#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tr9 h LEU 1 N 0.00 0.58-10.35 2.46 -0.00 -1.81 -3.42 115.31 102.77 1tr9 h LEU 1 Ca 0.00 -0.35 -0.51 0.00 -0.00 0.00 0.00 57.88 57.02 1tr9 h LEU 1 Cb 0.00 -0.17 0.06 0.00 -0.00 0.00 0.00 40.66 40.55 1tr9 h LEU 1 CO 0.00 1.09 0.37 -0.83 -0.00 0.00 0.00 178.44 179.07 1tr9 s GLY 2 N -4.23 1.64 0.39 0.17 0.00 -1.20 0.29 107.32 104.38 1tr9 s GLY 2 Ca -0.07 -0.15 0.25 0.00 0.00 0.00 0.00 44.72 44.75 1tr9 s GLY 2 CO 0.85 0.10 1.70 -0.56 0.00 0.00 0.00 173.10 175.19 1tr9 h PRO 3 N -0.23 0.00 -5.70 2.90 0.13 -1.70 -3.07 132.00 124.33 1tr9 h PRO 3 Ca -0.44 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.11 1tr9 h PRO 3 Cb 1.19 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.24 1tr9 h PRO 3 CO 0.62 0.00 -0.12 -1.17 -0.23 0.00 0.00 178.00 177.10 1tr9 s LEU 4 N -5.74 4.25 -0.18 1.56 2.96 -0.06 -0.62 118.68 120.87 1tr9 s LEU 4 Ca 0.07 0.79 -0.08 0.00 -0.22 0.00 0.00 54.13 54.69 1tr9 s LEU 4 Cb 0.07 -2.69 -0.04 0.00 0.50 0.00 0.00 46.19 44.03 1tr9 s LEU 4 CO 0.63 -0.03 0.09 0.26 -1.32 0.00 0.00 176.35 175.97 1tr9 s TRP 5 N 0.80 3.33 0.28 5.38 0.52 0.54 0.00 118.94 129.80 1tr9 s TRP 5 Ca 0.26 0.20 0.03 0.00 0.02 0.00 0.00 56.10 56.61 1tr9 s TRP 5 Cb -0.15 -2.08 -0.01 0.00 -1.15 0.00 0.00 33.47 30.08 1tr9 s TRP 5 CO 0.10 0.27 0.10 1.47 0.02 0.00 0.00 176.95 178.91 1tr9 n LEU 6 N 3.32 0.00 -4.40 2.99 -0.00 -0.64 -1.54 117.00 116.73 1tr9 n LEU 6 Ca -0.17 -2.15 -0.20 0.00 -0.00 0.00 0.00 56.01 53.49 1tr9 n LEU 6 Cb 0.52 0.72 -0.09 0.00 -0.00 0.00 0.00 43.42 44.57 1tr9 n LEU 6 CO 0.35 -0.33 -0.23 1.51 -0.00 0.00 0.00 177.39 178.69 1tr9 s ASP 7 N -2.72 1.92 0.25 1.45 3.84 -1.26 -0.83 116.67 119.32 1tr9 s ASP 7 Ca 0.15 -1.50 0.08 0.00 -0.00 0.00 0.00 52.55 51.27 1tr9 s ASP 7 Cb 0.01 0.26 -0.05 0.00 -1.38 0.00 0.00 42.92 41.75 1tr9 s ASP 7 CO 0.10 -0.80 -0.11 0.68 -0.00 0.00 0.00 175.17 175.05 1tr9 s VAL 8 N -3.48 1.76 0.13 2.11 -7.23 -1.26 -4.96 120.40 107.45 1tr9 s VAL 8 Ca 0.34 -2.19 -0.09 0.00 -1.81 0.00 0.00 61.98 58.23 1tr9 s VAL 8 Cb 0.06 -2.26 -0.14 0.00 0.56 0.00 0.00 36.38 34.60 1tr9 s VAL 8 CO 0.15 -0.44 1.35 0.00 -0.31 0.00 0.00 175.10 175.85 1tr9 h ALA 9 N 2.40 0.40 -3.00 1.32 0.00 -1.97 -3.47 119.26 114.95 1tr9 h ALA 9 Ca -0.39 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 53.92 1tr9 h ALA 9 Cb 1.23 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1tr9 h ALA 9 CO 0.64 0.71 0.00 0.41 0.00 0.00 0.00 179.25 181.01 1tr9 n GLY 10 N 0.65 4.33 0.12 0.00 0.00 -1.26 -4.77 105.19 104.26 1tr9 n GLY 10 Ca -0.06 -0.63 0.01 0.00 0.00 0.00 0.00 46.02 45.33 1tr9 n GLY 10 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1tr9 h TYR 11 N 0.00 0.00 -3.64 1.61 0.99 -1.82 -3.39 116.97 110.72 1tr9 h TYR 11 Ca 0.00 0.00 -0.50 0.00 2.00 0.00 0.00 58.73 60.23 1tr9 h TYR 11 Cb 0.00 0.00 -0.20 0.00 1.00 0.00 0.00 36.73 37.53 1tr9 h TYR 11 CO 0.00 0.59 -0.79 -1.21 -0.00 0.00 0.00 178.16 176.75 1tr9 s GLU 12 N -2.91 1.12 0.04 4.88 2.02 -1.26 -4.66 118.70 117.93 1tr9 s GLU 12 Ca 0.03 -1.24 -0.30 0.00 0.02 0.00 0.00 54.97 53.48 1tr9 s GLU 12 Cb 0.08 -1.20 -0.04 0.00 0.10 0.00 0.00 34.13 33.06 1tr9 s GLU 12 CO 0.76 0.26 1.06 -1.17 0.02 0.00 0.00 175.26 176.19 1tr9 s LEU 13 N -2.27 4.39 0.59 1.80 2.96 -1.26 -4.88 118.68 120.01 1tr9 s LEU 13 Ca 0.09 1.82 -0.06 0.00 -0.22 0.00 0.00 54.13 55.76 1tr9 s LEU 13 Cb -0.07 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 43.04 1tr9 s LEU 13 CO 0.05 -0.32 0.91 -0.94 -1.32 0.00 0.00 176.35 174.73 1tr9 s SER 14 N 0.87 5.64 0.29 3.68 1.04 -1.26 -4.95 113.70 119.01 1tr9 s SER 14 Ca 0.54 0.78 -0.02 0.00 0.48 0.00 0.00 55.95 57.74 1tr9 s SER 14 Cb -0.25 -1.78 0.44 0.00 0.10 0.00 0.00 66.02 64.53 1tr9 s SER 14 CO 0.29 -1.05 1.93 0.00 0.98 0.00 0.00 173.24 175.39 1tr9 h ALA 15 N -0.20 1.43 -0.22 5.32 0.00 -2.00 -1.80 119.26 121.79 1tr9 h ALA 15 Ca -0.45 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.44 1tr9 h ALA 15 Cb 1.25 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 1tr9 h ALA 15 CO 0.61 0.47 0.04 1.49 0.00 0.00 0.00 179.25 181.87 1tr9 h GLU 16 N 1.13 0.13 -0.50 0.00 4.81 -2.01 -2.78 114.58 115.36 1tr9 h GLU 16 Ca 0.37 -0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.66 1tr9 h GLU 16 Cb 0.04 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.33 1tr9 h GLU 16 CO -0.11 0.08 0.18 -0.44 -0.73 0.00 0.00 179.01 177.99 1tr9 h ASP 17 N 0.13 0.19 -0.98 1.04 3.32 -1.82 -2.34 116.42 115.96 1tr9 h ASP 17 Ca 0.10 0.06 0.04 0.00 0.02 0.00 0.00 57.03 57.25 1tr9 h ASP 17 Cb 0.10 0.04 -0.06 0.00 0.22 0.00 0.00 39.33 39.63 1tr9 h ASP 17 CO -0.14 0.13 0.64 0.03 -1.72 0.00 0.00 179.24 178.19 1tr9 h ARG 18 N 0.36 1.18 -0.23 3.56 3.08 -1.09 -1.10 114.38 120.13 1tr9 h ARG 18 Ca 0.24 -0.07 -0.05 0.00 0.07 0.00 0.00 59.98 60.17 1tr9 h ARG 18 Cb 0.25 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 1tr9 h ARG 18 CO -0.24 0.78 -0.04 0.93 -1.07 0.00 0.00 179.97 180.33 1tr9 h GLU 19 N 1.21 0.43 -0.17 0.04 5.08 -1.25 -3.20 114.58 116.73 1tr9 h GLU 19 Ca 0.40 -0.16 -0.09 0.00 -1.00 0.00 0.00 59.36 58.51 1tr9 h GLU 19 Cb 0.05 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1tr9 h GLU 19 CO -0.13 0.65 -0.30 0.97 -1.00 0.00 0.00 179.01 179.20 1tr9 h ILE 20 N 0.17 1.27 0.00 3.13 2.10 -0.90 -2.13 117.51 121.15 1tr9 h ILE 20 Ca 0.06 -1.30 -0.00 0.00 1.08 0.00 0.00 64.86 64.70 1tr9 h ILE 20 Cb 0.48 1.48 -0.00 0.00 -1.09 0.00 0.00 36.82 37.69 1tr9 h ILE 20 CO 0.02 0.40 -0.01 -0.07 -1.08 0.00 0.00 178.15 177.41 1tr9 h LEU 21 N 0.29 0.00 -0.38 2.19 3.38 -1.21 -1.67 115.31 117.91 1tr9 h LEU 21 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1tr9 h LEU 21 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1tr9 h LEU 21 CO 0.05 0.01 -0.14 0.00 0.09 0.00 0.00 178.44 178.45 1tr9 n GLN 22 N -3.34 0.85 -2.16 1.13 6.02 -0.80 -4.66 117.38 114.41 1tr9 n GLN 22 Ca -0.03 -0.38 -0.42 0.00 -0.01 0.00 0.00 57.00 56.16 1tr9 n GLN 22 Cb 0.10 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 29.84 1tr9 n GLN 22 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1tr9 s HIS 23 N -2.41 3.02 0.61 1.08 2.46 -0.63 -4.88 115.29 114.54 1tr9 s HIS 23 Ca 0.29 0.84 0.33 0.00 0.47 0.00 0.00 55.06 56.98 1tr9 s HIS 23 Cb 0.20 -3.71 1.92 0.00 -0.13 0.00 0.00 32.58 30.86 1tr9 s HIS 23 CO 0.47 -2.58 2.24 -1.35 -2.47 0.00 0.00 174.74 171.05 1tr9 h PRO 24 N 7.31 0.00 0.00 2.88 0.11 -1.89 -1.26 132.00 139.15 1tr9 h PRO 24 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1tr9 h PRO 24 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1tr9 h PRO 24 CO 0.88 0.00 0.00 1.15 -0.21 0.00 0.00 178.00 179.82 1tr9 h THR 25 N 0.00 0.00 -3.42 -1.15 2.02 -1.94 -3.26 112.91 105.15 1tr9 h THR 25 Ca 0.02 -0.38 -0.53 0.00 0.77 0.00 0.00 66.41 66.29 1tr9 h THR 25 Cb 0.12 1.31 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 1tr9 h THR 25 CO -0.00 0.00 0.45 -0.69 0.37 0.00 0.00 175.52 175.65 1tr9 s VAL 26 N -3.65 4.32 0.00 3.16 1.01 -0.48 -0.88 120.40 123.89 1tr9 s VAL 26 Ca 0.01 1.79 0.00 0.00 0.00 0.00 0.00 61.98 63.78 1tr9 s VAL 26 Cb 0.09 -4.15 0.00 0.00 0.00 0.00 0.00 36.38 32.33 1tr9 s VAL 26 CO 0.49 0.21 0.00 0.61 0.00 0.00 0.00 175.10 176.41 1tr9 n GLY 27 N 2.64 0.48 3.63 4.51 0.00 0.10 -3.26 105.19 113.29 1tr9 n GLY 27 Ca 0.05 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.99 1tr9 n GLY 27 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tr9 s GLY 28 N -1.33 -0.36 -0.08 -0.02 0.00 -0.98 -1.92 107.32 102.63 1tr9 s GLY 28 Ca 0.00 0.31 0.02 0.00 0.00 0.00 0.00 44.72 45.05 1tr9 s GLY 28 CO 0.00 0.10 -0.15 0.14 0.00 0.00 0.00 173.10 173.19 1tr9 s VAL 29 N -3.56 1.38 -0.16 1.40 1.01 -0.15 -1.62 120.40 118.71 1tr9 s VAL 29 Ca 0.07 -0.60 -0.11 0.00 0.00 0.00 0.00 61.98 61.34 1tr9 s VAL 29 Cb -0.02 -1.25 -0.05 0.00 0.00 0.00 0.00 36.38 35.06 1tr9 s VAL 29 CO -0.03 0.41 0.20 -0.63 0.00 0.00 0.00 175.10 175.05 1tr9 s ILE 30 N 0.75 5.37 0.04 2.22 -1.09 -0.01 -1.10 121.20 127.38 1tr9 s ILE 30 Ca -0.12 0.36 -0.00 0.00 -2.23 0.00 0.00 60.65 58.65 1tr9 s ILE 30 Cb -0.16 -3.53 -0.04 0.00 -1.58 0.00 0.00 42.46 37.16 1tr9 s ILE 30 CO 0.03 0.46 0.17 -0.76 -1.23 0.00 0.00 174.94 173.61 1tr9 s LEU 31 N 0.05 4.23 0.39 2.97 1.43 0.18 -4.47 118.68 123.46 1tr9 s LEU 31 Ca 0.13 0.24 0.04 0.00 -1.03 0.00 0.00 54.13 53.50 1tr9 s LEU 31 Cb -0.12 -2.73 -0.04 0.00 0.03 0.00 0.00 46.19 43.34 1tr9 s LEU 31 CO 0.02 0.21 0.10 -0.36 0.23 0.00 0.00 176.35 176.55 1tr9 s PHE 32 N -1.41 1.83 0.34 0.29 0.40 -1.26 -4.44 117.98 113.73 1tr9 s PHE 32 Ca 0.31 -1.17 0.07 0.00 -0.60 0.00 0.00 56.93 55.54 1tr9 s PHE 32 Cb -0.13 -1.21 0.75 0.00 0.51 0.00 0.00 43.02 42.95 1tr9 s PHE 32 CO 0.23 -0.19 1.86 0.78 0.70 0.00 0.00 175.22 178.61 1tr9 h GLY 33 N 1.87 1.32 2.00 4.36 0.00 -1.94 -0.05 103.07 110.63 1tr9 h GLY 33 Ca -0.37 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 46.63 1tr9 h GLY 33 CO 0.61 0.10 0.00 0.07 0.00 0.00 0.00 176.54 177.33 1tr9 h ARG 34 N 0.76 0.00 -0.08 4.80 0.11 -1.94 -0.21 114.38 117.83 1tr9 h ARG 34 Ca 0.46 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.54 1tr9 h ARG 34 Cb 0.67 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.75 1tr9 h ARG 34 CO -0.22 0.00 0.00 0.09 0.10 0.00 0.00 179.97 179.94 1tr9 n ASN 35 N -2.51 2.28 -4.09 0.08 4.13 -0.04 -4.15 115.26 110.97 1tr9 n ASN 35 Ca -0.01 -1.76 -0.32 0.00 1.68 0.00 0.00 54.58 54.16 1tr9 n ASN 35 Cb 0.10 -0.04 -0.16 0.00 -1.54 0.00 0.00 39.78 38.15 1tr9 n ASN 35 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 1tr9 s TYR 36 N -1.92 2.88 -0.14 3.10 6.14 -0.09 -4.62 117.35 122.70 1tr9 s TYR 36 Ca 0.34 -1.84 -0.08 0.00 0.64 0.00 0.00 57.07 56.12 1tr9 s TYR 36 Cb 0.20 -1.89 -0.06 0.00 0.42 0.00 0.00 41.96 40.63 1tr9 s TYR 36 CO 0.31 -0.82 -0.20 1.58 0.64 0.00 0.00 175.55 177.06 1tr9 n HIS 37 N 4.57 0.00 -3.90 4.97 -0.00 -1.26 -4.97 115.22 114.63 1tr9 n HIS 37 Ca -0.18 0.00 -0.08 0.00 -0.00 0.00 0.00 57.72 57.46 1tr9 n HIS 37 Cb 0.47 -0.50 -0.03 0.00 -0.00 0.00 0.00 29.99 29.93 1tr9 n HIS 37 CO 0.00 0.00 0.00 0.16 -0.00 0.00 0.00 176.34 176.50 1tr9 s ASP 38 N -6.31 -0.20 0.15 0.26 -4.77 -1.26 -4.97 116.67 99.57 1tr9 s ASP 38 Ca -0.21 -0.71 -0.17 0.00 -3.30 0.00 0.00 52.55 48.17 1tr9 s ASP 38 Cb 0.07 0.66 0.03 0.00 -1.09 0.00 0.00 42.92 42.59 1tr9 s ASP 38 CO 0.27 -1.24 1.78 0.78 0.70 0.00 0.00 175.17 177.45 1tr9 h ASN 39 N 2.11 0.28 -0.24 2.11 2.35 -1.93 -0.85 115.58 119.40 1tr9 h ASN 39 Ca -0.23 0.01 -0.12 0.00 -0.55 0.00 0.00 56.30 55.42 1tr9 h ASN 39 Cb 1.25 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 39.57 1tr9 h ASN 39 CO 0.29 0.20 -0.26 1.56 -1.65 0.00 0.00 177.43 177.57 1tr9 h GLN 40 N 0.38 0.73 -0.68 0.81 1.08 -1.99 -1.78 115.11 113.65 1tr9 h GLN 40 Ca 0.14 -0.31 -0.05 0.00 -1.45 0.00 0.00 58.65 56.99 1tr9 h GLN 40 Cb 0.04 -0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 27.42 1tr9 h GLN 40 CO -0.09 0.91 0.23 0.37 -0.95 0.00 0.00 178.83 179.31 1tr9 h GLN 41 N 0.63 1.04 -0.29 1.46 -0.00 -1.89 -1.68 115.11 114.39 1tr9 h GLN 41 Ca 0.08 -0.21 -0.02 0.00 -0.00 0.00 0.00 58.65 58.50 1tr9 h GLN 41 Cb 0.77 -0.16 -0.01 0.00 0.00 0.00 0.00 27.48 28.08 1tr9 h GLN 41 CO 0.06 0.89 0.12 1.25 0.00 0.00 0.00 178.83 181.15 1tr9 h LEU 42 N 0.98 0.40 -0.77 -2.39 5.85 -0.96 -0.77 115.31 117.66 1tr9 h LEU 42 Ca 0.22 -0.17 0.08 0.00 0.84 0.00 0.00 57.88 58.86 1tr9 h LEU 42 Cb 0.27 -0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.13 1tr9 h LEU 42 CO -0.01 0.46 0.43 -0.07 -0.34 0.00 0.00 178.44 178.91 1tr9 h LEU 43 N 0.32 0.63 -0.60 2.25 3.38 -1.18 -1.57 115.31 118.54 1tr9 h LEU 43 Ca 0.10 0.04 -0.11 0.00 0.09 0.00 0.00 57.88 57.99 1tr9 h LEU 43 Cb 0.18 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1tr9 h LEU 43 CO -0.01 0.38 -0.14 0.00 0.09 0.00 0.00 178.44 178.76 1tr9 h ALA 44 N 1.41 0.80 -0.25 1.53 0.00 -1.10 -0.58 119.26 121.07 1tr9 h ALA 44 Ca 0.36 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1tr9 h ALA 44 Cb 0.29 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1tr9 h ALA 44 CO -0.22 0.66 0.14 1.25 0.00 0.00 0.00 179.25 181.07 1tr9 h LEU 45 N 0.86 0.31 -0.62 0.00 5.85 -0.80 -1.50 115.31 119.42 1tr9 h LEU 45 Ca 0.13 -0.09 -0.15 0.00 0.84 0.00 0.00 57.88 58.62 1tr9 h LEU 45 Cb 0.69 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 1tr9 h LEU 45 CO 0.05 0.31 -0.53 0.78 -0.34 0.00 0.00 178.44 178.71 1tr9 h ASN 46 N 0.29 0.50 -0.51 1.25 2.35 -1.15 -0.01 115.58 118.29 1tr9 h ASN 46 Ca 0.09 -0.26 0.00 0.00 -0.55 0.00 0.00 56.30 55.58 1tr9 h ASN 46 Cb 0.07 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 1tr9 h ASN 46 CO -0.01 0.93 0.33 0.50 -1.65 0.00 0.00 177.43 177.52 1tr9 h LYS 47 N 0.35 0.67 -0.63 0.81 3.64 -1.02 -1.56 116.57 118.83 1tr9 h LYS 47 Ca 0.01 -0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.26 1tr9 h LYS 47 Cb 1.04 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.69 1tr9 h LYS 47 CO 0.09 0.46 0.06 0.00 -2.27 0.00 0.00 179.45 177.80 1tr9 h ALA 48 N 1.17 0.92 -0.45 5.00 0.00 -0.91 -0.34 119.26 124.65 1tr9 h ALA 48 Ca 0.18 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1tr9 h ALA 48 Cb -0.06 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1tr9 h ALA 48 CO -0.04 0.66 0.28 0.82 0.00 0.00 0.00 179.25 180.97 1tr9 h ILE 49 N 0.99 1.13 -0.46 0.00 2.04 -0.72 -0.01 117.51 120.49 1tr9 h ILE 49 Ca 0.19 -0.28 -0.12 0.00 1.00 0.00 0.00 64.86 65.65 1tr9 h ILE 49 Cb 0.48 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 1tr9 h ILE 49 CO 0.02 0.13 -0.18 0.03 0.00 0.00 0.00 178.15 178.15 1tr9 h ARG 50 N 0.60 0.89 -0.22 2.37 3.08 -1.04 -1.40 114.38 118.66 1tr9 h ARG 50 Ca 0.16 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.85 1tr9 h ARG 50 Cb -0.03 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 1tr9 h ARG 50 CO -0.03 1.00 0.10 0.37 -1.07 0.00 0.00 179.97 180.33 1tr9 h GLN 51 N 0.78 0.32 -0.56 0.04 -0.00 -0.83 -2.23 115.11 112.64 1tr9 h GLN 51 Ca 0.11 -0.05 -0.10 0.00 -0.00 0.00 0.00 58.65 58.61 1tr9 h GLN 51 Cb 0.72 -0.05 -0.02 0.00 0.00 0.00 0.00 27.48 28.13 1tr9 h GLN 51 CO 0.06 0.35 -0.03 0.00 0.00 0.00 0.00 178.83 179.21 1tr9 h ALA 52 N 0.95 0.76 -0.45 3.38 0.00 -0.90 -2.94 119.26 120.06 1tr9 h ALA 52 Ca 0.07 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.60 1tr9 h ALA 52 Cb 0.15 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1tr9 h ALA 52 CO -0.01 0.61 0.00 0.00 0.00 0.00 0.00 179.25 179.85 1tr9 h ALA 53 N 0.95 1.17 0.00 0.00 0.00 -1.22 -3.42 119.26 116.74 1tr9 h ALA 53 Ca 0.15 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1tr9 h ALA 53 Cb 0.58 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1tr9 h ALA 53 CO 0.03 0.54 0.00 1.63 0.00 0.00 0.00 179.25 181.46 1tr9 n LYS 54 N -4.23 0.00 -1.65 0.00 5.02 -0.84 -4.81 118.16 111.64 1tr9 n LYS 54 Ca 0.02 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 56.01 1tr9 n LYS 54 Cb 0.29 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 35.35 1tr9 n LYS 54 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1tr9 s ARG 55 N 0.00 2.87 0.26 1.97 1.70 -1.26 -4.96 118.95 119.53 1tr9 s ARG 55 Ca 0.00 0.81 -0.30 0.00 -0.47 0.00 0.00 55.73 55.77 1tr9 s ARG 55 Cb 0.00 -1.99 -0.14 0.00 -0.57 0.00 0.00 34.95 32.25 1tr9 s ARG 55 CO 0.00 -1.11 1.25 -2.30 -1.08 0.00 0.00 175.30 172.06 1tr9 n PRO 56 N -3.12 1.77 -4.00 3.89 -0.02 -1.26 -4.81 135.00 127.45 1tr9 n PRO 56 Ca 0.07 0.63 -0.10 0.00 -2.02 0.00 0.00 63.50 62.08 1tr9 n PRO 56 Cb 0.54 -2.18 -0.11 0.00 -0.02 0.00 0.00 33.50 31.74 1tr9 n PRO 56 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1tr9 s ILE 57 N -0.55 0.19 0.05 4.25 2.07 -1.26 0.16 121.20 126.12 1tr9 s ILE 57 Ca 0.64 -1.00 -0.16 0.00 -1.41 0.00 0.00 60.65 58.72 1tr9 s ILE 57 Cb -0.67 -0.40 -0.06 0.00 0.13 0.00 0.00 42.46 41.46 1tr9 s ILE 57 CO 0.55 -0.51 0.49 -0.76 -1.91 0.00 0.00 174.94 172.80 1tr9 s LEU 58 N -1.58 4.46 -0.13 8.50 1.43 -0.81 -4.67 118.68 125.90 1tr9 s LEU 58 Ca -0.14 1.08 0.02 0.00 -1.03 0.00 0.00 54.13 54.06 1tr9 s LEU 58 Cb -0.09 -2.83 0.01 0.00 0.03 0.00 0.00 46.19 43.31 1tr9 s LEU 58 CO -0.01 0.26 -0.18 -0.63 0.23 0.00 0.00 176.35 176.02 1tr9 s ILE 59 N -1.17 1.71 0.23 -0.59 1.01 -1.26 -0.97 121.20 120.16 1tr9 s ILE 59 Ca 0.28 -0.76 0.04 0.00 0.00 0.00 0.00 60.65 60.21 1tr9 s ILE 59 Cb -0.17 -1.55 -0.05 0.00 0.01 0.00 0.00 42.46 40.70 1tr9 s ILE 59 CO 0.17 0.48 -0.02 -0.83 0.00 0.00 0.00 174.94 174.74 1tr9 s GLY 60 N 0.99 1.56 0.01 6.18 0.00 -0.25 -1.17 107.32 114.63 1tr9 s GLY 60 Ca -0.05 -1.76 -0.25 0.00 0.00 0.00 0.00 44.72 42.65 1tr9 s GLY 60 CO -0.03 -1.69 0.57 0.54 0.00 0.00 0.00 173.10 172.50 1tr9 s VAL 61 N -3.35 0.02 -0.70 1.40 0.11 -0.96 -0.64 120.40 116.28 1tr9 s VAL 61 Ca 0.28 -0.15 -0.24 0.00 -2.93 0.00 0.00 61.98 58.94 1tr9 s VAL 61 Cb 0.05 -0.95 0.06 0.00 -1.53 0.00 0.00 36.38 34.00 1tr9 s VAL 61 CO 0.08 -0.08 1.09 -1.81 -3.33 0.00 0.00 175.10 171.06 1tr9 s ASP 62 N -1.68 6.18 -0.44 3.54 1.01 -1.26 -1.25 116.67 122.78 1tr9 s ASP 62 Ca -0.08 -0.82 0.02 0.00 0.71 0.00 0.00 52.55 52.38 1tr9 s ASP 62 Cb -0.01 -2.47 0.15 0.00 1.01 0.00 0.00 42.92 41.60 1tr9 s ASP 62 CO 0.02 -1.58 0.29 -1.58 0.21 0.00 0.00 175.17 172.53 1tr9 s GLN 63 N 4.67 1.13 -0.16 8.23 2.00 -1.26 -3.33 119.66 130.94 1tr9 s GLN 63 Ca 0.27 -2.03 0.18 0.00 -2.00 0.00 0.00 55.36 51.78 1tr9 s GLN 63 Cb -0.13 -1.94 -0.25 0.00 0.80 0.00 0.00 33.01 31.49 1tr9 s GLN 63 CO 0.11 -1.26 0.19 0.39 -0.50 0.00 0.00 175.29 174.23 1tr9 n GLU 64 N 3.27 0.68 0.00 1.67 1.02 0.13 -4.83 120.64 122.58 1tr9 n GLU 64 Ca 0.17 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.32 1tr9 n GLU 64 Cb 0.39 -1.56 0.00 0.00 -0.02 0.00 0.00 31.44 30.26 1tr9 n GLU 64 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1tr9 n GLY 65 N 1.67 2.19 7.00 0.62 0.00 0.02 -4.69 105.19 112.01 1tr9 n GLY 65 Ca -0.28 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 43.78 1tr9 n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tr9 n GLY 66 N 1.22 3.63 0.19 -0.02 0.00 0.40 -2.21 105.19 108.40 1tr9 n GLY 66 Ca 0.00 -0.05 0.14 0.00 0.00 0.00 0.00 46.02 46.11 1tr9 n GLY 66 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1tr9 h ARG 67 N 0.00 0.00 -3.37 1.61 3.08 -1.92 -3.36 114.38 110.43 1tr9 h ARG 67 Ca 0.00 0.00 -0.65 0.00 0.07 0.00 0.00 59.98 59.40 1tr9 h ARG 67 Cb 0.00 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 29.65 1tr9 h ARG 67 CO 0.00 0.00 -0.57 0.08 -1.07 0.00 0.00 179.97 178.41 1tr9 s VAL 68 N -3.39 2.84 -0.29 2.04 1.01 -0.94 -4.98 120.40 116.69 1tr9 s VAL 68 Ca 0.05 -3.40 -0.01 0.00 0.00 0.00 0.00 61.98 58.62 1tr9 s VAL 68 Cb 0.09 -2.93 0.13 0.00 0.00 0.00 0.00 36.38 33.67 1tr9 s VAL 68 CO 0.52 -0.84 0.28 -1.58 0.00 0.00 0.00 175.10 173.48 1tr9 s GLN 69 N -0.43 0.32 0.25 2.72 0.74 -1.26 -0.69 119.66 121.31 1tr9 s GLN 69 Ca 0.18 -0.18 -0.02 0.00 0.05 0.00 0.00 55.36 55.39 1tr9 s GLN 69 Cb -0.22 -0.69 0.31 0.00 1.10 0.00 0.00 33.01 33.50 1tr9 s GLN 69 CO -0.03 -1.03 1.71 0.00 -0.55 0.00 0.00 175.29 175.39 1tr9 h ARG 70 N 8.25 0.70 -4.54 1.67 2.47 -1.93 -3.40 114.38 117.61 1tr9 h ARG 70 Ca -0.13 -0.24 -0.70 0.00 -1.26 0.00 0.00 59.98 57.64 1tr9 h ARG 70 Cb 1.07 -0.06 -0.29 0.00 -1.65 0.00 0.00 29.97 29.04 1tr9 h ARG 70 CO 0.34 0.81 -0.53 -0.06 0.56 0.00 0.00 179.97 181.09 1tr9 s PHE 71 N -4.73 3.35 0.01 3.04 2.99 -1.26 -4.60 117.98 116.78 1tr9 s PHE 71 Ca -0.09 -1.67 -0.04 0.00 0.00 0.00 0.00 56.93 55.14 1tr9 s PHE 71 Cb 0.14 -2.76 -0.02 0.00 0.00 0.00 0.00 43.02 40.38 1tr9 s PHE 71 CO 0.81 -0.83 -0.08 0.54 -0.00 0.00 0.00 175.22 175.66 1tr9 n ARG 72 N 4.82 0.13 -1.72 0.44 1.74 -1.26 -4.72 116.66 116.08 1tr9 n ARG 72 Ca -0.10 0.05 -0.42 0.00 -0.77 0.00 0.00 57.85 56.61 1tr9 n ARG 72 Cb 0.43 -0.72 -0.03 0.00 -1.02 0.00 0.00 32.46 31.12 1tr9 n ARG 72 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1tr9 s GLU 73 N -2.19 4.04 0.00 5.56 2.02 -1.26 -1.47 118.70 125.40 1tr9 s GLU 73 Ca -0.07 2.48 0.00 0.00 0.02 0.00 0.00 54.97 57.40 1tr9 s GLU 73 Cb 0.02 -4.16 0.00 0.00 0.10 0.00 0.00 34.13 30.09 1tr9 s GLU 73 CO 0.11 -1.06 0.00 0.41 0.02 0.00 0.00 175.26 174.73 1tr9 n GLY 74 N 4.62 0.94 3.70 -1.39 0.00 -1.26 -4.68 105.19 107.11 1tr9 n GLY 74 Ca 0.21 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.99 1tr9 n GLY 74 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1tr9 s PHE 75 N -2.99 2.83 0.22 1.61 0.40 -0.54 -4.96 117.98 114.55 1tr9 s PHE 75 Ca 0.00 -0.18 -0.30 0.00 -0.60 0.00 0.00 56.93 55.85 1tr9 s PHE 75 Cb 0.00 -1.27 -0.09 0.00 0.51 0.00 0.00 43.02 42.16 1tr9 s PHE 75 CO 0.00 0.58 1.38 -1.12 0.70 0.00 0.00 175.22 176.76 1tr9 s SER 76 N -3.63 6.78 0.08 1.36 0.01 -1.26 -4.90 113.70 112.13 1tr9 s SER 76 Ca 0.31 2.52 -0.31 0.00 1.31 0.00 0.00 55.95 59.79 1tr9 s SER 76 Cb -0.07 -2.61 -0.06 0.00 0.21 0.00 0.00 66.02 63.48 1tr9 s SER 76 CO 0.21 -0.62 1.24 -0.60 0.41 0.00 0.00 173.24 173.88 1tr9 s ARG 77 N -0.14 4.41 -0.15 12.44 6.06 -1.26 -4.99 118.95 135.33 1tr9 s ARG 77 Ca 0.59 1.84 -0.06 0.00 -2.50 0.00 0.00 55.73 55.59 1tr9 s ARG 77 Cb -0.39 -3.32 -0.04 0.00 0.06 0.00 0.00 34.95 31.26 1tr9 s ARG 77 CO 0.40 -0.29 0.05 0.42 -2.50 0.00 0.00 175.30 173.38 1tr9 s ILE 78 N 1.02 4.69 0.88 4.11 -1.09 -1.26 -4.56 121.20 124.99 1tr9 s ILE 78 Ca 0.60 -0.08 -0.12 0.00 -2.23 0.00 0.00 60.65 58.82 1tr9 s ILE 78 Cb -0.31 -3.06 0.12 0.00 -1.58 0.00 0.00 42.46 37.63 1tr9 s ILE 78 CO 0.30 0.52 1.09 -2.16 -1.23 0.00 0.00 174.94 173.46 1tr9 s PRO 79 N -0.15 1.37 0.37 2.79 0.04 -1.26 -0.45 135.00 137.70 1tr9 s PRO 79 Ca 0.07 0.75 -0.27 0.00 0.04 0.00 0.00 61.00 61.59 1tr9 s PRO 79 Cb -0.12 -1.83 -0.11 0.00 0.04 0.00 0.00 34.50 32.48 1tr9 s PRO 79 CO 0.01 -2.15 1.27 -2.30 0.04 0.00 0.00 177.00 173.88 1tr9 n PRO 80 N -3.81 2.04 -0.18 0.56 -0.02 -1.26 -2.95 135.00 129.37 1tr9 n PRO 80 Ca 0.07 0.72 0.19 0.00 -2.02 0.00 0.00 63.50 62.45 1tr9 n PRO 