#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tqy s VAL 3 N 0.00 5.12 0.09 2.46 1.01 -1.26 -1.44 120.40 126.37 1tqy s VAL 3 Ca 0.00 0.25 -0.00 0.00 0.00 0.00 0.00 61.98 62.23 1tqy s VAL 3 Cb 0.00 -3.85 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 1tqy s VAL 3 CO 0.00 -0.09 0.25 -0.76 0.00 0.00 0.00 175.10 174.50 1tqy s LEU 4 N 2.16 4.34 -0.43 3.92 1.43 -0.60 -0.57 118.68 128.93 1tqy s LEU 4 Ca 0.15 0.30 -0.17 0.00 -1.03 0.00 0.00 54.13 53.38 1tqy s LEU 4 Cb -0.16 -3.00 0.03 0.00 0.03 0.00 0.00 46.19 43.09 1tqy s LEU 4 CO 0.12 0.13 0.41 -0.63 0.23 0.00 0.00 176.35 176.61 1tqy s ILE 5 N -1.57 5.14 -0.26 -0.59 -1.09 0.25 -1.53 121.20 121.54 1tqy s ILE 5 Ca 0.36 -0.51 0.20 0.00 -2.23 0.00 0.00 60.65 58.47 1tqy s ILE 5 Cb -0.13 -4.03 -0.29 0.00 -1.58 0.00 0.00 42.46 36.43 1tqy s ILE 5 CO 0.28 -0.43 0.55 0.35 -1.23 0.00 0.00 174.94 174.45 1tqy n THR 6 N 5.35 0.00 -3.75 2.92 -2.24 -0.16 -0.56 114.28 115.84 1tqy n THR 6 Ca -0.09 -0.35 -0.13 0.00 -2.27 0.00 0.00 64.05 61.21 1tqy n THR 6 Cb 0.47 0.29 -0.09 0.00 -2.10 0.00 0.00 70.33 68.90 1tqy n THR 6 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1tqy s GLY 7 N -3.95 -0.21 0.03 3.38 0.00 -1.22 -3.97 107.32 101.39 1tqy s GLY 7 Ca -0.04 0.62 0.02 0.00 0.00 0.00 0.00 44.72 45.32 1tqy s GLY 7 CO 0.83 0.43 -0.07 -1.34 0.00 0.00 0.00 173.10 172.96 1tqy s VAL 8 N -0.74 0.45 -0.07 1.40 -7.23 -1.26 -0.12 120.40 112.84 1tqy s VAL 8 Ca -0.08 -0.89 0.00 0.00 -1.81 0.00 0.00 61.98 59.20 1tqy s VAL 8 Cb -0.04 -0.50 0.02 0.00 0.56 0.00 0.00 36.38 36.42 1tqy s VAL 8 CO 0.03 -0.30 -0.04 -0.83 -0.31 0.00 0.00 175.10 173.65 1tqy s GLY 9 N -1.28 0.56 -0.03 2.32 0.00 0.88 -3.93 107.32 105.84 1tqy s GLY 9 Ca -0.08 -0.20 0.05 0.00 0.00 0.00 0.00 44.72 44.49 1tqy s GLY 9 CO 0.00 0.73 -0.18 -1.34 0.00 0.00 0.00 173.10 172.31 1tqy s VAL 10 N 1.42 1.48 -0.25 1.40 -7.23 -1.26 -0.77 120.40 115.18 1tqy s VAL 10 Ca -0.03 -0.77 -0.01 0.00 -1.81 0.00 0.00 61.98 59.36 1tqy s VAL 10 Cb -0.13 -1.25 0.08 0.00 0.56 0.00 0.00 36.38 35.63 1tqy s VAL 10 CO -0.03 0.42 0.04 0.68 -0.31 0.00 0.00 175.10 175.90 1tqy s VAL 11 N -0.21 0.92 0.12 1.32 -7.23 -0.81 -0.37 120.40 114.15 1tqy s VAL 11 Ca 0.02 -1.09 0.04 0.00 -1.81 0.00 0.00 61.98 59.15 1tqy s VAL 11 Cb -0.09 -1.49 -0.04 0.00 0.56 0.00 0.00 36.38 35.31 1tqy s VAL 11 CO 0.01 -0.39 -0.11 0.00 -0.31 0.00 0.00 175.10 174.30 1tqy s ALA 12 N 1.64 1.33 0.48 1.32 0.00 -0.52 -0.95 121.76 125.06 1tqy s ALA 12 Ca 0.03 -1.34 0.17 0.00 0.00 0.00 0.00 51.96 50.82 1tqy s ALA 12 Cb -0.18 0.02 1.18 0.00 0.00 0.00 0.00 23.12 24.15 1tqy s