50 61.74 3iou n PRO 405 Cb 0.20 -0.64 0.05 0.00 -0.04 0.00 0.00 33.50 33.07 3iou n PRO 405 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 3iou s PRO 406 N -4.38 2.84 -0.22 0.54 0.04 -1.26 -4.90 135.00 127.65 3iou s PRO 406 Ca 0.40 1.94 -0.29 0.00 0.04 0.00 0.00 61.00 63.09 3iou s PRO 406 Cb -0.01 -1.92 0.01 0.00 0.04 0.00 0.00 34.50 32.61 3iou s PRO 406 CO 0.27 -1.34 1.08 -1.25 0.04 0.00 0.00 177.00 175.80 3iou s PRO 407 N -3.31 4.24 0.00 0.56 0.04 -1.26 -4.99 135.00 130.28 3iou s PRO 407 Ca 0.79 1.39 0.00 0.00 0.04 0.00 0.00 61.00 63.22 3iou s PRO 407 Cb -0.34 -3.67 0.00 0.00 0.04 0.00 0.00 34.50 30.54 3iou s PRO 407 CO 0.36 -0.66 0.00 -0.35 0.04 0.00 0.00 177.00 176.39 3iou n PRO 408 N 6.40 0.00 0.00 0.56 -0.04 -1.26 -4.95 135.00 135.72 3iou n PRO 408 Ca 0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 3iou n PRO 408 Cb 0.46 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.92 3iou n PRO 408 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 3iou n PRO 409 N 0.00 1.88 0.00 0.54 -0.04 -1.26 -4.68 135.00 131.44 3iou n PRO 409 Ca 0.00 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.51 3iou n PRO 409 Cb 0.00 0.00 0.24 0.00 -0.04 0.00 0.00 33.50 33.70 3iou n PRO 409 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 3iou n PRO 410 N 0.00 0.01 -2.90 0.54 -0.04 -1.26 -4.99 135.00 126.36 3iou n PRO 410 Ca 0.00 0.30 -0.42 0.00 -0.04 0.00 0.00 63.50 63.34 3iou n PRO 410 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 3iou n PRO 410 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 3iou s PRO 411 N -2.98 3.93 0.00 0.54 0.02 -1.26 -5.06 135.00 130.18 3iou s PRO 411 Ca 0.06 0.59 0.00 0.00 0.02 0.00 0.00 61.00 61.67 3iou s PRO 411 Cb 0.07 -3.75 0.00 0.00 0.02 0.00 0.00 34.50 30.84 3iou s PRO 411 CO 0.20 -0.76 0.00 -0.35 -0.33 0.00 0.00 177.00 175.76 3iou n PRO 412 N 6.37 2.05 -3.53 5.54 -0.04 -1.26 -4.90 135.00 139.23 3iou n PRO 412 Ca 0.05 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.27 3iou n PRO 412 Cb 0.48 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.92 3iou n PRO 412 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 3iou s PRO 413 N 0.91 3.48 0.24 0.54 0.02 -1.26 -5.01 135.00 133.91 3iou s PRO 413 Ca 0.00 -0.42 -0.06 0.00 0.02 0.00 0.00 61.00 60.54 3iou s PRO 413 Cb 0.00 -2.72 -0.06 0.00 0.02 0.00 0.00 34.50 31.74 3iou s PRO 413 CO 0.00 0.23 0.50 -1.25 -0.33 0.00 0.00 177.00 176.15 3iou s PRO 414 N -4.17 3.66 1.10 5.54 0.04 -1.26 -5.10 135.00 134.81 3iou s PRO 414 Ca 0.39 0.02 -0.20 0.00 0.04 0.00 0.00 61.00 61.25 3iou s PRO 414 Cb -0.10 -2.71 0.06 0.00 0.04 0.00 0.00 34.50 31.79 3iou s PRO 414 CO 0.34 0.31 -0.22 -2.30 0.04 0.00 0.00 177.00 175.17 3iou n PRO 415 N -0.50 -1.31 0.00 0.56 -0.02 -1.26 -5.36 135.00 127.11 3iou n PRO 415 Ca -0.02 -0.37 0.13 0.00 -2.02 0.00 0.00 63.50 61.23 3iou n PRO 415 Cb 0.53 -1.60 0.30 0.00 -0.02 0.00 0.00 33.50 32.72 3iou n PRO 415 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52