80 Cb 0.56 -2.34 0.55 0.00 -0.02 0.00 0.00 33.50 32.25 1tr9 n PRO 80 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1tr9 h ALA 81 N 2.36 2.27 -0.52 3.55 0.00 -1.78 -1.27 119.26 123.87 1tr9 h ALA 81 Ca -0.47 0.00 0.11 0.00 0.00 0.00 0.00 54.91 54.56 1tr9 h ALA 81 Cb 1.29 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.03 1tr9 h ALA 81 CO 0.61 -0.50 0.36 0.37 0.00 0.00 0.00 179.25 180.09 1tr9 h GLN 82 N 0.33 0.20 -0.05 0.00 4.15 -0.78 -3.09 115.11 115.87 1tr9 h GLN 82 Ca 0.40 -0.01 -0.07 0.00 0.77 0.00 0.00 58.65 59.74 1tr9 h GLN 82 Cb 1.08 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.71 1tr9 h GLN 82 CO -0.12 0.13 -0.30 1.88 -1.93 0.00 0.00 178.83 178.50 1tr9 h TYR 83 N 0.21 0.09 -0.37 3.99 -1.99 -1.52 -3.27 116.97 114.11 1tr9 h TYR 83 Ca 0.25 -0.02 0.04 0.00 2.00 0.00 0.00 58.73 60.99 1tr9 h TYR 83 Cb 0.69 -0.02 -0.04 0.00 2.00 0.00 0.00 36.73 39.36 1tr9 h TYR 83 CO -0.00 0.38 0.16 1.88 -0.00 0.00 0.00 178.16 180.58 1tr9 h TYR 84 N 0.08 0.30 0.00 4.88 -1.99 -1.72 -1.79 116.97 116.72 1tr9 h TYR 84 Ca 0.01 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.76 1tr9 h TYR 84 Cb 0.57 -0.08 0.00 0.00 2.00 0.00 0.00 36.73 39.22 1tr9 h TYR 84 CO 0.00 0.14 0.00 0.00 -0.00 0.00 0.00 178.16 178.31 1tr9 n ALA 85 N -2.31 1.74 0.56 3.88 0.00 -1.23 -2.01 120.51 121.14 1tr9 n ALA 85 Ca 0.01 0.02 0.13 0.00 0.00 0.00 0.00 53.44 53.60 1tr9 n ALA 85 Cb 0.11 -1.34 0.30 0.00 0.00 0.00 0.00 19.45 18.53 1tr9 n ALA 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1tr9 h ARG 86 N 0.00 0.00 -6.86 0.00 3.08 -1.45 -3.47 114.38 105.69 1tr9 h ARG 86 Ca 0.00 0.00 -0.49 0.00 0.07 0.00 0.00 59.98 59.56 1tr9 h ARG 86 Cb 0.35 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.42 1tr9 h ARG 86 CO 0.00 0.00 0.08 0.00 -1.07 0.00 0.00 179.97 178.98 1tr9 s ALA 87 N -3.14 3.42 0.28 0.04 0.00 -0.85 -5.00 121.76 116.51 1tr9 s ALA 87 Ca 0.09 -0.45 0.22 0.00 0.00 0.00 0.00 51.96 51.81 1tr9 s ALA 87 Cb 0.12 -2.57 0.99 0.00 0.00 0.00 0.00 23.12 21.65 1tr9 s ALA 87 CO 0.65 -0.20 1.88 1.05 0.00 0.00 0.00 175.76 179.13 1tr9 h GLU 88 N 0.63 0.00 -1.72 0.00 4.11 -1.90 -3.12 114.58 112.58 1tr9 h GLU 88 Ca -0.47 0.00 -0.58 0.00 0.07 0.00 0.00 59.36 58.38 1tr9 h GLU 88 Cb 1.20 0.00 -0.42 0.00 0.50 0.00 0.00 28.75 30.03 1tr9 h GLU 88 CO 0.63 0.26 -0.74 0.27 0.07 0.00 0.00 179.01 179.50 1tr9 n ASN 89 N -3.63 4.41 -0.29 3.06 2.04 -1.26 -4.91 115.26 114.68 1tr9 n ASN 89 Ca -0.01 -3.65 0.02 0.00 -0.44 0.00 0.00 54.58 50.51 1tr9 n ASN 89 Cb 0.39 -0.49 0.23 0.00 -2.53 0.00 0.00 39.78 37.37 1tr9 n ASN 89 CO 0.00 0.00 0.00 1.23 -0.44 0.00 0.00 177.26 178.05 1tr9 h GLY 90 N 2.72 1.25 0.99 4.83 0.00 -1.61 -1.45 103.07 109.79 1tr9 h GLY 90 Ca 0.23 -0.42 -0.10 0.00 0.00 0.00 0.00 47.33 47.03 1tr9 h GLY 90 CO 0.82 0.35 -0.18 -2.08 0.00 0.00 0.00 176.54 175.45 1tr9 h VAL 91 N 1.06 1.28 -0.28 4.60 2.07 -1.91 0.13 116.25 123.21 1tr9 h VAL 91 Ca 0.35 -1.31 0.01 0.00 0.82 0.00 0.00 66.70 66.57 1tr9 h VAL 91 Cb 0.06 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 1tr9 h VAL 91 CO -0.11 0.43 0.18 -0.08 0.02 0.00 0.00 177.57 178.01 1tr9 h GLU 92 N 0.56 0.35 -0.13 1.57 4.81 -1.91 -2.54 114.58 117.30 1tr9 h GLU 92 Ca 0.08 -0.02 -0.15 0.00 -0.13 0.00 0.00 59.36 59.14 1tr9 h GLU 92 Cb 0.73 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.02 1tr9 h GLU 92 CO 0.05 0.23 -0.55 -0.07 -0.73 0.00 0.00 179.01 177.95 1tr9 h LEU 93 N 0.36 0.43 -0.65 1.64 3.38 -1.09 -2.56 115.31 116.83 1tr9 h LEU 93 Ca 0.11 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 1tr9 h LEU 93 Cb -0.03 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1tr9 h LEU 93 CO -0.04 0.89 0.12 0.00 0.09 0.00 0.00 178.44 179.51 1tr9 h ALA 94 N 1.11 0.86 -0.77 1.53 0.00 -0.64 0.18 119.26 121.54 1tr9 h ALA 94 Ca 0.01 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 1tr9 h ALA 94 Cb 1.05 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 1tr9 h ALA 94 CO 0.09 0.61 0.37 1.49 0.00 0.00 0.00 179.25 181.81 1tr9 h GLU 95 N 0.99 1.11 -0.80 0.00 4.22 -1.38 -1.37 114.58 117.35 1tr9 h GLU 95 Ca 0.20 -0.17 -0.01 0.00 0.08 0.00 0.00 59.36 59.46 1tr9 h GLU 95 Cb 0.41 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.43 1tr9 h GLU 95 CO 0.01 0.87 0.44 1.96 -2.18 0.00 0.00 179.01 180.11 1tr9 h GLN 96 N 1.09 1.11 -0.36 1.92 4.20 -1.01 -1.06 115.11 120.99 1tr9 h GLN 96 Ca 0.26 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.83 1tr9 h GLN 96 Cb 0.13 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 1tr9 h GLN 96 CO -0.03 0.82 0.17 0.78 -0.67 0.00 0.00 178.83 179.90 1tr9 h GLY 97 N 1.11 0.56 0.96 3.46 0.00 -0.64 0.25 103.07 108.77 1tr9 h GLY 97 Ca 0.28 -0.28 -0.06 0.00 0.00 0.00 0.00 47.33 47.27 1tr9 h GLY 97 CO -0.05 0.26 0.02 -1.33 0.00 0.00 0.00 176.54 175.45 1tr9 h GLY 98 N 0.45 0.78 0.91 4.60 0.00 -1.12 -3.10 103.07 105.59 1tr9 h GLY 98 Ca 0.12 -0.56 -0.02 0.00 0.00 0.00 0.00 47.33 46.88 1tr9 h GLY 98 CO -0.02 0.51 0.10 -0.25 0.00 0.00 0.00 176.54 176.89 1tr9 h TRP 99 N 0.57 0.41 0.00 5.60 7.01 -1.14 -1.88 115.95 126.52 1tr9 h TRP 99 Ca 0.12 -0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.09 1tr9 h TRP 99 Cb 0.45 -0.12 0.00 0.00 -2.10 0.00 0.00 29.16 27.38 1tr9 h TRP 99 CO 0.03 0.43 0.00 -0.11 -2.79 0.00 0.00 178.44 176.00 1tr9 n LEU 100 N -4.76 0.42 0.00 0.65 7.94 0.07 -0.56 117.00 120.76 1tr9 n LEU 100 Ca -0.03 -0.21 0.00 0.00 -1.11 0.00 0.00 56.01 54.66 1tr9 n LEU 100 Cb 0.14 -0.14 0.00 0.00 0.53 0.00 0.00 43.42 43.95 1tr9 n LEU 100 CO 0.36 0.09 0.00 0.00 -1.11 0.00 0.00 177.39 176.73 1tr9 n ALA 102 N 0.50 0.00 -0.22 1.96 0.00 -0.71 -1.55 120.51 120.49 1tr9 n ALA 102 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 1tr9 n ALA 102 Cb 0.09 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.58 1tr9 n ALA 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1tr9 h ALA 103 N 0.00 0.78 -0.28 0.00 0.00 -1.07 -0.84 119.26 117.84 1tr9 h ALA 103 Ca 0.00 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1tr9 h ALA 103 Cb 0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1tr9 h ALA 103 CO 0.00 0.23 -0.18 0.93 0.00 0.00 0.00 179.25 180.22 1tr9 h GLU 104 N 0.83 0.51 -0.33 0.00 5.08 -1.52 -0.58 114.58 118.57 1tr9 h GLU 104 Ca 0.22 -0.17 -0.05 0.00 -1.00 0.00 0.00 59.36 58.36 1tr9 h GLU 104 Cb -0.07 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1tr9 h GLU 104 CO -0.05 0.67 0.01 -0.07 -1.00 0.00 0.00 179.01 178.58 1tr9 h LEU 105 N 0.46 0.57 -1.08 1.33 3.38 -1.70 -2.95 115.31 115.31 1tr9 h LEU 105 Ca 0.08 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 1tr9 h LEU 105 Cb 0.58 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 1tr9 h LEU 105 CO 0.04 0.73 0.32 0.40 0.09 0.00 0.00 178.44 180.02 1tr9 h ILE 106 N 0.39 1.22 0.00 1.22 2.04 -0.91 -0.74 117.51 120.74 1tr9 h ILE 106 Ca 0.10 -0.63 0.00 0.00 1.00 0.00 0.00 64.86 65.33 1tr9 h ILE 106 Cb 0.43 0.36 0.00 0.00 -0.74 0.00 0.00 36.82 36.87 1tr9 h ILE 106 CO 0.02 0.26 0.00 0.00 0.00 0.00 0.00 178.15 178.43 1tr9 h ALA 107 N 1.39 1.00 -0.28 1.87 0.00 -1.00 -1.91 119.26 120.33 1tr9 h ALA 107 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1tr9 h ALA 107 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1tr9 h ALA 107 CO -0.03 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.94 1tr9 n HIS 108 N -2.89 0.97 -2.49 0.00 8.25 -0.35 -4.09 115.22 114.61 1tr9 n HIS 108 Ca -0.01 -0.85 -0.11 0.00 -0.26 0.00 0.00 57.72 56.49 1tr9 n HIS 108 Cb 0.17 -0.31 0.01 0.00 1.12 0.00 0.00 29.99 30.98 1tr9 n HIS 108 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1tr9 n ASP 109 N -0.40 -3.70 -4.72 0.41 4.64 -0.72 -4.51 116.55 107.56 1tr9 n ASP 109 Ca 0.21 -0.10 -0.35 0.00 -1.38 0.00 0.00 54.79 53.17 1tr9 n ASP 109 Cb 0.88 -2.71 -0.08 0.00 -1.04 0.00 0.00 41.12 38.16 1tr9 n ASP 109 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 1tr9 s VAL 110 N -2.74 4.94 0.02 5.18 1.01 -0.77 -4.91 120.40 123.13 1tr9 s VAL 110 Ca 0.10 0.01 -0.20 0.00 0.00 0.00 0.00 61.98 61.89 1tr9 s VAL 110 Cb -0.04 -3.18 -0.19 0.00 0.00 0.00 0.00 36.38 32.96 1tr9 s VAL 110 CO 0.12 0.53 1.19 0.44 0.00 0.00 0.00 175.10 177.38 1tr9 h ASP 111 N 5.90 0.47 -5.06 3.32 5.19 -1.46 -3.33 116.42 121.46 1tr9 h ASP 111 Ca -0.45 -0.66 -0.06 0.00 -0.62 0.00 0.00 57.03 55.24 1tr9 h ASP 111 Cb 1.19 -0.14 -0.15 0.00 0.18 0.00 0.00 39.33 40.41 1tr9 h ASP 111 CO 0.64 1.06 -0.07 -1.48 -3.12 0.00 0.00 179.24 176.27 1tr9 s LEU 112 N -8.63 0.35 -0.06 1.55 0.05 -1.01 -4.41 118.68 106.53 1tr9 s LEU 112 Ca -0.14 -0.16 0.02 0.00 0.05 0.00 0.00 54.13 53.90 1tr9 s LEU 112 Cb 0.04 1.83 -0.03 0.00 -2.05 0.00 0.00 46.19 45.99 1tr9 s LEU 112 CO 0.79 -0.77 -0.09 -0.55 -0.55 0.00 0.00 176.35 175.17 1tr9 s SER 113 N -2.44 4.43 -1.10 1.48 0.15 -1.26 -2.25 113.70 112.70 1tr9 s SER 113 Ca -0.01 -0.08 -0.22 0.00 0.70 0.00 0.00 55.95 56.34 1tr9 s SER 113 Cb 0.01 -1.06 0.02 0.00 -1.71 0.00 0.00 66.02 63.28 1tr9 s SER 113 CO -0.08 0.36 1.70 -0.36 1.20 0.00 0.00 173.24 176.06 1tr9 s PHE 114 N -0.78 2.38 -0.08 3.44 0.40 -0.38 -4.59 117.98 118.37 1tr9 s PHE 114 Ca 0.12 -0.60 -0.30 0.00 -0.60 0.00 0.00 56.93 55.55 1tr9 s PHE 114 Cb -0.11 -4.49 0.08 0.00 0.51 0.00 0.00 43.02 39.01 1tr9 s PHE 114 CO 0.01 -1.76 0.73 0.00 0.70 0.00 0.00 175.22 174.90 1tr9 s ALA 115 N 6.61 -1.79 0.33 5.36 0.00 -1.21 -4.62 121.76 126.44 1tr9 s ALA 115 Ca 0.56 1.40 0.07 0.00 0.00 0.00 0.00 51.96 53.99 1tr9 s ALA 115 Cb -0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 23.12 22.92 1tr9 s ALA 115 CO 0.00 -0.36 0.28 -1.25 0.00 0.00 0.00 175.76 174.43 1tr9 s PRO 116 N -1.08 2.72 -0.01 0.00 0.04 -0.80 -1.73 135.00 134.14 1tr9 s PRO 116 Ca -0.09 -1.29 -0.30 0.00 0.04 0.00 0.00 61.00 59.36 1tr9 s PRO 116 Cb -0.00 -2.47 -0.05 0.00 0.04 0.00 0.00 34.50 32.02 1tr9 s PRO 116 CO 0.08 0.12 1.30 0.08 0.04 0.00 0.00 177.00 178.62 1tr9 s VAL 117 N -2.30 3.94 -0.77 -0.36 1.01 -1.26 -2.37 120.40 118.29 1tr9 s VAL 117 Ca 0.40 1.32 0.08 0.00 0.00 0.00 0.00 61.98 63.78 1tr9 s VAL 117 Cb -0.06 -3.85 0.22 0.00 0.00 0.00 0.00 36.38 32.70 1tr9 s VAL 117 CO 0.26 0.01 1.15 0.18 0.00 0.00 0.00 175.10 176.71 1tr9 n LEU 118 N 5.14 2.62 0.00 3.92 4.77 0.21 -4.58 117.00 129.08 1tr9 n LEU 118 Ca 0.12 -1.89 0.00 0.00 -0.03 0.00 0.00 56.01 54.21 1tr9 n LEU 118 Cb 0.45 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 1tr9 n LEU 118 CO 0.57 0.65 0.00 0.47 -1.33 0.00 0.00 177.39 177.74 1tr9 n ASP 119 N 0.32 0.00 -0.43 -1.43 8.00 -1.22 -4.84 116.55 116.96 1tr9 n ASP 119 Ca 0.09 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.59 1tr9 n ASP 119 Cb 0.37 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.47 1tr9 n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1tr9 n GLY 121 N 1.37 0.00 0.34 0.44 0.00 -0.26 -4.44 105.19 102.65 1tr9 n GLY 121 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 1tr9 n GLY 121 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1tr9 