ALA 12 CO -0.15 -0.04 2.04 -1.35 0.00 0.00 0.00 175.76 176.27 1tqy h PRO 13 N 3.21 0.19 -0.45 0.00 0.11 -1.81 -1.58 132.00 131.67 1tqy h PRO 13 Ca -0.37 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1tqy h PRO 13 Cb 1.19 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1tqy h PRO 13 CO 0.57 0.12 0.00 0.27 -0.21 0.00 0.00 178.00 178.76 1tqy n ASN 14 N -4.46 4.24 0.00 -2.05 6.94 -1.26 -4.53 115.26 114.14 1tqy n ASN 14 Ca 0.06 -2.60 0.00 0.00 -0.02 0.00 0.00 54.58 52.01 1tqy n ASN 14 Cb 0.33 -0.51 0.00 0.00 -2.36 0.00 0.00 39.78 37.24 1tqy n ASN 14 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1tqy n GLY 15 N 0.41 0.03 3.47 4.83 0.00 -0.59 -4.35 105.19 108.99 1tqy n GLY 15 Ca 0.22 0.74 -0.43 0.00 0.00 0.00 0.00 46.02 46.54 1tqy n GLY 15 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1tqy s LEU 16 N 0.00 4.79 0.00 0.99 0.20 -1.26 -1.44 118.68 121.96 1tqy s LEU 16 Ca 0.00 -1.95 0.00 0.00 0.69 0.00 0.00 54.13 52.87 1tqy s LEU 16 Cb 0.00 -2.43 0.00 0.00 -0.43 0.00 0.00 46.19 43.33 1tqy s LEU 16 CO 0.00 -1.14 0.00 0.61 -0.29 0.00 0.00 176.35 175.53 1tqy n GLY 17 N 5.72 3.18 0.19 7.98 0.00 0.51 -4.76 105.19 118.01 1tqy n GLY 17 Ca 0.26 -1.90 -0.11 0.00 0.00 0.00 0.00 46.02 44.27 1tqy n GLY 17 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1tqy h LEU 18 N 0.00 -0.43 0.12 0.99 6.46 -1.87 -2.27 115.31 118.30 1tqy h LEU 18 Ca 0.00 0.06 0.02 0.00 -0.12 0.00 0.00 57.88 57.84 1tqy h LEU 18 Cb 0.00 0.18 -0.03 0.00 -0.73 0.00 0.00 40.66 40.08 1tqy h LEU 18 CO 0.00 -0.21 -0.27 0.00 -0.62 0.00 0.00 178.44 177.34 1tqy h ALA 19 N 0.69 -0.46 -0.19 1.25 0.00 -1.96 0.58 119.26 119.17 1tqy h ALA 19 Ca 0.05 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1tqy h ALA 19 Cb 0.31 0.43 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1tqy h ALA 19 CO -0.15 -0.81 -0.07 -1.35 0.00 0.00 0.00 179.25 176.87 1tqy h PRO 20 N -0.48 0.30 0.06 0.00 0.11 -1.85 -2.20 132.00 127.93 1tqy h PRO 20 Ca 0.03 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.08 1tqy h PRO 20 Cb 0.51 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.57 1tqy h PRO 20 CO -0.15 0.39 -0.03 -0.92 -0.21 0.00 0.00 178.00 177.08 1tqy h TYR 21 N 0.29 -0.07 -0.90 0.65 3.20 -0.90 -2.24 116.97 117.00 1tqy h TYR 21 Ca 0.06 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.92 1tqy h TYR 21 Cb 0.32 0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.57 1tqy h TYR 21 CO 0.01 0.33 0.54 2.35 -1.64 0.00 0.00 178.16 179.75 1tqy h TRP 22 N -0.50 1.19 -0.48 -3.82 2.91 -0.83 -0.94 115.95 113.49 1tqy h TRP 22 Ca -0.01 -0.00 -0.03 0.00 