n PHE 122 N -2.31 0.00 0.22 1.61 0.99 -1.26 -4.56 117.46 112.15 1tr9 n PHE 122 Ca 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 57.45 57.55 1tr9 n PHE 122 Cb 0.12 0.00 0.37 0.00 -1.00 0.00 0.00 39.48 38.97 1tr9 n PHE 122 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1tr9 h ALA 123 N 1.75 0.95 -2.00 4.37 0.00 -1.89 -3.31 119.26 119.13 1tr9 h ALA 123 Ca 0.00 -0.17 -0.58 0.00 0.00 0.00 0.00 54.91 54.16 1tr9 h ALA 123 Cb 0.37 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.06 1tr9 h ALA 123 CO 0.00 0.24 0.77 0.00 0.00 0.00 0.00 179.25 180.26 1tr9 h LYS 125 N 8.12 0.60 -0.09 0.00 1.57 -1.87 0.30 116.57 125.20 1tr9 h LYS 125 Ca -0.21 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.50 1tr9 h LYS 125 Cb 1.07 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 33.23 1tr9 h LYS 125 CO 1.01 0.40 -0.10 0.00 -0.57 0.00 0.00 179.45 180.19 1tr9 h ALA 126 N 1.60 1.68 0.00 3.86 0.00 -1.94 -3.33 119.26 121.13 1tr9 h ALA 126 Ca 0.51 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1tr9 h ALA 126 Cb 0.78 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1tr9 h ALA 126 CO -0.39 0.24 -0.07 -0.89 0.00 0.00 0.00 179.25 178.14 1tr9 n ILE 127 N -4.35 0.16 0.00 0.00 2.08 -0.16 -4.95 119.36 112.15 1tr9 n ILE 127 Ca -0.01 0.47 0.00 0.00 0.56 0.00 0.00 62.75 63.76 1tr9 n ILE 127 Cb 0.21 -1.60 0.00 0.00 -0.75 0.00 0.00 39.64 37.51 1tr9 n ILE 127 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1tr9 n GLY 128 N 1.67 3.39 0.00 7.39 0.00 0.89 -1.51 105.19 117.03 1tr9 n GLY 128 Ca -0.01 -0.03 0.04 0.00 0.00 0.00 0.00 46.02 46.02 1tr9 n GLY 128 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1tr9 n ASN 129 N 4.36 0.00 0.15 1.61 0.23 -1.26 -2.28 115.26 118.07 1tr9 n ASN 129 Ca 0.00 -1.42 0.13 0.00 -0.53 0.00 0.00 54.58 52.76 1tr9 n ASN 129 Cb 0.00 0.00 0.50 0.00 -2.08 0.00 0.00 39.78 38.20 1tr9 n ASN 129 CO 0.00 0.00 0.00 0.03 -0.93 0.00 0.00 177.26 176.36 1tr9 h ARG 130 N 0.00 0.00 -6.66 -3.83 3.08 -1.64 -2.15 114.38 103.19 1tr9 h ARG 130 Ca 0.00 0.00 -0.50 0.00 0.07 0.00 0.00 59.98 59.55 1tr9 h ARG 130 Cb 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 1tr9 h ARG 130 CO 0.00 0.00 0.13 0.00 -1.07 0.00 0.00 179.97 179.03 1tr9 s ALA 131 N -3.32 3.35 -0.17 0.04 0.00 -0.96 -4.56 121.76 116.13 1tr9 s ALA 131 Ca 0.05 0.16 0.28 0.00 0.00 0.00 0.00 51.96 52.44 1tr9 s ALA 131 Cb 0.10 -2.84 0.81 0.00 0.00 0.00 0.00 23.12 21.19 1tr9 s ALA 131 CO 0.45 0.31 1.78 0.74 0.00 0.00 0.00 175.76 179.05 1tr9 h PHE 132 N 2.95 0.00 -2.01 0.00 -1.00 -1.79 -2.30 116.94 112.79 1tr9 h PHE 132 Ca -0.48 0.00 0.32 0.00 2.81 0.00 0.00 57.97 60.62 1tr9 h PHE 132 Cb 1.19 0.00 -0.06 0.00 3.61 0.00 0.00 35.95 40.69 1tr9 h PHE 132 CO 0.63 0.02 0.82 0.41 -1.61 0.00 0.00 178.31 178.58 1tr9 n GLY 133 N 0.60 0.24 0.38 -1.45 0.00 -1.26 -4.60 105.19 99.09 1tr9 n GLY 133 Ca 0.02 -1.02 0.06 0.00 0.00 0.00 0.00 46.02 45.09 1tr9 n GLY 133 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1tr9 n GLU 134 N -0.83 1.47 -4.19 1.61 1.02 -1.26 -1.10 120.64 117.36 1tr9 n GLU 134 Ca 0.04 -0.93 -0.11 0.00 -0.02 0.00 0.00 57.16 56.14 1tr9 n GLU 134 Cb 0.51 -1.20 -0.10 0.00 -0.02 0.00 0.00 31.44 30.64 1tr9 n GLU 134 CO 0.00 0.00 0.00 0.16 1.18 0.00 0.00 177.13 178.47 1tr9 s ASP 135 N -1.37 0.57 0.13 1.62 -4.77 -1.26 -4.47 116.67 107.12 1tr9 s ASP 135 Ca 0.12 -1.24 -0.18 0.00 -3.30 0.00 0.00 52.55 47.95 1tr9 s ASP 135 Cb 0.10 0.25 -0.03 0.00 -1.09 0.00 0.00 42.92 42.16 1tr9 s ASP 135 CO 0.25 -0.71 1.78 0.58 0.70 0.00 0.00 175.17 177.77 1tr9 h VAL 136 N 2.75 1.03 -0.37 2.11 2.07 -1.95 -1.83 116.25 120.07 1tr9 h VAL 136 Ca -0.36 -0.11 -0.04 0.00 0.82 0.00 0.00 66.70 67.01 1tr9 h VAL 136 Cb 1.21 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 1tr9 h VAL 136 CO 0.59 0.06 0.08 -0.61 0.02 0.00 0.00 177.57 177.71 1tr9 h GLN 137 N 0.33 0.60 -0.65 1.57 5.75 -1.99 -0.38 115.11 120.34 1tr9 h GLN 137 Ca 0.11 -0.15 -0.03 0.00 -0.15 0.00 0.00 58.65 58.42 1tr9 h GLN 137 Cb -0.00 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 28.44 1tr9 h GLN 137 CO -0.05 0.65 0.28 1.15 -2.65 0.00 0.00 178.83 178.21 1tr9 h THR 138 N 0.45 1.23 -0.11 2.39 2.02 -1.93 0.07 112.91 117.02 1tr9 h THR 138 Ca 0.11 -0.69 -0.02 0.00 0.77 0.00 0.00 66.41 66.59 1tr9 h THR 138 Cb 0.33 0.48 -0.00 0.00 -1.74 0.00 0.00 68.15 67.21 1tr9 h THR 138 CO 0.00 0.28 0.01 0.58 0.37 0.00 0.00 175.52 176.76 1tr9 h VAL 139 N 0.90 1.24 -0.47 3.16 2.07 -1.13 -2.79 116.25 119.23 1tr9 h VAL 139 Ca 0.22 -0.75 -0.00 0.00 0.82 0.00 0.00 66.70 66.99 1tr9 h VAL 139 Cb 0.17 1.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.44 1tr9 h VAL 139 CO -0.02 0.21 0.29 -0.07 0.02 0.00 0.00 177.57 178.00 1tr9 h LEU 140 N -0.07 0.56 -0.24 2.57 3.38 -0.88 -0.46 115.31 120.16 1tr9 h LEU 140 Ca 0.03 -0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.00 1tr9 h LEU 140 Cb 0.33 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 1tr9 h LEU 140 CO 0.00 0.44 -0.06 0.50 0.09 0.00 0.00 178.44 179.42 1tr9 h LYS 141 N 0.62 0.01 0.04 1.13 3.64 -0.98 -1.08 116.57 119.95 1tr9 h LYS 141 Ca 0.17 -0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 59.26 1tr9 h LYS 141 Cb -0.01 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 1tr9 h LYS 141 CO -0.03 0.00 -1.61 0.45 -2.27 0.00 0.00 179.45 175.99 1tr9 h HIS 142 N 0.01 0.16 -0.15 1.91 3.86 -1.41 -3.03 115.15 116.49 1tr9 h HIS 142 Ca 0.12 -0.12 -0.16 0.00 -1.16 0.00 0.00 60.37 59.06 1tr9 h HIS 142 Cb 0.18 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 28.63 1tr9 h HIS 142 CO -0.24 1.19 -0.56 0.66 0.86 0.00 0.00 177.93 179.83 1tr9 h SER 143 N 0.02 0.52 -0.84 2.45 4.64 -1.12 -2.17 113.55 117.05 1tr9 h SER 143 Ca -0.26 -0.28 -0.00 0.00 -0.47 0.00 0.00 61.79 60.78 1tr9 h SER 143 Cb 1.98 -0.15 -0.04 0.00 -0.31 0.00 0.00 62.40 63.88 1tr9 h SER 143 CO 0.10 0.97 0.52 0.28 -0.87 0.00 0.00 176.83 177.83 1tr9 h SER 144 N 0.35 1.00 -0.28 4.97 0.02 -1.26 0.28 113.55 118.64 1tr9 h SER 144 Ca 0.00 -0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 1tr9 h SER 144 Cb 1.09 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.36 1tr9 h SER 144 CO 0.10 0.76 0.08 0.00 -1.14 0.00 0.00 176.83 176.63 1tr9 h ALA 145 N 1.28 0.37 -0.57 3.77 0.00 -1.39 -0.61 119.26 122.11 1tr9 h ALA 145 Ca 0.30 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1tr9 h ALA 145 Cb -0.06 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1tr9 h ALA 145 CO -0.06 0.01 0.35 0.35 0.00 0.00 0.00 179.25 179.91 1tr9 h PHE 146 N 0.29 0.73 -0.72 0.00 3.57 -1.12 -2.04 116.94 117.65 1tr9 h PHE 146 Ca 0.09 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.61 1tr9 h PHE 146 Cb 0.26 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 38.72 1tr9 h PHE 146 CO 0.01 0.49 0.46 -0.07 -2.23 0.00 0.00 178.31 176.97 1tr9 h LEU 147 N 0.76 0.78 -1.07 0.59 3.38 -0.76 -2.37 115.31 116.62 1tr9 h LEU 147 Ca 0.20 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.22 1tr9 h LEU 147 Cb -0.04 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 40.47 1tr9 h LEU 147 CO -0.04 0.55 0.62 0.03 0.09 0.00 0.00 178.44 179.69 1tr9 h ARG 148 N 0.92 1.10 -0.58 1.13 3.08 -0.61 -0.86 114.38 118.56 1tr9 h ARG 148 Ca 0.28 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.26 1tr9 h ARG 148 Cb -0.04 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 29.76 1tr9 h ARG 148 CO -0.09 0.73 0.00 0.41 -1.07 0.00 0.00 179.97 179.95 1tr9 n GLY 149 N -1.38 0.41 0.82 0.04 0.00 -0.81 -1.03 105.19 103.24 1tr9 n GLY 149 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1tr9 n GLY 149 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1tr9 n LYS 151 N 0.48 0.00 0.01 1.61 4.81 -0.33 -3.39 118.16 121.35 1tr9 n LYS 151 Ca 0.00 0.00 0.13 0.00 -0.87 0.00 0.00 58.31 57.57 1tr9 n LYS 151 Cb 0.08 0.00 0.57 0.00 0.02 0.00 0.00 35.03 35.69 1tr9 n LYS 151 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1tr9 h ALA 152 N 0.00 2.11 -0.37 3.14 0.00 -1.33 -1.08 119.26 121.73 1tr9 h ALA 152 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1tr9 h ALA 152 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1tr9 h ALA 152 CO 0.00 -0.21 0.00 1.33 0.00 0.00 0.00 179.25 180.37 1tr9 n VAL 153 N -4.46 0.48 -0.77 0.00 0.24 -1.22 -5.14 118.33 107.47 1tr9 n VAL 153 Ca 0.07 -0.74 0.00 0.00 -2.04 0.00 0.00 64.34 61.63 1tr9 n VAL 153 Cb 0.35 1.02 0.00 0.00 -1.47 0.00 0.00 33.84 33.75 1tr9 n VAL 153 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1tr9 n GLY 154 N 1.51 -1.52 3.21 7.63 0.00 -0.41 -4.32 105.19 111.28 1tr9 n GLY 154 Ca 0.19 -0.51 -0.23 0.00 0.00 0.00 0.00 46.02 45.47 1tr9 n GLY 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tr9 s ALA 156 N 0.00 1.51 0.08 4.61 0.00 -1.26 -1.37 121.76 125.32 1tr9 s ALA 156 Ca 0.00 -0.98 0.03 0.00 0.00 0.00 0.00 51.96 51.02 1tr9 s ALA 156 Cb 0.00 -0.26 -0.04 0.00 0.00 0.00 0.00 23.12 22.82 1tr9 s ALA 156 CO 0.00 0.32 0.05 0.95 0.00 0.00 0.00 175.76 177.08 1tr9 s THR 157 N -0.86 4.38 -0.19 0.00 -4.23 -1.26 -4.68 115.64 108.80 1tr9 s THR 157 Ca 0.05 -0.82 -0.03 0.00 -1.18 0.00 0.00 61.69 59.71 1tr9 s THR 157 Cb -0.09 -3.10 0.06 0.00 1.34 0.00 0.00 72.50 70.72 1tr9 s THR 157 CO 0.02 0.13 0.05 -0.89 -0.54 0.00 0.00 174.62 173.39 1tr9 s THR 158 N -1.36 0.43 0.26 3.99 2.01 -0.70 -0.82 115.64 119.45 1tr9 s THR 158 Ca 0.28 -0.51 -0.29 0.00 0.31 0.00 0.00 61.69 61.47 1tr9 s THR 158 Cb -0.12 -0.97 -0.09 0.00 0.01 0.00 0.00 72.50 71.33 1tr9 s THR 158 CO 0.21 -0.23 0.97 -0.83 -0.69 0.00 0.00 174.62 174.04 1tr9 s GLY 159 N 1.90 3.07 0.09 4.40 0.00 -0.74 -1.91 107.32 114.13 1tr9 s GLY 159 Ca -0.00 0.66 -0.13 0.00 0.00 0.00 0.00 44.72 45.25 1tr9 s GLY 159 CO -0.09 1.22 0.29 -1.59 0.00 0.00 0.00 173.10 172.94 1tr9 s LYS 160 N -1.33 0.92 -0.38 2.90 -2.85 -1.00 -4.62 119.74 113.38 1tr9 s LYS 160 Ca 0.43 -0.76 -0.05 0.00 -1.00 0.00 0.00 55.97 54.58 1tr9 s LYS 160 Cb -0.26 0.39 0.07 0.00 -2.06 0.00 0.00 37.83 35.97 1tr9 s LYS 160 CO 0.33 -0.32 0.16 -1.01 0.10 0.00 0.00 175.35 174.61 1tr9 s HIS 161 N -3.53 3.38 0.21 1.78 0.09 -1.26 0.66 115.29 116.61 1tr9 s HIS 161 Ca 0.02 -1.83 -0.31 0.00 -0.00 0.00 0.00 55.06 52.93 1tr9 s HIS 161 Cb 0.02 -2.73 -0.11 0.00 -0.00 0.00 0.00 32.58 29.77 1tr9 s HIS 161 CO -0.10 -0.85 1.60 0.12 -0.00 0.00 0.00 174.74 175.51 1tr9 s PHE 162 N 1.30 2.97 -0.93 1.40 5.36 -1.26 -0.28 117.98 126.54 1tr9 s PHE 162 Ca 0.02 0.62 0.17 0.00 -0.96 0.00 0.00 56.93 56.78 1tr9 s PHE 162 Cb -0.22 -3.99 0.69 0.00 -0.34 0.00 0.00 43.02 39.16 1tr9 s PHE 162 CO -0.00 -3.60 1.60 -0.35 -1.46 0.00 0.00 175.22 171.41 1tr9 n PRO 163 N 3.52 3.74 0.00 10.12 -0.04 -1.26 -0.16 135.00 150.92 1tr9 n PRO 163 Ca 0.13 -2.86 0.00 0.00 -0.04 0.00 0.00 63.50 60.72 1tr9 n PRO 163 Cb 0.38 -1.89 0.00 0.00 -0.04 0.00 0.00 33.50 31.95 1tr9 n PRO 163 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1tr9 n GLY 164 N 0.88 3.51 0.93 0.55 0.00 0.61 -4.84 105.19 106.83 1tr9 n GLY 164 Ca 0.25 -0.44 0.10 0.00 0.00 0.00 0.00 46.02 45.92 1tr9 n GLY 164 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1tr9 n HIS 165 N 0.00 0.39 0.25 1.61 -0.00 -1.22 -4.68 115.22 111.56 1tr9 n HIS 165 Ca 0.00 -0.24 0.10 0.00 0.46 0.00 0.00 57.72 58.04 1tr9 n HIS 165 Cb 0.00 -0.00 0.64 0.00 -0.12 0.00 0.00 29.99 30.51 1tr9 n HIS 165 CO 0.00 0.00 0.00 0.78 0.46 0.00 0.00 176.34 177.58 1tr9 h GLY 166 N 3.62 0.00 -0.61 1.57 0.00 -1.90 -3.14 103.07 102.60 1tr9 h GLY 166 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1tr9 h GLY 166 CO 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 176.54 176.24 1tr9 n ALA 167 N -2.37 3.02 -1.77 3.60 0.00 -1.26 -3.59 120.51 118.14 1tr9 n ALA 167 Ca -0.02 -2.97 -0.40 0.00 0.00 0.00 0.00 53.44 50.05 1tr9 n ALA 167 Cb 0.24 -0.37 -0.04 0.00 0.00 0.00 0.00 19.45 19.27 1tr9 n ALA 167 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1tr9 s VAL 168 N -2.98 3.53 -0.02 0.00 1.01 -1.19 -4.79 120.40 115.97 1tr9 s VAL 168 Ca 0.35 1.53 0.06 0.00 0.00 0.00 0.00 61.98 63.92 1tr9 s VAL 168 Cb 0.33 -3.98 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 1tr9 s VAL 168 CO -0.03 0.36 -0.18 -0.63 0.00 0.00 0.00 175.10 174.63 1tr9 s ILE 169 N -1.12 2.77 -0.27 2.22 1.01 0.07 -4.71 121.20 121.17 1tr9 s ILE 169 Ca 0.44 -0.94 0.18 0.00 0.00 0.00 0.00 60.65 60.33 1tr9 s ILE 169 Cb -0.32 -2.09 0.49 0.00 0.01 0.00 0.00 42.46 40.56 1tr9 s ILE 169 CO 0.40 0.51 1.14 0.00 0.00 0.00 0.00 174.94 176.99 1tr9 n ALA 170 N 2.11 3.35 -1.27 9.38 0.00 -1.26 -0.84 120.51 131.97 1tr9 n ALA 170 Ca -0.17 -3.07 0.00 0.00 0.00 0.00 0.00 53.44 50.20 1tr9 n ALA 170 Cb 0.52 -0.70 0.00 0.00 0.00 0.00 0.00 19.45 19.27 1tr9 n ALA 170 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1tr9 n ASP 171 N -0.62 0.00 -0.68 0.00 5.68 -1.26 -4.96 116.55 114.71 1tr9 n ASP 171 Ca 0.19 0.00 0.09 0.00 -0.50 0.00 0.00 54.79 54.57 1tr9 n ASP 171 Cb 0.86 0.00 0.30 0.00 -1.14 0.00 0.00 41.12 41.14 1tr9 n ASP 171 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1tr9 n SER 172 N 0.00 2.01 -0.23 -1.12 3.41 -1.26 -4.28 113.62 112.15 1tr9 n SER 172 Ca 0.00 -1.83 -0.04 0.00 -0.26 0.00 0.00 58.87 56.75 1tr9 n SER 172 Cb 0.00 -0.17 0.13 0.00 -0.26 0.00 0.00 64.21 63.91 1tr9 n SER 172 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 1tr9 h HIS 173 N 2.50 1.07 -3.94 7.33 6.17 -1.97 -3.44 115.15 122.86 1tr9 h HIS 173 Ca 0.00 -0.07 -0.27 0.00 0.71 0.00 0.00 60.37 60.74 1tr9 h HIS 173 Cb 0.56 -0.32 -0.15 0.00 2.52 0.00 0.00 27.41 30.01 1tr9 h HIS 173 CO 0.17 0.81 -0.65 -0.51 0.71 0.00 0.00 177.93 178.46 1tr9 s LEU 174 N -9.62 1.92 0.00 0.26 1.43 -1.26 -5.06 118.68 106.34 1tr9 s LEU 174 Ca -0.11 -1.22 0.27 0.00 -1.03 0.00 0.00 54.13 52.03 1tr9 s LEU 174 Cb 0.16 0.05 0.88 0.00 0.03 0.00 0.00 46.19 47.31 1tr9 s LEU 174 CO 0.82 -0.64 1.65 -0.62 0.23 0.00 0.00 176.35 177.79 1tr9 n GLU 175 N -0.25 0.42 -4.38 1.70 1.02 -1.26 -4.80 120.64 113.09 1tr9 n GLU 175 Ca -0.05 -0.20 -0.21 0.00 -0.02 0.00 0.00 57.16 56.68 1tr9 n GLU 175 Cb 0.64 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 30.43 1tr9 n GLU 175 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1tr9 s THR 176 N -2.72 1.31 0.47 2.62 2.01 -1.26 -3.54 115.64 114.53 1tr9 s THR 176 Ca 0.20 -1.16 -0.23 0.00 0.31 0.00 0.00 61.69 60.81 1tr9 s THR 176 Cb 0.19 -1.19 -0.08 0.00 0.01 0.00 0.00 72.50 71.43 1tr9 s THR 176 CO 0.56 0.00 1.14 -2.65 -0.69 0.00 0.00 174.62 172.99 1tr9 n PRO 177 N 1.68 1.52 -3.92 4.92 -0.02 -1.26 -4.76 135.00 133.16 1tr9 n PRO 177 Ca -0.19 0.55 -0.09 0.00 -2.02 0.00 0.00 63.50 61.75 1tr9 n PRO 177 Cb 0.54 -2.26 -0.07 0.00 -0.02 0.00 0.00 33.50 31.69 1tr9 n PRO 177 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1tr9 s TYR 178 N -1.29 0.30 -0.26 6.00 -0.85 -0.02 -1.42 117.35 119.80 1tr9 s TYR 178 Ca 0.66 -0.70 -0.04 0.00 -0.52 0.00 0.00 57.07 56.47 1tr9 s TYR 178 Cb -0.49 -0.08 0.09 0.00 0.38 0.00 0.00 41.96 41.85 1tr9 s TYR 178 CO 0.54 -0.62 0.11 0.34 -1.52 0.00 0.00 175.55 174.41 1tr9 s ASP 179 N -2.92 3.27 0.00 -0.18 -1.08 -0.16 -0.75 116.67 114.85 1tr9 s ASP 179 Ca 0.11 -1.14 0.15 0.00 -0.52 0.00 0.00 52.55 51.16 1tr9 s ASP 179 Cb 0.04 -0.38 0.52 0.00 -1.46 0.00 0.00 42.92 41.64 1tr9 s ASP 179 CO -0.05 -0.41 1.39 -0.62 0.52 0.00 0.00 175.17 176.00 1tr9 n GLU 180 N 5.21 1.71 -1.68 4.34 1.02 -1.26 -3.94 120.64 126.04 1tr9 n GLU 180 Ca -0.06 -1.09 -0.43 0.00 -0.02 0.00 0.00 57.16 55.56 1tr9 n GLU 180 Cb 0.44 -1.31 -0.01 0.00 -0.02 0.00 0.00 31.44 30.53 1tr9 n GLU 180 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1tr9 n ARG 181 N 0.34 2.04 0.20 3.49 1.74 -1.26 -4.79 116.66 118.42 1tr9 n ARG 181 Ca 0.13 0.72 0.04 0.00 -0.77 0.00 0.00 57.85 57.97 1tr9 n ARG 181 Cb 0.29 -2.28 0.43 0.00 -1.02 0.00 0.00 32.46 29.87 1tr9 n ARG 181 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1tr9 h GLU 182 N 2.70 0.00 -3.85 5.56 5.08 -2.00 -3.43 114.58 118.64 1tr9 h GLU 182 Ca -0.45 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 57.63 1tr9 h GLU 182 Cb 1.29 0.00 -0.30 0.00 0.50 0.00 0.00 28.75 30.24 1tr9 h GLU 182 CO 0.64 0.30 -0.73 -0.08 -1.00 0.00 0.00 179.01 178.13 1tr9 s THR 183 N -4.30 0.13 -0.28 1.13 -1.32 -1.26 -4.98 115.64 104.76 1tr9 s THR 183 Ca -0.03 -0.02 0.09 0.00 -1.21 0.00 0.00 61.69 60.52 1tr9 s THR 183 Cb 0.15 -0.15 0.47 0.00 -1.51 0.00 0.00 72.50 71.45 1tr9 s THR 183 CO 0.70 0.06 1.36 2.30 -2.21 0.00 0.00 174.62 176.84 1tr9 n ILE 184 N 3.36 2.49 -0.23 5.08 -5.35 -1.26 -4.86 119.36 118.59 1tr9 n ILE 184 Ca -0.17 -3.23 0.03 0.00 -0.27 0.00 0.00 62.75 59.12 1tr9 n ILE 184 Cb 0.57 -0.50 0.15 0.00 -1.74 0.00 0.00 39.64 38.12 1tr9 n ILE 184 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1tr9 h ALA 185 N 1.28 0.89 -0.19 -1.28 0.00 -1.98 -2.46 119.26 115.53 1tr9 h ALA 185 Ca 0.20 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.22 1tr9 h ALA 185 Cb 1.38 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.31 1tr9 h ALA 185 CO 0.39 -0.27 0.04 1.96 0.00 0.00 0.00 179.25 181.37 1tr9 h GLN 186 N 0.33 0.30 -0.14 0.00 4.20 -2.00 -0.57 115.11 117.24 1tr9 h GLN 186 Ca 0.37 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 59.01 1tr9 h GLN 186 Cb 0.58 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.32 1tr9 h GLN 186 CO -0.42 0.43 0.00 -0.25 -0.67 0.00 0.00 178.83 177.92 1tr9 n ASP 187 N -4.78 0.00 0.00 1.46 9.92 -0.93 -3.17 116.55 119.05 1tr9 n ASP 187 Ca -0.04 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.22 1tr9 n ASP 187 Cb 0.17 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.65 1tr9 n ASP 187 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1tr9 n ALA 189 N 0.47 0.00 -0.03 2.24 0.00 -0.22 -3.78 120.51 119.19 1tr9 n ALA 189 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1tr9 n ALA 189 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 1tr9 n ALA 189 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1tr9 h ILE 190 N 0.00 1.20 -0.48 0.00 2.04 -1.83 -1.44 117.51 116.99 1tr9 h ILE 190 Ca 0.00 -0.61 -0.03 0.00 1.00 0.00 0.00 64.86 65.22 1tr9 h ILE 190 Cb 0.00 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 1tr9 h ILE 190 CO 0.00 0.18 0.19 -0.26 0.00 0.00 0.00 178.15 178.26 1tr9 h PHE 191 N -0.04 0.74 -0.44 1.37 -1.00 -1.89 -2.24 116.94 113.45 1tr9 h PHE 191 Ca 0.03 -0.06 0.06 0.00 2.81 0.00 0.00 57.97 60.81 1tr9 h PHE 191 Cb 0.26 -0.22 -0.05 0.00 3.61 0.00 0.00 35.95 39.54 1tr9 h PHE 191 CO 0.01 0.63 0.14 -0.09 -1.61 0.00 0.00 178.31 177.39 1tr9 h ARG 192 N 0.64 0.30 -0.63 1.51 2.43 -1.88 -0.47 114.38 116.27 1tr9 h ARG 192 Ca 0.16 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.26 1tr9 h ARG 192 Cb 0.20 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.66 1tr9 h ARG 192 CO -0.01 0.20 0.19 0.00 -1.51 0.00 0.00 179.97 178.83 1tr9 h ALA 193 N 1.30 0.83 -0.17 2.80 0.00 -1.10 -0.45 119.26 122.46 1tr9 h ALA 193 Ca 0.21 -0.21 -0.18 0.00 0.00 0.00 0.00 54.91 54.72 1tr9 h ALA 193 Cb 0.21 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1tr9 h ALA 193 CO -0.22 0.51 -0.63 1.96 0.00 0.00 0.00 179.25 180.87 1tr9 h GLN 194 N 0.91 0.61 -0.14 0.00 1.08 -1.11 -1.32 115.11 115.15 1tr9 h GLN 194 Ca 0.20 -0.43 -0.00 0.00 -1.45 0.00 0.00 58.65 56.98 1tr9 h GLN 194 Cb 0.30 0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.79 1tr9 h GLN 194 CO -0.01 1.04 0.08 0.82 -0.95 0.00 0.00 178.83 179.82 1tr9 h ILE 195 N 0.45 1.07 -0.40 2.54 2.04 -0.99 -2.76 117.51 119.47 1tr9 h ILE 195 Ca -0.01 -0.19 -0.04 0.00 1.00 0.00 0.00 64.86 65.62 1tr9 h ILE 195 Cb 1.20 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 38.22 1tr9 h ILE 195 CO 0.12 0.07 0.09 -0.33 0.00 0.00 0.00 178.15 178.10 1tr9 h GLU 196 N 0.14 0.60 0.00 2.37 5.08 -1.00 -1.38 114.58 120.39 1tr9 h GLU 196 Ca 0.05 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1tr9 h GLU 196 Cb 0.04 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1tr9 h GLU 196 CO -0.01 0.55 0.00 0.00 -1.00 0.00 0.00 179.01 178.55 1tr9 h ALA 197 N 1.52 1.00 -0.37 3.43 0.00 -1.15 -3.47 119.26 120.23 1tr9 h ALA 197 Ca 0.13 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 1tr9 h ALA 197 Cb 0.23 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1tr9 h ALA 197 CO -0.00 0.00 -0.08 0.41 0.00 0.00 0.00 179.25 179.58 1tr9 n GLY 198 N 0.11 0.35 0.85 0.00 0.00 -0.52 -4.94 105.19 101.04 1tr9 n GLY 198 Ca 0.02 -0.80 0.09 0.00 0.00 0.00 0.00 46.02 45.33 1tr9 n GLY 198 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1tr9 n VAL 199 N -3.69 0.36 -3.86 1.61 0.24 -1.16 -4.89 118.33 106.93 1tr9 n VAL 199 Ca -0.04 -0.68 -0.35 0.00 -2.04 0.00 0.00 64.34 61.23 1tr9 n VAL 199 Cb 0.41 1.07 -0.14 0.00 -1.47 0.00 0.00 33.84 33.71 1tr9 n VAL 199 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1tr9 s LEU 200 N -1.34 3.07 0.17 1.34 1.43 -1.26 -4.75 118.68 117.34 1tr9 s LEU 200 Ca 0.27 -0.36 0.14 0.00 -1.03 0.00 0.00 54.13 53.15 1tr9 s LEU 200 Cb 0.17 -1.79 -0.06 0.00 0.03 0.00 0.00 46.19 44.54 1tr9 s LEU 200 CO 0.24 -0.03 1.21 0.44 0.23 0.00 0.00 176.35 178.44 1tr9 h ASP 201 N 8.15 0.00 -2.68 2.29 5.19 -1.71 -3.44 116.42 124.22 1tr9 h ASP 201 Ca -0.40 0.00 -0.13 0.00 -0.62 0.00 0.00 57.03 55.88 1tr9 h ASP 201 Cb 1.16 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.64 1tr9 h ASP 201 CO 0.60 0.66 -0.08 0.00 -3.12 0.00 0.00 179.24 177.30 1tr9 n ALA 202 N -2.31 -0.09 -2.61 3.45 0.00 -0.00 -1.76 120.51 117.18 1tr9 n ALA 202 Ca -0.02 -0.71 -0.09 0.00 0.00 0.00 0.00 53.44 52.62 1tr9 n ALA 202 Cb 0.83 0.57 -0.09 0.00 0.00 0.00 0.00 19.45 20.75 1tr9 n ALA 202 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1tr9 s PRO 205 N -2.37 0.59 0.19 0.00 0.04 -1.26 -1.80 135.00 130.40 1tr9 s PRO 205 Ca 0.13 -0.85 -0.30 0.00 0.04 0.00 0.00 61.00 60.02 1tr9 s PRO 205 Cb -0.00 0.23 -0.08 0.00 0.04 0.00 0.00 34.50 34.69 1tr9 s PRO 205 CO 0.09 -0.14 0.96 0.00 0.04 0.00 0.00 177.00 177.95 1tr9 s