1.13 0.00 0.00 58.89 59.98 1tqy h TRP 22 Cb 0.44 -0.39 -0.02 0.00 -0.51 0.00 0.00 29.16 28.68 1tqy h TRP 22 CO 0.06 0.79 0.17 1.03 -1.03 0.00 0.00 178.44 179.47 1tqy h SER 23 N 1.25 0.68 -0.19 2.65 0.87 -1.40 -1.70 113.55 115.70 1tqy h SER 23 Ca 0.32 -0.19 -0.01 0.00 -1.23 0.00 0.00 61.79 60.69 1tqy h SER 23 Cb -0.05 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 61.73 1tqy h SER 23 CO -0.06 0.68 0.08 0.00 -0.53 0.00 0.00 176.83 177.00 1tqy h ALA 24 N 1.02 0.25 -0.17 6.23 0.00 -0.84 -2.40 119.26 123.35 1tqy h ALA 24 Ca 0.16 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.02 1tqy h ALA 24 Cb 0.23 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.89 1tqy h ALA 24 CO -0.01 -0.17 -0.21 0.28 0.00 0.00 0.00 179.25 179.14 1tqy h VAL 25 N 0.17 0.47 0.00 0.00 2.07 -1.04 0.17 116.25 118.09 1tqy h VAL 25 Ca 0.06 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.57 1tqy h VAL 25 Cb 0.15 0.47 -0.00 0.00 -1.52 0.00 0.00 31.29 30.39 1tqy h VAL 25 CO -0.01 0.00 -0.06 -0.07 0.02 0.00 0.00 177.57 177.45 1tqy h LEU 26 N -0.24 0.00 -1.61 2.57 3.38 -1.25 -1.08 115.31 117.07 1tqy h LEU 26 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1tqy h LEU 26 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1tqy h LEU 26 CO -0.31 0.06 -0.01 -0.67 0.09 0.00 0.00 178.44 177.60 1tqy n ASP 27 N -3.79 2.52 -0.76 -0.43 2.03 -0.57 -4.50 116.55 111.04 1tqy n ASP 27 Ca -0.02 -1.83 -0.10 0.00 0.52 0.00 0.00 54.79 53.36 1tqy n ASP 27 Cb 0.16 0.01 -0.04 0.00 -0.72 0.00 0.00 41.12 40.53 1tqy n ASP 27 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1tqy n GLY 28 N 1.30 1.09 3.65 0.27 0.00 0.33 -4.98 105.19 106.84 1tqy n GLY 28 Ca 0.15 -0.58 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 1tqy n GLY 28 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1tqy s ARG 29 N -2.90 4.21 0.42 1.61 0.52 0.29 -4.93 118.95 118.19 1tqy s ARG 29 Ca 0.00 1.10 0.03 0.00 -0.52 0.00 0.00 55.73 56.33 1tqy s ARG 29 Cb 0.00 -3.64 -0.00 0.00 0.52 0.00 0.00 34.95 31.83 1tqy s ARG 29 CO 0.00 -0.56 0.61 -3.38 0.02 0.00 0.00 175.30 172.00 1tqy s HIS 30 N 2.96 3.15 -0.24 -0.53 -3.43 -1.26 -4.40 115.29 111.54 1tqy s HIS 30 Ca 0.38 0.05 0.12 0.00 -0.80 0.00 0.00 55.06 54.82 1tqy s HIS 30 Cb -0.15 -2.25 0.49 0.00 -1.43 0.00 0.00 32.58 29.23 1tqy s HIS 30 CO 0.07 -0.29 1.41 0.41 -2.00 0.00 0.00 174.74 174.33 1tqy n GLY 31 N -1.96 4.71 3.85 -1.38 0.00 0.31 -4.83 105.19 105.89 1tqy n GLY 31 Ca 0.02 -1.18 -0.33 0.00 0.00 0.00 0.00 46.02 44.53 1tqy n GLY 31 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tqy s LEU 32 N -3.11 4.12 