ALA 206 N -2.87 3.31 -1.34 8.56 0.00 0.77 -4.62 121.76 125.57 1tr9 s ALA 206 Ca -0.03 0.62 -0.12 0.00 0.00 0.00 0.00 51.96 52.44 1tr9 s ALA 206 Cb 0.00 -3.25 0.12 0.00 0.00 0.00 0.00 23.12 20.00 1tr9 s ALA 206 CO -0.06 0.09 1.97 1.58 0.00 0.00 0.00 175.76 179.34 1tr9 n HIS 207 N 1.98 3.34 -3.82 0.00 -0.00 -1.26 -1.83 115.22 113.62 1tr9 n HIS 207 Ca -0.00 -2.89 -0.13 0.00 0.46 0.00 0.00 57.72 55.16 1tr9 n HIS 207 Cb 0.48 -2.20 -0.14 0.00 -0.12 0.00 0.00 29.99 28.00 1tr9 n HIS 207 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 1tr9 s VAL 208 N 1.58 -0.02 -0.11 3.57 1.01 -1.26 -4.46 120.40 120.71 1tr9 s VAL 208 Ca 0.43 0.06 -0.13 0.00 0.00 0.00 0.00 61.98 62.35 1tr9 s VAL 208 Cb 0.10 -0.10 -0.05 0.00 0.00 0.00 0.00 36.38 36.34 1tr9 s VAL 208 CO -0.03 0.03 0.30 -0.69 0.00 0.00 0.00 175.10 174.71 1tr9 s VAL 209 N 0.37 5.26 -0.70 2.92 1.01 -0.51 -0.90 120.40 127.85 1tr9 s VAL 209 Ca -0.03 0.57 0.03 0.00 0.00 0.00 0.00 61.98 62.56 1tr9 s VAL 209 Cb -0.04 -3.61 0.17 0.00 0.00 0.00 0.00 36.38 32.90 1tr9 s VAL 209 CO -0.01 0.49 0.50 -0.31 0.00 0.00 0.00 175.10 175.77 1tr9 s TYR 210 N -0.25 3.56 0.46 5.22 1.51 -1.26 -0.99 117.35 125.61 1tr9 s TYR 210 Ca 0.18 -3.23 0.40 0.00 -1.01 0.00 0.00 57.07 53.42 1tr9 s TYR 210 Cb -0.14 -2.85 2.11 0.00 -0.11 0.00 0.00 41.96 40.97 1tr9 s TYR 210 CO 0.07 -0.63 2.23 -1.35 -1.11 0.00 0.00 175.55 174.76 1tr9 h PRO 211 N 5.77 0.00 0.00 -1.71 0.11 -1.69 0.13 132.00 134.61 1tr9 h PRO 211 Ca 0.10 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.14 1tr9 h PRO 211 Cb 0.80 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.90 1tr9 h PRO 211 CO 0.74 0.00 -0.33 1.25 -0.21 0.00 0.00 178.00 179.45 1tr9 h HIS 212 N 0.00 0.00 0.00 0.65 2.76 -1.85 -3.35 115.15 113.36 1tr9 h HIS 212 Ca 0.00 0.00 -0.42 0.00 -2.20 0.00 0.00 60.37 57.75 1tr9 h HIS 212 Cb 0.09 0.00 -0.07 0.00 1.55 0.00 0.00 27.41 28.98 1tr9 h HIS 212 CO 0.00 0.33 -2.49 0.66 -1.30 0.00 0.00 177.93 175.13 1tr9 n TYR 213 N -3.94 0.00 -3.56 5.26 4.01 0.38 -5.08 117.16 114.23 1tr9 n TYR 213 Ca -0.02 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.62 1tr9 n TYR 213 Cb 0.39 -0.98 -0.05 0.00 -0.31 0.00 0.00 39.34 38.39 1tr9 n TYR 213 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1tr9 s ASP 214 N -6.97 -0.39 0.27 7.72 2.15 -0.70 -5.06 116.67 113.70 1tr9 s ASP 214 Ca -0.36 0.37 0.14 0.00 0.43 0.00 0.00 52.55 53.13 1tr9 s ASP 214 Cb 0.12 0.33 0.23 0.00 -0.30 0.00 0.00 42.92 43.29 1tr9 s ASP 214 CO 0.54 -0.39 1.52 0.00 -0.17 0.00 0.00 175.17 176.66 1tr9 h ALA 215 N 2.52 0.73 -2.35 3.66 0.00 -1.86 -3.35 119.26 118.61 1tr9 h ALA 215 Ca -0.19 -0.54 -0.50 0.00 0.00 0.00 0.00 54.91 53.68 1tr9 h ALA 215 Cb 1.17 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 1tr9 h ALA 215 CO 0.32 0.74 0.06 -0.65 0.00 0.00 0.00 179.25 179.71 1tr9 s GLN 216 N -3.18 3.97 0.46 0.00 -1.52 -1.26 -4.91 119.66 113.22 1tr9 s GLN 216 Ca 0.01 0.60 -0.24 0.00 -1.95 0.00 0.00 55.36 53.78 1tr9 s GLN 216 Cb 0.10 -2.48 -0.09 0.00 -0.22 0.00 0.00 33.01 30.32 1tr9 s GLN 216 CO 0.75 0.19 1.26 -2.30 -0.25 0.00 0.00 175.29 174.94 1tr9 n PRO 217 N -0.30 1.81 -0.22 2.91 -0.02 -1.26 -4.58 135.00 133.33 1tr9 n PRO 217 Ca 0.03 0.65 0.14 0.00 -2.02 0.00 0.00 63.50 62.30 1tr9 n PRO 217 Cb 0.53 -2.40 0.45 0.00 -0.02 0.00 0.00 33.50 32.06 1tr9 n PRO 217 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1tr9 h ALA 218 N 1.84 2.00 0.00 3.55 0.00 -0.86 0.47 119.26 126.27 1tr9 h ALA 218 Ca -0.48 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1tr9 h ALA 218 Cb 1.30 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1tr9 h ALA 218 CO 0.59 -0.23 0.00 -1.13 0.00 0.00 0.00 179.25 178.47 1tr9 n SER 219 N -4.52 0.47 -1.04 0.00 3.41 -0.76 -2.39 113.62 108.79 1tr9 n SER 219 Ca 0.16 0.63 0.05 0.00 -0.26 0.00 0.00 58.87 59.45 1tr9 n SER 219 Cb 0.53 -0.72 0.12 0.00 -0.26 0.00 0.00 64.21 63.87 1tr9 n SER 219 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tr9 n GLY 220 N -0.21 3.13 3.29 5.00 0.00 0.13 -4.58 105.19 111.94 1tr9 n GLY 220 Ca 0.02 -1.09 -0.35 0.00 0.00 0.00 0.00 46.02 44.60 1tr9 n GLY 220 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1tr9 s SER 221 N -2.64 4.37 0.39 1.61 0.15 -1.01 -4.82 113.70 111.76 1tr9 s SER 221 Ca 0.36 -0.54 0.06 0.00 0.70 0.00 0.00 55.95 56.53 1tr9 s SER 221 Cb 0.38 -1.73 0.80 0.00 -1.71 0.00 0.00 66.02 63.76 1tr9 s SER 221 CO -0.12 -0.06 2.02 0.28 1.20 0.00 0.00 173.24 176.56 1tr9 h SER 222 N 8.10 0.49 0.42 5.45 0.02 -1.89 -1.70 113.55 124.44 1tr9 h SER 222 Ca -0.39 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.52 1tr9 h SER 222 Cb 1.14 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.57 1tr9 h SER 222 CO 0.60 0.39 -0.20 0.22 -1.14 0.00 0.00 176.83 176.70 1tr9 h TYR 223 N 0.56 -0.52 -0.36 3.45 3.20 -1.94 -1.49 116.97 119.87 1tr9 h TYR 223 Ca 0.15 -0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.93 1tr9 h TYR 223 Cb 0.01 0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 1tr9 h TYR 223 CO 0.00 -0.31 -0.07 -1.49 -1.64 0.00 0.00 178.16 174.65 1tr9 h TRP 224 N -0.60 0.78 0.00 -3.82 4.06 -1.81 -0.70 115.95 113.86 1tr9 h TRP 224 Ca -0.06 -0.16 0.00 0.00 2.06 0.00 0.00 58.89 60.73 1tr9 h TRP 224 Cb 0.45 -0.19 0.00 0.00 -1.00 0.00 0.00 29.16 28.42 1tr9 h TRP 224 CO -0.04 0.84 -0.82 -0.07 -3.56 0.00 0.00 178.44 174.79 1tr9 h LEU 225 N 0.49 0.00 0.00 -4.49 3.38 -1.38 -1.20 115.31 112.11 1tr9 h LEU 225 Ca 0.09 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1tr9 h LEU 225 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1tr9 h LEU 225 CO 0.03 0.02 -0.22 0.29 0.09 0.00 0.00 178.44 178.65 1tr9 n LYS 226 N -2.64 0.12 -0.13 1.13 5.02 -0.57 -4.05 118.16 117.04 1tr9 n LYS 226 Ca 0.01 0.05 -0.06 0.00 -2.02 0.00 0.00 58.31 56.28 1tr9 n LYS 226 Cb 0.53 -0.57 0.02 0.00 -0.02 0.00 0.00 35.03 34.99 1tr9 n LYS 226 CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 1tr9 h GLN 227 N -0.22 0.45 0.00 1.97 5.75 -1.30 -1.43 115.11 120.33 1tr9 h GLN 227 Ca 0.00 -0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.47 1tr9 h GLN 227 Cb 0.22 -0.10 -0.00 0.00 1.07 0.00 0.00 27.48 28.67 1tr9 h GLN 227 CO 0.00 0.30 -0.24 0.28 -2.65 0.00 0.00 178.83 176.51 1tr9 h VAL 228 N 0.46 0.04 -0.65 2.39 2.07 -1.24 0.95 116.25 120.27 1tr9 h VAL 228 Ca 0.18 -1.04 -0.08 0.00 0.82 0.00 0.00 66.70 66.59 1tr9 h VAL 228 Cb 0.06 0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 29.88 1tr9 h VAL 228 CO -0.11 0.01 0.10 0.25 0.02 0.00 0.00 177.57 177.85 1tr9 h LEU 229 N -1.00 1.02 0.00 2.57 5.85 -1.30 0.16 115.31 122.61 1tr9 h LEU 229 Ca -0.00 -0.26 -0.14 0.00 0.84 0.00 0.00 57.88 58.32 1tr9 h LEU 229 Cb 0.26 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1tr9 h LEU 229 CO -0.00 1.02 -0.98 0.54 -0.34 0.00 0.00 178.44 178.68 1tr9 n ARG 230 N -4.25 0.52 -0.06 1.25 5.12 -0.78 -1.54 116.66 116.93 1tr9 n ARG 230 Ca 0.04 0.54 -0.11 0.00 -1.93 0.00 0.00 57.85 56.39 1tr9 n ARG 230 Cb 0.29 -1.71 -0.10 0.00 -1.16 0.00 0.00 32.46 29.78 1tr9 n ARG 230 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 1tr9 h GLU 231 N -1.00 -0.01 -0.08 5.56 5.08 -1.15 -2.24 114.58 120.74 1tr9 h GLU 231 Ca -0.21 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 57.99 1tr9 h GLU 231 Cb 0.97 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.23 1tr9 h GLU 231 CO -0.12 0.74 -0.60 0.93 -1.00 0.00 0.00 179.01 178.95 1tr9 h GLU 232 N -0.97 0.55 0.00 2.33 5.08 -0.50 -3.37 114.58 117.70 1tr9 h GLU 232 Ca -0.00 -0.48 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1tr9 h GLU 232 Cb 0.75 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.11 1tr9 h GLU 232 CO 0.00 1.11 -1.54 1.28 -1.00 0.00 0.00 179.01 178.86 1tr9 n LEU 233 N -4.17 0.39 -0.30 1.33 4.77 0.53 -5.00 117.00 114.55 1tr9 n LEU 233 Ca -0.09 0.14 -0.03 0.00 -0.03 0.00 0.00 56.01 56.00 1tr9 n LEU 233 Cb 0.65 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.71 1tr9 n LEU 233 CO 0.48 -0.08 -0.04 0.61 -1.33 0.00 0.00 177.39 177.03 1tr9 n GLY 234 N 1.23 0.43 3.74 -0.72 0.00 -0.84 -4.78 105.19 104.24 1tr9 n GLY 234 Ca -0.02 -0.85 -0.41 0.00 0.00 0.00 0.00 46.02 44.74 1tr9 n GLY 234 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1tr9 s PHE 235 N -2.14 3.20 -0.89 1.61 5.36 -0.59 -4.92 117.98 119.61 1tr9 s PHE 235 Ca 0.00 1.12 0.08 0.00 -0.96 0.00 0.00 56.93 57.17 1tr9 s PHE 235 Cb 0.00 -3.67 0.03 0.00 -0.34 0.00 0.00 43.02 39.04 1tr9 s PHE 235 CO 0.00 -2.17 0.67 1.63 -1.46 0.00 0.00 175.22 173.88 1tr9 n LYS 236 N 2.77 1.13 -0.13 10.12 4.76 -1.26 -4.63 118.16 130.92 1tr9 n LYS 236 Ca 0.07 -0.78 0.00 0.00 -2.87 0.00 0.00 58.31 54.73 1tr9 n LYS 236 Cb 0.42 -1.09 0.00 0.00 -1.84 0.00 0.00 35.03 32.52 1tr9 n LYS 236 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1tr9 n GLY 237 N 0.62 0.16 3.73 0.72 0.00 -1.26 -5.05 105.19 104.11 1tr9 n GLY 237 Ca 0.04 -1.80 -0.40 0.00 0.00 0.00 0.00 46.02 43.85 1tr9 n GLY 237 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tr9 s ILE 238 N 0.39 4.81 -0.24 -0.61 -1.09 -0.72 -4.96 121.20 118.77 1tr9 s ILE 238 Ca 0.00 1.70 -0.08 0.00 -2.23 0.00 0.00 60.65 60.04 1tr9 s ILE 238 Cb 0.00 -4.15 -0.04 0.00 -1.58 0.00 0.00 42.46 36.69 1tr9 s ILE 238 CO 0.00 0.30 0.09 -0.69 -1.23 0.00 0.00 174.94 173.41 1tr9 s VAL 239 N 0.33 4.60 0.33 2.92 1.01 -1.26 -4.25 120.40 124.08 1tr9 s VAL 239 Ca 0.41 -0.08 -0.07 0.00 0.00 0.00 0.00 61.98 62.24 1tr9 s VAL 239 Cb -0.20 -3.14 -0.06 0.00 0.00 0.00 0.00 36.38 32.98 1tr9 s VAL 239 CO 0.23 0.35 0.64 -0.36 0.00 0.00 0.00 175.10 175.96 1tr9 s PHE 240 N 1.34 3.47 0.82 5.22 2.99 -1.26 -0.20 117.98 130.36 1tr9 s PHE 240 Ca 0.05 0.82 -0.10 0.00 0.00 0.00 0.00 56.93 57.70 1tr9 s PHE 240 Cb -0.15 -2.25 0.13 0.00 0.00 0.00 0.00 43.02 40.75 1tr9 s PHE 240 CO 0.04 0.07 1.15 -1.54 -0.00 0.00 0.00 175.22 174.95 1tr9 s SER 241 N -3.10 4.04 1.05 1.36 1.04 -1.26 -4.13 113.70 112.69 1tr9 s SER 241 Ca 0.47 0.29 -0.18 0.00 0.48 0.00 0.00 55.95 57.02 1tr9 s SER 241 Cb -0.11 -0.64 0.24 0.00 0.10 0.00 0.00 66.02 65.61 1tr9 s SER 241 CO 0.30 -2.12 1.29 1.51 0.98 0.00 0.00 173.24 175.19 1tr9 s ASP 242 N -4.71 2.31 -0.49 7.02 3.84 -1.26 -4.68 116.67 118.70 1tr9 s ASP 242 Ca 0.67 0.26 -0.27 0.00 -0.00 0.00 0.00 52.55 53.21 1tr9 s ASP 242 Cb -0.07 -0.27 -0.01 0.00 -1.38 0.00 0.00 42.92 41.18 1tr9 s ASP 242 CO 0.48 -3.23 1.77 -0.62 -0.00 0.00 0.00 175.17 173.57 1tr9 s ASP 243 N -4.71 5.64 0.00 2.11 3.68 -1.26 -4.08 116.67 118.05 1tr9 s ASP 243 Ca 0.75 0.71 0.21 0.00 2.13 0.00 0.00 52.55 56.35 1tr9 s ASP 243 Cb -0.04 -2.53 1.20 0.00 -1.45 0.00 0.00 42.92 40.10 1tr9 s ASP 243 CO 0.54 -2.01 1.64 0.18 0.13 0.00 0.00 175.17 175.65 1tr9 n LEU 244 N 11.32 0.00 -1.11 -1.34 4.77 0.19 -4.70 117.00 126.12 1tr9 n LEU 244 Ca 0.20 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 1tr9 n LEU 244 Cb 0.50 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1tr9 n LEU 244 CO 0.70 -0.03 0.46 -1.54 -1.33 0.00 0.00 177.39 175.65 1tr9 n SER 245 N -1.08 2.64 0.00 -1.43 3.41 -1.26 -4.90 113.62 111.01 1tr9 n SER 245 Ca 0.14 -1.64 0.00 0.00 -0.26 0.00 0.00 58.87 57.11 1tr9 n SER 245 Cb 0.10 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.57 1tr9 n SER 245 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1tr9 n GLU 247 N 0.80 0.00 -0.00 4.33 2.13 -1.26 -5.05 120.64 121.59 1tr9 n GLU 247 Ca 0.00 0.00 0.04 0.00 0.66 0.00 0.00 57.16 57.86 1tr9 n GLU 247 Cb 0.38 0.00 0.42 0.00 0.27 0.00 0.00 31.44 32.51 1tr9 n GLU 247 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1tr9 h GLY 248 N 0.00 0.58 2.00 8.31 0.00 -2.00 -0.30 103.07 111.67 1tr9 h GLY 248 Ca 0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1tr9 h GLY 248 CO 0.00 0.22 -0.05 0.00 0.00 0.00 0.00 176.54 176.71 1tr9 h ALA 249 N 1.73 1.89 -4.44 3.60 0.00 -2.00 -3.46 119.26 116.58 1tr9 h ALA 249 Ca 0.15 -0.05 -0.41 0.00 0.00 0.00 0.00 54.91 54.61 1tr9 h ALA 249 Cb -0.05 -0.01 0.05 0.00 0.00 0.00 0.00 17.79 17.78 1tr9 h ALA 249 CO -0.03 0.06 -0.60 0.00 0.00 0.00 0.00 179.25 178.68 1tr9 n ALA 250 N -2.52 -0.96 -2.49 0.00 0.00 -0.12 -5.07 120.51 109.35 1tr9 n ALA 250 Ca -0.03 0.27 -0.35 0.00 0.00 0.00 0.00 53.44 53.33 1tr9 n ALA 250 Cb 0.13 -3.70 0.01 0.00 0.00 0.00 0.00 19.45 15.89 1tr9 n ALA 250 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1tr9 n VAL 251 N -4.44 4.02 -3.38 0.00 0.24 -1.26 -5.11 118.33 108.39 1tr9 n VAL 251 Ca -0.12 -5.25 0.00 0.00 -2.04 0.00 0.00 64.34 56.93 1tr9 n VAL 251 Cb 0.62 -1.38 0.00 0.00 -1.47 0.00 0.00 33.84 31.61 1tr9 n VAL 251 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1tr9 n GLY 253 N -0.31 5.13 3.74 7.63 0.00 -1.26 -5.18 105.19 114.93 1tr9 n GLY 253 Ca 0.43 -1.64 -0.28 0.00 0.00 0.00 0.00 46.02 44.53 1tr9 n GLY 253 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tr9 n GLY 254 N 1.12 -1.35 0.34 -0.02 0.00 -1.26 -4.72 105.19 99.29 1tr9 n GLY 254 Ca 0.00 -1.73 0.03 0.00 0.00 0.00 0.00 46.02 44.32 1tr9 n GLY 254 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1tr9 h PRO 255 N 0.00 0.82 -0.43 1.61 0.13 -1.92 -0.84 132.00 131.36 1tr9 h PRO 255 Ca -0.41 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 64.63 1tr9 h PRO 255 Cb 1.15 -0.18 -0.02 0.00 0.13 0.00 0.00 31.00 32.08 1tr9 h PRO 255 CO 0.30 0.54 0.11 0.28 -0.23 0.00 0.00 178.00 178.99 1tr9 h VAL 256 N 0.84 1.23 -0.53 1.56 2.07 -1.91 0.52 116.25 120.03 1tr9 h VAL 256 Ca 0.26 -0.80 -0.11 0.00 0.82 0.00 0.00 66.70 66.86 1tr9 h VAL 256 Cb 0.01 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 1tr9 h VAL 256 CO -0.07 0.28 -0.11 -0.33 0.02 0.00 0.00 177.57 177.37 1tr9 h GLU 257 N 0.56 1.01 -0.48 1.57 3.07 -1.74 -0.86 114.58 117.71 1tr9 h GLU 257 Ca 0.14 -0.37 -0.06 0.00 -0.50 0.00 0.00 59.36 58.57 1tr9 h GLU 257 Cb 0.32 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.14 1tr9 h GLU 257 CO 0.00 1.05 0.08 0.00 -1.40 0.00 0.00 179.01 178.74 1tr9 h ARG 258 N 0.89 0.79 -0.54 2.33 3.08 -1.08 -1.39 114.38 118.46 1tr9 h ARG 258 Ca 0.14 -0.21 0.01 0.00 0.07 0.00 0.00 59.98 59.99 1tr9 h ARG 258 Cb 0.67 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.60 1tr9 h ARG 258 CO 0.05 0.79 0.36 0.77 -1.07 0.00 0.00 179.97 180.87 1tr9 h SER 259 N 0.66 0.62 -0.26 7.04 0.02 -0.72 -0.97 113.55 119.94 1tr9 h SER 259 Ca 0.15 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1tr9 h SER 259 Cb 0.38 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 1tr9 h SER 259 CO 0.01 0.45 0.15 -0.74 -1.14 0.00 0.00 176.83 175.56 1tr9 h HIS 260 N 0.73 0.34 -0.85 3.45 -0.00 -0.97 -1.93 115.15 115.92 1tr9 h HIS 260 Ca 0.20 -0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.54 1tr9 h HIS 260 Cb -0.08 -0.11 -0.04 0.00 -0.00 0.00 0.00 27.41 27.18 1tr9 h HIS 260 CO -0.04 0.27 0.41 0.37 -0.00 0.00 0.00 177.93 178.94 1tr9 h GLN 261 N 0.32 1.23 -0.67 5.26 5.75 -1.06 0.25 115.11 126.19 1tr9 h GLN 261 Ca 0.09 -0.18 -0.04 0.00 -0.15 0.00 0.00 58.65 58.37 1tr9 h GLN 261 Cb 0.03 -0.22 -0.03 0.00 1.07 0.00 0.00 27.48 28.33 1tr9 h GLN 261 CO -0.02 0.94 0.28 0.00 -2.65 0.00 0.00 178.83 177.38 1tr9 h ALA 262 N 1.23 0.87 -0.27 3.38 0.00 -0.87 0.11 119.26 123.71 1tr9 h ALA 262 Ca 0.29 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1tr9 h ALA 262 Cb 0.12 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1tr9 h ALA 262 CO -0.04 0.48 -0.03 -0.07 0.00 0.00 0.00 179.25 179.59 1tr9 h LEU 263 N 0.95 0.50 -0.95 0.00 3.38 -1.05 -0.86 115.31 117.27 1tr9 h LEU 263 Ca 0.23 -0.34 -0.06 0.00 0.09 0.00 0.00 57.88 57.79 1tr9 h LEU 263 Cb 0.19 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1tr9 h LEU 263 CO -0.02 0.72 0.08 0.58 0.09 0.00 0.00 178.44 179.89 1tr9 h VAL 264 N 0.27 1.24 0.00 1.22 2.07 -0.80 -2.64 116.25 117.61 1tr9 h VAL 264 Ca 0.07 -0.91 -0.02 0.00 0.82 0.00 0.00 66.70 66.66 1tr9 h VAL 264 Cb 0.48 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 31.00 1tr9 h VAL 264 CO 0.02 0.33 -0.12 0.00 0.02 0.00 0.00 177.57 177.83 1tr9 h ALA 265 N 1.28 1.59 0.00 1.67 0.00 -0.64 -3.46 119.26 119.70 1tr9 h ALA 265 Ca 0.17 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1tr9 h ALA 265 Cb 0.37 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1tr9 h ALA 265 CO 0.01 0.14 0.00 0.41 0.00 0.00 0.00 179.25 179.81 1tr9 n GLY 266 N -1.03 -0.08 3.76 0.00 0.00 -0.99 -3.96 105.19 102.89 1tr9 n GLY 266 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 1tr9 n GLY 266 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tr9 n ASP 268 N 1.17 1.07 -3.55 0.00 10.43 0.72 -4.49 116.55 121.90 1tr9 n ASP 268 Ca -0.01 -1.24 -0.15 0.00 2.57 0.00 0.00 54.79 55.96 1tr9 n ASP 268 Cb 0.45 0.01 -0.06 0.00 1.84 0.00 0.00 41.12 43.36 1tr9 n ASP 268 CO 0.00 0.00 0.00 0.27 -1.07 0.00 0.00 177.20 176.40 1tr9 s ILE 270 N -2.11 0.00 -0.12 0.53 -4.36 0.21 -4.73 121.20 110.62 1tr9 s ILE 270 Ca 0.37 0.00 0.03 0.00 -0.26 0.00 0.00 60.65 60.79 1tr9 s ILE 270 Cb 0.21 -1.00 0.00 0.00 1.25 0.00 0.00 42.46 42.92 1tr9 s ILE 270 CO 0.38 0.00 -0.22 -0.76 0.24 0.00 0.00 174.94 174.58 1tr9 s LEU 271 N -0.92 2.18 -0.26 0.37 1.02 -1.26 -0.34 118.68 119.48 1tr9 s LEU 271 Ca -0.06 -0.55 0.01 0.00 0.02 0.00 0.00 54.13 53.54 1tr9 s LEU 271 Cb -0.01 -1.45 0.07 0.00 0.02 0.00 0.00 46.19 44.82 1tr9 s LEU 271 CO 0.06 0.12 -0.02 -0.63 0.02 0.00 0.00 176.35 175.89 1tr9 s ILE 272 N 0.59 1.57 0.10 -0.59 1.01 -0.59 -0.64 121.20 122.64 1tr9 s ILE 272 Ca -0.12 -1.40 0.04 0.00 0.00 0.00 0.00 60.65 59.17 1tr9 s ILE 272 Cb -0.17 -1.91 -0.04 0.00 0.01 0.00 0.00 42.46 40.36 1tr9 s ILE 272 CO 0.03 -0.23 0.07 0.00 0.00 0.00 0.00 174.94 174.81 1tr9 n ASN 274 N 0.33 -3.65 -3.28 0.00 3.02 -1.26 -4.67 115.26 105.74 1tr9 n ASN 274 Ca -0.09 0.00 -0.23 0.00 -0.03 0.00 0.00 54.58 54.23 1tr9 n ASN 274 Cb 0.52 -2.37 -0.08 0.00 -0.61 0.00 0.00 39.78 37.24 1tr9 n ASN 274 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1tr9 n LYS 275 N -0.70 0.25 -0.31 3.52 5.02 -1.26 -4.98 118.16 119.70 1tr9 n LYS 275 Ca 0.00 -2.99 0.05 0.00 -2.02 0.00 0.00 58.31 53.36 1tr9 n LYS 275 Cb 0.25 -1.63 0.20 0.00 -0.02 0.00 0.00 35.03 33.84 1tr9 n LYS 275 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 1tr9 h ARG 276 N 5.50 0.73 -0.13 1.97 9.65 -1.92 -1.65 114.38 128.53 1tr9 h ARG 276 Ca 0.23 -0.04 -0.06 0.00 -1.10 0.00 0.00 59.98 59.01 1tr9 h ARG 276 Cb 0.94 -0.17 -0.01 0.00 -1.39 0.00 0.00 29.97 29.35 1tr9 h ARG 276 CO 0.31 0.48 -0.18 1.05 2.80 0.00 0.00 179.97 184.44 1tr9 h GLU 277 N 0.75 0.21 -0.26 0.20 4.11 -1.99 -0.57 114.58 117.04 1tr9 h GLU 277 Ca 0.44 -0.05 -0.18 0.00 0.07 0.00 0.00 59.36 59.64 1tr9 h GLU 277 Cb 0.51 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1tr9 h GLU 277 CO -0.30 0.39 -0.53 0.00 0.07 0.00 0.00 179.01 178.64 1tr9 h ALA 278 N 1.62 0.41 -0.50 1.06 0.00 -1.77 -1.78 119.26 118.30 1tr9 h ALA 278 Ca 0.04 -0.51 0.01 0.00 0.00 0.00 0.00 54.91 54.45 1tr9 h ALA 278 Cb 0.44 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1tr9 h ALA 278 CO 0.03 0.61 0.33 0.00 0.00 0.00 0.00 179.25 180.22 1tr9 h ALA 279 N 0.65 0.64 -0.70 0.00 0.00 -0.85 -1.38 119.26 117.61 1tr9 h ALA 279 Ca 0.01 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 1tr9 h ALA 279 Cb 1.14 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 1tr9 h ALA 279 CO 0.12 0.07 0.23 0.28 0.00 0.00 0.00 179.25 179.95 1tr9 h VAL 280 N 0.67 1.26 -0.80 0.00 2.07 -1.05 0.46 116.25 118.84 1tr9 h VAL 280 Ca 0.19 -0.87 0.01 0.00 0.82 0.00 0.00 66.70 66.85 1tr9 h VAL 280 Cb -0.06 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 30.16 1tr9 h VAL 280 CO -0.05 0.34 0.53 -0.08 0.02 0.00 0.00 177.57 178.33 1tr9 h GLU 281 N 1.03 1.05 -0.10 1.57 4.81 -0.94 0.84 114.58 122.84 1tr9 h GLU 281 Ca 0.23 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 1tr9 h GLU 281 Cb 0.29 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.42 1tr9 h GLU 281 CO -0.01 0.70 0.02 0.28 -0.73 0.00 0.00 179.01 179.26 1tr9 h VAL 282 N 1.09 1.21 -0.98 0.32 2.07 -0.83 -2.57 116.25 116.55 1tr9 h VAL 282 Ca 0.29 -0.67 0.12 0.00 0.82 0.00 0.00 66.70 67.26 1tr9 h VAL 282 Cb -0.13 1.48 -0.08 0.00 -1.52 0.00 0.00 31.29 31.04 1tr9 h VAL 282 CO -0.06 0.19 0.62 -0.07 0.02 0.00 0.00 177.57 178.27 1tr9 h LEU 283 N -0.07 0.89 -0.18 2.57 4.07 -0.52 0.83 115.31 122.90 1tr9 h LEU 283 Ca 0.03 0.04 0.00 0.00 0.08 0.00 0.00 57.88 58.03 1tr9 h LEU 283 Cb 0.28 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 41.89 1tr9 h LEU 283 CO 0.00 0.48 0.00 0.47 -1.08 0.00 0.00 178.44 178.32 1tr9 n ASP 284 N -4.60 0.73 0.00 -0.43 8.00 0.25 -4.25 116.55 116.26 1tr9 n ASP 284 Ca 0.18 0.60 0.00 0.00 0.71 0.00 0.00 54.79 56.28 1tr9 n ASP 284 Cb 0.35 -0.78 0.00 0.00 -0.02 0.00 0.00 41.12 40.67 1tr9 n ASP 284 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1tr9 n ASN 285 N -2.22 4.59 -4.78 -2.24 3.02 -0.65 -5.05 115.26 107.94 1tr9 n ASN 285 Ca 0.05 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.22 1tr9 n ASN 285 Cb 0.37 0.66 -0.04 0.00 -0.61 0.00 0.00 39.78 40.16 1tr9 n ASN 285 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1tr9 s LEU 286 N -3.32 4.22 0.68 3.41 2.96 0.19 -5.00 118.68 121.83 1tr9 s LEU 286 Ca 0.00 2.10 -0.17 0.00 -0.22 0.00 0.00 54.13 55.84 1tr9 s LEU 286 Cb 0.00 -4.07 -0.02 0.00 0.50 0.00 0.00 46.19 42.60 1tr9 s LEU 286 CO 0.00 -0.43 0.87 -2.65 -1.32 0.00 0.00 176.35 172.82 1tr9 n PRO 287 N 0.19 0.58 -2.51 0.98 -0.02 -1.26 -4.96 135.00 127.99 1tr9 n PRO 287 Ca 0.04 0.25 -0.33 0.00 -2.02 0.00 0.00 63.50 61.44 1tr9 n PRO 287 Cb 0.48 -2.12 -0.04 0.00 -0.02 0.00 0.00 33.50 31.81 1tr9 n PRO 287 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1tr9 s ILE 288 N -1.74 4.30 -0.10 4.25 -1.09 -1.26 -5.01 121.20 120.56 1tr9 s ILE 288 Ca 0.73 1.25 -0.25 0.00 -2.23 0.00 0.00 60.65 60.15 1tr9 s ILE 288 Cb -0.37 -3.60 0.06 0.00 -1.58 0.00 0.00 42.46 36.96 1tr9 s ILE 288 CO 0.51 -0.49 0.58 -1.61 -1.23 0.00 0.00 174.94 172.70 1tr9 s