0.00 0.99 1.02 -1.26 -3.58 118.68 116.85 1tqy s LEU 32 Ca 0.42 1.27 0.00 0.00 0.02 0.00 0.00 54.13 55.84 1tqy s LEU 32 Cb 0.38 -3.96 0.00 0.00 0.02 0.00 0.00 46.19 42.62 1tqy s LEU 32 CO 0.02 -0.16 0.00 0.61 0.02 0.00 0.00 176.35 176.84 1tqy n GLY 33 N -0.17 -0.79 3.75 -3.19 0.00 -0.78 -4.92 105.19 99.09 1tqy n GLY 33 Ca 0.02 -0.98 -0.38 0.00 0.00 0.00 0.00 46.02 44.68 1tqy n GLY 33 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1tqy s PRO 34 N -2.00 3.15 0.22 1.61 0.02 -1.26 -1.31 135.00 135.44 1tqy s PRO 34 Ca 0.00 2.22 -0.30 0.00 0.02 0.00 0.00 61.00 62.94 1tqy s PRO 34 Cb 0.00 -2.26 -0.09 0.00 0.02 0.00 0.00 34.50 32.18 1tqy s PRO 34 CO 0.00 -1.17 1.20 0.08 -0.33 0.00 0.00 177.00 176.78 1tqy s VAL 35 N -1.31 3.41 0.00 3.83 1.01 0.05 -4.77 120.40 122.63 1tqy s VAL 35 Ca 0.71 1.26 0.00 0.00 0.00 0.00 0.00 61.98 63.95 1tqy s VAL 35 Cb -0.40 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.18 1tqy s VAL 35 CO 0.47 0.23 0.60 0.35 0.00 0.00 0.00 175.10 176.76 1tqy n THR 36 N 2.03 0.27 0.32 3.92 -2.24 -1.26 -4.51 114.28 112.80 1tqy n THR 36 Ca 0.03 -0.59 0.16 0.00 -2.27 0.00 0.00 64.05 61.38 1tqy n THR 36 Cb 0.44 0.93 0.66 0.00 -2.10 0.00 0.00 70.33 70.26 1tqy n THR 36 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1tqy h ARG 37 N 0.00 0.00 -2.57 -0.78 2.47 -1.91 -3.46 114.38 108.13 1tqy h ARG 37 Ca 0.00 0.00 0.14 0.00 -1.26 0.00 0.00 59.98 58.86 1tqy h ARG 37 Cb 0.20 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.48 1tqy h ARG 37 CO 0.00 0.00 0.53 -0.59 0.56 0.00 0.00 179.97 180.47 1tqy s PHE 38 N -3.58 0.05 -0.89 3.04 -0.12 -1.26 -4.97 117.98 110.24 1tqy s PHE 38 Ca 0.02 -0.47 -0.25 0.00 -0.05 0.00 0.00 56.93 56.18 1tqy s PHE 38 Cb 0.09 0.71 0.02 0.00 -0.63 0.00 0.00 43.02 43.21 1tqy s PHE 38 CO 0.47 -1.00 1.54 0.34 -0.05 0.00 0.00 175.22 176.53 1tqy s ASP 39 N -3.29 6.03 0.42 1.98 2.15 -1.26 -4.82 116.67 117.88 1tqy s ASP 39 Ca 0.19 -0.87 0.23 0.00 0.43 0.00 0.00 52.55 52.53 1tqy s ASP 39 Cb -0.03 -2.56 0.48 0.00 -0.30 0.00 0.00 42.92 40.51 1tqy s ASP 39 CO 0.06 -1.92 1.65 -0.37 -0.17 0.00 0.00 175.17 174.42 1tqy h VAL 40 N 6.70 0.26 -0.14 1.11 -1.51 -1.95 -3.32 116.25 117.40 1tqy h VAL 40 Ca 0.01 -1.22 0.04 0.00 -1.23 0.00 0.00 66.70 64.30 1tqy h VAL 40 Cb 1.03 2.01 -0.01 0.00 -2.13 0.00 0.00 31.29 32.19 1tqy h VAL 40 CO 1.33 0.14 0.60 0.77 -1.23 0.00 0.00 177.57 179.17 1tqy h SER 41 N 0.00 0.00 -0.02 4.19 4.64 -1.91 0.30 113.55 120.76 1tqy h SER 41 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1tqy h SER 41 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 