GLU 290 N -3.67 0.87 -0.61 2.79 2.02 -1.26 -5.10 118.70 113.74 1tr9 s GLU 290 Ca 0.62 0.35 0.06 0.00 0.02 0.00 0.00 54.97 56.01 1tr9 s GLU 290 Cb -0.11 0.41 0.22 0.00 0.10 0.00 0.00 34.13 34.75 1tr9 s GLU 290 CO 0.24 -0.22 0.62 0.28 0.02 0.00 0.00 175.26 176.20 1tr9 n VAL 291 N 1.57 1.46 -0.04 2.63 0.31 0.85 -4.94 118.33 120.17 1tr9 n VAL 291 Ca -0.18 -4.82 0.02 0.00 -0.01 0.00 0.00 64.34 59.36 1tr9 n VAL 291 Cb 0.56 -2.07 0.36 0.00 -0.91 0.00 0.00 33.84 31.79 1tr9 n VAL 291 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1tr9 h PRO 292 N 4.58 0.62 0.00 5.55 0.13 -1.88 -1.14 132.00 139.86 1tr9 h PRO 292 Ca 0.17 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1tr9 h PRO 292 Cb 0.74 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 31.74 1tr9 h PRO 292 CO 0.72 0.46 0.00 -0.56 -0.23 0.00 0.00 178.00 178.38 1tr9 h GLN 293 N 0.63 0.00 0.00 0.86 -0.00 -1.95 -2.17 115.11 112.47 1tr9 h GLN 293 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.81 1tr9 h GLN 293 Cb 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.50 1tr9 h GLN 293 CO -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 178.83 178.80 1tr9 n ALA 294 N -2.00 1.78 0.31 0.06 0.00 -0.43 -2.43 120.51 117.80 1tr9 n ALA 294 Ca -0.02 0.01 0.19 0.00 0.00 0.00 0.00 53.44 53.62 1tr9 n ALA 294 Cb 0.10 -1.35 1.04 0.00 0.00 0.00 0.00 19.45 19.24 1tr9 n ALA 294 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1tr9 h GLU 295 N 0.00 0.00 0.00 0.00 5.08 -1.56 -0.35 114.58 117.75 1tr9 h GLU 295 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1tr9 h GLU 295 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1tr9 h GLU 295 CO 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.01 1tr9 h ALA 296 N 1.95 1.00 0.00 3.43 0.00 -1.72 -2.56 119.26 121.36 1tr9 h ALA 296 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1tr9 h ALA 296 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1tr9 h ALA 296 CO -0.00 0.00 -0.50 1.28 0.00 0.00 0.00 179.25 180.03 1tr9 n LEU 297 N -2.87 0.53 -4.77 0.00 4.77 -0.14 -4.82 117.00 109.70 1tr9 n LEU 297 Ca -0.02 0.14 -0.40 0.00 -0.03 0.00 0.00 56.01 55.70 1tr9 n LEU 297 Cb 0.08 -0.25 -0.01 0.00 -2.33 0.00 0.00 43.42 40.91 1tr9 n LEU 297 CO 0.18 0.04 0.97 -0.76 -1.33 0.00 0.00 177.39 176.49 1tr9 s LEU 298 N -3.50 4.30 0.58 2.23 1.43 -0.97 -4.57 118.68 118.18 1tr9 s LEU 298 Ca 0.09 2.68 -0.20 0.00 -1.03 0.00 0.00 54.13 55.67 1tr9 s LEU 298 Cb 0.16 -3.79 -0.04 0.00 0.03 0.00 0.00 46.19 42.55 1tr9 s LEU 298 CO 0.69 -0.72 1.28 -1.59 0.23 0.00 0.00 176.35 176.24 1tr9 s LYS 299 N -2.06 3.00 0.00 1.70 -2.85 -1.26 -4.81 119.74 113.46 1tr9 s LYS 299 Ca 0.53 2.03 0.23 0.00 -1.00 0.00 0.00 55.97 57.77 1tr9 s LYS 299 Cb -0.39 -2.07 0.09 0.00 -2.06 0.00 0.00 37.83 33.40 1tr9 s LYS 299 CO 0.51 -1.24 1.16 1.63 0.10 0.00 0.00 175.35 177.51 1tr9 n LYS 300 N -1.37 1.40 -4.18 1.78 4.76 -0.47 -4.96 118.16 115.12 1tr9 n LYS 300 Ca 0.12 -1.14 -0.14 0.00 -2.87 0.00 0.00 58.31 54.29 1tr9 n LYS 300 Cb 0.47 -1.48 -0.11 0.00 -1.84 0.00 0.00 35.03 32.08 1tr9 n LYS 300 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1tr9 s GLN 301 N -2.39 0.86 -0.04 1.97 -0.21 -1.26 -4.97 119.66 113.63 1tr9 s GLN 301 Ca 0.21 -1.19 -0.01 0.00 0.02 0.00 0.00 55.36 54.39 1tr9 s GLN 301 Cb 0.19 -0.51 0.03 0.00 1.00 0.00 0.00 33.01 33.72 1tr9 s GLN 301 CO 0.52 0.07 0.06 -1.14 -2.12 0.00 0.00 175.29 172.68 1tr9 s GLN 302 N -2.94 -0.01 0.15 2.91 0.74 -1.26 -5.01 119.66 114.24 1tr9 s GLN 302 Ca 0.07 0.27 -0.24 0.00 0.05 0.00 0.00 55.36 55.51 1tr9 s GLN 302 Cb -0.02 -0.27 0.07 0.00 1.10 0.00 0.00 33.01 33.89 1tr9 s GLN 302 CO -0.00 -0.20 0.72 -0.59 -0.55 0.00 0.00 175.29 174.67 1tr9 s PHE 303 N 1.29 -0.39 0.53 1.67 -0.12 -1.26 -5.12 117.98 114.58 1tr9 s PHE 303 Ca -0.07 0.13 -0.02 0.00 -0.05 0.00 0.00 56.93 56.92 1tr9 s PHE 303 Cb -0.13 0.59 0.01 0.00 -0.63 0.00 0.00 43.02 42.87 1tr9 s PHE 303 CO -0.04 -0.87 0.78 -1.54 -0.05 0.00 0.00 175.22 173.51 1tr9 s SER 304 N -2.75 5.62 0.19 1.98 1.04 -1.26 -4.15 113.70 114.37 1tr9 s SER 304 Ca 0.05 0.41 -0.08 0.00 0.48 0.00 0.00 55.95 56.81 1tr9 s SER 304 Cb -0.02 -1.49 0.09 0.00 0.10 0.00 0.00 66.02 64.70 1tr9 s SER 304 CO -0.06 -0.93 1.65 0.22 0.98 0.00 0.00 173.24 175.09 1tr9 h TYR 305 N 0.10 1.15 -0.51 5.02 3.20 -1.96 -1.34 116.97 122.62 1tr9 h TYR 305 Ca -0.45 -0.20 0.07 0.00 3.14 0.00 0.00 58.73 61.29 1tr9 h TYR 305 Cb 1.26 -0.30 -0.06 0.00 1.54 0.00 0.00 36.73 39.17 1tr9 h TYR 305 CO 0.44 1.02 0.19 0.77 -1.64 0.00 0.00 178.16 178.94 1tr9 h SER 306 N 0.96 0.20 -0.43 -2.11 0.02 -1.95 -1.20 113.55 109.04 1tr9 h SER 306 Ca 0.17 0.06 -0.04 0.00 -0.84 0.00 0.00 61.79 61.15 1tr9 h SER 306 Cb 0.56 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.12 1tr9 h SER 306 CO 0.03 0.14 0.13 -0.33 -1.14 0.00 0.00 176.83 175.66 1tr9 h GLU 307 N 0.37 0.67 -0.73 3.45 5.08 -1.90 -3.06 114.58 118.47 1tr9 h GLU 307 Ca 0.25 -0.15 0.03 0.00 -1.00 0.00 0.00 59.36 58.49 1tr9 h GLU 307 Cb 0.26 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.37 1tr9 h GLU 307 CO -0.25 0.66 0.46 1.25 -1.00 0.00 0.00 179.01 180.13 1tr9 h LEU 308 N 0.55 0.75 -1.09 1.33 5.85 -0.95 -2.61 115.31 119.14 1tr9 h LEU 308 Ca 0.14 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1tr9 h LEU 308 Cb 0.28 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.15 1tr9 h LEU 308 CO -0.00 0.51 0.00 0.29 -0.34 0.00 0.00 178.44 178.90 1tr9 n LYS 309 N -4.65 0.18 0.03 1.25 5.02 -0.48 -1.65 118.16 117.85 1tr9 n LYS 309 Ca 0.08 0.53 0.13 0.00 -2.02 0.00 0.00 58.31 57.04 1tr9 n LYS 309 Cb 0.10 -1.93 0.53 0.00 -0.02 0.00 0.00 35.03 33.70 1tr9 n LYS 309 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1tr9 n ARG 310 N -2.28 0.08 -2.66 1.97 1.74 -0.98 -4.63 116.66 109.90 1tr9 n ARG 310 Ca 0.00 0.09 -0.42 0.00 -0.77 0.00 0.00 57.85 56.76 1tr9 n ARG 310 Cb 0.14 -1.60 -0.04 0.00 -1.02 0.00 0.00 32.46 29.95 1tr9 n ARG 310 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1tr9 s LEU 311 N -3.48 4.42 0.48 0.55 1.02 -0.66 -4.91 118.68 116.11 1tr9 s LEU 311 Ca 0.12 1.79 0.14 0.00 0.02 0.00 0.00 54.13 56.19 1tr9 s LEU 311 Cb 0.16 -3.58 1.14 0.00 0.02 0.00 0.00 46.19 43.93 1tr9 s LEU 311 CO 0.52 -0.22 2.11 -0.33 0.02 0.00 0.00 176.35 178.45 1tr9 h GLU 312 N 6.24 0.18 -0.90 1.70 3.07 -1.89 -1.20 114.58 121.79 1tr9 h GLU 312 Ca -0.42 -0.01 0.05 0.00 -0.50 0.00 0.00 59.36 58.48 1tr9 h GLU 312 Cb 1.22 -0.04 -0.06 0.00 -0.84 0.00 0.00 28.75 29.03 1tr9 h GLU 312 CO 0.74 0.12 0.59 -0.09 -1.40 0.00 0.00 179.01 178.98 1tr9 h ARG 313 N 0.19 1.04 -0.07 2.33 2.43 -1.93 -0.33 114.38 118.05 1tr9 h ARG 313 Ca 0.07 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.10 1tr9 h ARG 313 Cb 0.05 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 29.37 1tr9 h ARG 313 CO -0.01 0.69 -0.27 2.35 -1.51 0.00 0.00 179.97 181.22 1tr9 h TRP 314 N 1.07 0.40 -0.55 2.20 7.01 -1.49 -1.93 115.95 122.66 1tr9 h TRP 314 Ca 0.38 -0.17 0.08 0.00 2.11 0.00 0.00 58.89 61.29 1tr9 h TRP 314 Cb 0.12 -0.06 -0.06 0.00 -2.10 0.00 0.00 29.16 27.05 1tr9 h TRP 314 CO -0.00 0.89 0.20 1.96 -2.79 0.00 0.00 178.44 178.69 1tr9 h GLN 315 N -0.20 0.37 -0.07 2.65 4.20 -0.81 -0.81 115.11 120.44 1tr9 h GLN 315 Ca -0.01 -0.02 -0.06 0.00 0.06 0.00 0.00 58.65 58.61 1tr9 h GLN 315 Cb 0.91 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.61 1tr9 h GLN 315 CO 0.06 0.24 -0.20 1.96 -0.67 0.00 0.00 178.83 180.22 1tr9 h GLN 316 N 0.38 0.25 -0.53 1.46 1.08 -1.16 -2.96 115.11 113.63 1tr9 h GLN 316 Ca 0.27 -0.18 0.01 0.00 -1.45 0.00 0.00 58.65 57.29 1tr9 h GLN 316 Cb 0.31 0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 27.74 1tr9 h GLN 316 CO -0.27 0.81 0.35 0.00 -0.95 0.00 0.00 178.83 178.76 1tr9 h ALA 317 N 0.45 0.68 -0.48 3.87 0.00 -1.14 0.53 119.26 123.17 1tr9 h ALA 317 Ca -0.01 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 1tr9 h ALA 317 Cb 0.82 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1tr9 h ALA 317 CO 0.04 0.10 0.03 0.66 0.00 0.00 0.00 179.25 180.08 1tr9 h SER 318 N 0.71 0.80 -0.54 0.00 4.64 -1.24 -2.73 113.55 115.18 1tr9 h SER 318 Ca 0.20 -0.29 -0.05 0.00 -0.47 0.00 0.00 61.79 61.18 1tr9 h SER 318 Cb -0.07 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 61.79 1tr9 h SER 318 CO -0.05 0.89 0.14 0.00 -0.87 0.00 0.00 176.83 176.93 1tr9 h ALA 319 N 0.94 0.71 0.00 5.18 0.00 -1.32 -2.81 119.26 121.95 1tr9 h ALA 319 Ca 0.14 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1tr9 h ALA 319 Cb 0.46 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1tr9 h ALA 319 CO 0.02 0.40 0.00 0.09 0.00 0.00 0.00 179.25 179.76 1tr9 n ASN 320 N -4.42 0.70 0.00 0.00 5.03 0.15 -2.10 115.26 114.61 1tr9 n ASN 320 Ca 0.02 -0.47 0.00 0.00 0.87 0.00 0.00 54.58 55.00 1tr9 n ASN 320 Cb 0.23 -0.12 0.00 0.00 -1.02 0.00 0.00 39.78 38.87 1tr9 n ASN 320 CO 0.00 0.00 0.00 1.67 -1.83 0.00 0.00 177.26 177.10 1tr9 n GLN 322 N 0.89 0.00 -0.13 3.52 -0.06 -1.06 -1.01 117.38 119.52 1tr9 n GLN 322 Ca 0.00 0.00 -0.06 0.00 -2.00 0.00 0.00 57.00 54.94 1tr9 n GLN 322 Cb 0.12 0.00 0.11 0.00 -4.06 0.00 0.00 30.24 26.41 1tr9 n GLN 322 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1tr9 h ARG 323 N 0.00 0.87 -0.58 3.69 3.08 -1.72 -1.73 114.38 117.98 1tr9 h ARG 323 Ca 0.00 -0.26 -0.06 0.00 0.07 0.00 0.00 59.98 59.73 1tr9 h ARG 323 Cb 0.00 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 1tr9 h ARG 323 CO 0.00 0.89 0.13 1.25 -1.07 0.00 0.00 179.97 181.17 1tr9 h LEU 324 N 0.80 0.90 -0.27 3.04 5.85 -1.36 -0.69 115.31 123.57 1tr9 h LEU 324 Ca 0.14 -0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 1tr9 h LEU 324 Cb 0.53 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 1tr9 h LEU 324 CO 0.03 0.90 0.11 0.40 -0.34 0.00 0.00 178.44 179.54 1tr9 h ILE 325 N 0.85 1.17 -0.21 4.05 2.04 -1.76 -2.63 117.51 121.01 1tr9 h ILE 325 Ca 0.18 -0.52 -0.03 0.00 1.00 0.00 0.00 64.86 65.50 1tr9 h ILE 325 Cb 0.37 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 1tr9 h ILE 325 CO 0.00 0.18 -0.01 -0.33 0.00 0.00 0.00 178.15 177.99 1tr9 h GLU 326 N 0.29 0.31 -0.54 2.37 5.08 -1.19 -1.60 114.58 119.29 1tr9 h GLU 326 Ca 0.09 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1tr9 h GLU 326 Cb 0.17 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 1tr9 h GLU 326 CO -0.01 0.34 0.25 0.37 -1.00 0.00 0.00 179.01 178.96 1tr9 h GLN 327 N 0.30 0.79 -0.04 2.33 4.15 -0.76 -3.34 115.11 118.55 1tr9 h GLN 327 Ca 0.07 -0.12 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1tr9 h GLN 327 Cb 0.22 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.77 1tr9 h GLN 327 CO 0.01 0.66 0.00 1.19 -1.93 0.00 0.00 178.83 178.76 1tr9 n PHE 328 N -4.55 0.04 1.35 3.99 3.01 -1.11 -5.11 117.46 115.07 1tr9 n PHE 328 Ca 0.03 -0.09 0.11 0.00 1.01 0.00 0.00 57.45 58.51 1tr9 n PHE 328 Cb 0.13 -0.01 0.64 0.00 -0.01 0.00 0.00 39.48 40.24 1tr9 n PHE 328 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64