1tqy h SER 41 CO 0.02 0.00 0.00 -2.11 -0.87 0.00 0.00 176.83 173.87 1tqy n ARG 42 N -2.93 1.47 -4.37 4.77 1.85 -1.25 -4.87 116.66 111.33 1tqy n ARG 42 Ca 0.02 -0.68 -0.24 0.00 -1.00 0.00 0.00 57.85 55.95 1tqy n ARG 42 Cb 0.67 -1.48 -0.09 0.00 -1.05 0.00 0.00 32.46 30.52 1tqy n ARG 42 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 1tqy s TYR 43 N -1.99 2.51 0.21 2.89 2.02 0.11 -5.05 117.35 118.04 1tqy s TYR 43 Ca 0.40 -0.27 -0.09 0.00 -0.37 0.00 0.00 57.07 56.74 1tqy s TYR 43 Cb 0.21 -1.12 0.17 0.00 -0.40 0.00 0.00 41.96 40.82 1tqy s TYR 43 CO 0.34 0.65 1.84 -1.35 -1.57 0.00 0.00 175.55 175.45 1tqy h PRO 44 N 2.19 1.11 -5.40 -1.71 0.11 -1.89 -3.42 132.00 123.00 1tqy h PRO 44 Ca -0.43 -0.13 -0.61 0.00 0.11 0.00 0.00 66.00 64.94 1tqy h PRO 44 Cb 1.25 -0.22 -0.11 0.00 0.11 0.00 0.00 31.00 32.03 1tqy h PRO 44 CO 0.59 0.82 -0.45 0.00 -0.21 0.00 0.00 178.00 178.75 1tqy s ALA 45 N -5.86 3.71 0.00 -0.75 0.00 -1.26 -4.68 121.76 112.91 1tqy s ALA 45 Ca -0.13 -0.62 0.00 0.00 0.00 0.00 0.00 51.96 51.21 1tqy s ALA 45 Cb 0.15 -2.18 0.00 0.00 0.00 0.00 0.00 23.12 21.09 1tqy s ALA 45 CO 0.81 0.24 0.00 0.25 0.00 0.00 0.00 175.76 177.06 1tqy n THR 46 N 3.21 0.00 -3.65 0.00 -2.24 -1.26 -4.91 114.28 105.42 1tqy n THR 46 Ca -0.16 -0.13 -0.36 0.00 -2.27 0.00 0.00 64.05 61.13 1tqy n THR 46 Cb 0.53 0.60 -0.06 0.00 -2.10 0.00 0.00 70.33 69.30 1tqy n THR 46 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1tqy s LEU 47 N -2.07 4.39 0.21 3.22 1.43 -1.26 -0.77 118.68 123.83 1tqy s LEU 47 Ca 0.00 0.72 -0.20 0.00 -1.03 0.00 0.00 54.13 53.62 1tqy s LEU 47 Cb 0.00 -2.69 0.04 0.00 0.03 0.00 0.00 46.19 43.57 1tqy s LEU 47 CO 0.00 0.26 0.60 0.00 0.23 0.00 0.00 176.35 177.44 1tqy s ALA 48 N -1.25 -1.22 -0.59 4.21 0.00 -0.43 -4.36 121.76 118.12 1tqy s ALA 48 Ca 0.27 -0.02 -0.18 0.00 0.00 0.00 0.00 51.96 52.04 1tqy s ALA 48 Cb -0.14 0.86 0.11 0.00 0.00 0.00 0.00 23.12 23.96 1tqy s ALA 48 CO 0.15 -0.85 0.66 0.20 0.00 0.00 0.00 175.76 175.91 1tqy s GLY 49 N -2.85 1.89 -0.07 0.00 0.00 0.10 -1.87 107.32 104.52 1tqy s GLY 49 Ca 0.07 -2.35 -0.04 0.00 0.00 0.00 0.00 44.72 42.39 1tqy s GLY 49 CO -0.04 1.47 0.12 1.20 0.00 0.00 0.00 173.10 175.86 1tqy s GLN 50 N 2.32 3.32 -0.40 2.90 -0.21 -1.24 -1.00 119.66 125.35 1tqy s GLN 50 Ca 0.10 -0.27 -0.19 0.00 0.02 0.00 0.00 55.36 55.02 1tqy s GLN 50 Cb -0.25 -3.06 0.01 0.00 1.00 0.00 0.00 33.01 30.71 1tqy s GLN 50 CO 0.05 0.72 0.53 0.42 -2.12 0.00 0.00 175.29 174.89 1tqy s ILE 51 N -1.11 4.98 -1.16 1.08 1.01 -1.26 -4.57 121.20 120.17 1tqy s ILE 51 Ca 0.19 0.03 0.15 0.00 0.00 0.00 0.00 60.65 61.01 1tqy s ILE 51 Cb -0.12 -4.07 0.44 0.00 0.01 0.00 0.00 42.46 38.72 1tqy s ILE 51 CO 0.09 -0.41 1.37 0.47 0.00 0.00 0.00 174.94 176.45 1tqy n ASP 52 N 5.86 3.38 -0.68 3.58 8.00 -1.26 -4.49 116.55 130.95 1tqy n ASP 52 Ca -0.05 -2.09 0.06 0.00 0.71 0.00 0.00 54.79 53.42 1tqy n ASP 52 Cb 0.48 -0.34 0.14 0.00 -0.02 0.00 0.00 41.12 41.38 1tqy n ASP 52 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1tqy n ASP 53 N 0.79 1.56 -4.20 -2.24 3.85 -1.26 -4.98 116.55 110.06 1tqy n ASP 53 Ca 0.17 -3.22 -0.34 0.00 -0.71 0.00 0.00 54.79 50.68 1tqy n ASP 53 Cb 0.54 -0.44 -0.14 0.00 -1.35 0.00 0.00 41.12 39.73 1tqy n ASP 53 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.20 176.31 1tqy s PHE 54 N -2.27 3.08 -0.45 2.11 5.36 -1.26 -5.04 117.98 119.51 1tqy s PHE 54 Ca 0.33 -1.57 -0.01 0.00 -0.96 0.00 0.00 56.93 54.73 1tqy s PHE 54 Cb 0.33 -2.06 0.12 0.00 -0.34 0.00 0.00 43.02 41.07 1tqy s PHE 54 CO -0.07 -0.73 0.23 -1.58 -1.46 0.00 0.00 175.22 171.61 1tqy s HIS 55 N 1.32 3.55 0.32 10.12 5.65 -1.26 -4.99 115.29 130.00 1tqy s HIS 55 Ca -0.00 -2.67 0.05 0.00 0.25 0.00 0.00 55.06 52.69 1tqy s HIS 55 Cb -0.17 -3.13 0.86 0.00 -1.18 0.00 0.00 32.58 28.97 1tqy s HIS 55 CO -0.04 -0.92 1.58 0.00 -0.65 0.00 0.00 174.74 174.70 1tqy h ALA 56 N 7.60 1.35 -0.31 1.58 0.00 -1.96 0.23 119.26 127.75 1tqy h ALA 56 Ca -0.08 0.32 0.09 0.00 0.00 0.00 0.00 54.91 55.24 1tqy h ALA 56 Cb 1.01 0.54 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 1tqy h ALA 56 CO 0.67 -0.64 0.45 -1.35 0.00 0.00 0.00 179.25 178.38 1tqy h PRO 57 N 0.02 0.00 0.00 0.00 0.11 -1.95 0.52 132.00 130.70 1tqy h PRO 57 Ca 0.64 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.75 1tqy h PRO 57 Cb 1.41 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.52 1tqy h PRO 57 CO -0.89 0.00 -0.54 -0.25 -0.21 0.00 0.00 178.00 176.11 1tqy n ASP 58 N -3.46 0.54 -0.01 -2.05 8.00 0.79 -4.41 116.55 115.94 1tqy n ASP 58 Ca 0.05 -0.12 -0.02 0.00 0.71 0.00 0.00 54.79 55.42 1tqy n ASP 58 Cb 0.59 0.22 -0.02 0.00 -0.02 0.00 0.00 41.12 41.90 1tqy n ASP 58 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1tqy n HIS 59 N -1.69 0.00 -4.15 1.24 8.25 0.53 -5.04 115.22 114.37 1tqy n HIS 59 Ca 0.05 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.15 1tqy n HIS 59 Cb 0.37 -0.13 -0.08 0.00 1.12 0.00 0.00 29.99 31.27 1tqy n HIS 59 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1tqy s ILE 60 N -2.06 4.83 0.61 1.59 -1.09 0.15 -4.93 121.20 120.30 1tqy s ILE 60 Ca -0.02 -0.05 -0.19 0.00 -2.23 0.00 0.00 60.65 58.16 1tqy s ILE 60 Cb 0.01 -3.08 -0.03 0.00 -1.58 0.00 0.00 42.46 37.78 1tqy s ILE 60 CO 0.10 0.60 1.24 -2.65 -1.23 0.00 0.00 174.94 172.99 1tqy n PRO 61 N 2.18 1.21 -0.09 2.79 -0.02 -1.26 -4.56 135.00 135.25 1tqy n PRO 61 Ca -0.19 0.47 0.07 0.00 -2.02 0.00 0.00 63.50 61.82 1tqy n PRO 61 Cb 0.54 -2.46 0.42 0.00 -0.02 0.00 0.00 33.50 31.98 1tqy n PRO 61 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1tqy h GLY 62 N 0.75 0.71 1.44 -1.23 0.00 -1.96 -2.03 103.07 100.75 1tqy h GLY 62 Ca -0.50 -0.24 0.01 0.00 0.00 0.00 0.00 47.33 46.61 1tqy h GLY 62 CO 0.54 0.19 0.35 -0.09 0.00 0.00 0.00 176.54 177.53 1tqy h ARG 63 N 0.59 0.67 0.00 4.80 2.43 -2.03 -2.98 114.38 117.86 1tqy h ARG 63 Ca 0.24 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 59.24 1tqy h ARG 63 Cb 0.20 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 1tqy h ARG 63 CO -0.07 0.44 -0.80 -0.07 -1.51 0.00 0.00 179.97 177.96 1tqy h LEU 64 N 0.69 0.00 -0.55 3.80 3.38 -1.73 -3.39 115.31 117.51 1tqy h LEU 64 Ca 0.20 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.28 1tqy h LEU 64 Cb -0.03 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.61 1tqy h LEU 64 CO -0.05 0.56 -0.14 -0.07 0.09 0.00 0.00 178.44 178.83 1tqy h LEU 65 N 0.00 -0.51 -1.61 1.67 3.38 -1.38 -2.25 115.31 114.61 1tqy h LEU 65 Ca -0.05 0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 1tqy h LEU 65 Cb 1.47 0.34 -0.02 0.00 0.09 0.00 0.00 40.66 42.54 1tqy h LEU 65 CO 0.06 -0.18 0.18 -0.65 0.09 0.00 0.00 178.44 177.94 1tqy h PRO 66 N 0.00 0.44 -0.60 1.13 0.11 -1.75 -3.09 132.00 128.24 1tqy h PRO 66 Ca 0.27 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.34 1tqy h PRO 66 Cb 0.40 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.42 1tqy h PRO 66 CO -0.57 0.32 0.00 0.00 -0.21 0.00 0.00 178.00 177.54 1tqy n GLN 67 N -4.45 3.13 -4.88 1.05 10.64 -0.89 -4.96 117.38 117.01 1tqy n GLN 67 Ca 0.02 -2.63 -0.26 0.00 -1.83 0.00 0.00 57.00 52.30 1tqy n GLN 67 Cb 0.09 -1.64 -0.16 0.00 -0.86 0.00 0.00 30.24 27.68 1tqy n GLN 67 CO 0.00 0.00 0.00 0.95 -1.83 0.00 0.00 177.06 176.18 1tqy s THR 68 N -1.40 1.47 0.74 -0.39 -4.23 -0.94 -4.61 115.64 106.28 1tqy s THR 68 Ca 0.44 -0.77 -0.11 0.00 -1.18 0.00 0.00 61.69 60.07 1tqy s THR 68 Cb 0.26 -1.24 0.04 0.00 1.34 0.00 0.00 72.50 72.89 1tqy s THR 68 CO 0.25 0.42 1.09 -0.62 -0.54 0.00 0.00 174.62 175.22 1tqy s ASP 69 N -0.21 5.03 0.35 3.99 2.15 -1.26 -4.86 116.67 121.85 1tqy s ASP 69 Ca 0.02 1.30 0.04 0.00 0.43 0.00 0.00 52.55 54.34 1tqy s ASP 69 Cb -0.09 -2.09 0.69 0.00 -0.30 0.00 0.00 42.92 41.13 1tqy s ASP 69 CO 0.01 -1.63 1.96 -0.65 -0.17 0.00 0.00 175.17 174.69 1tqy h PRO 70 N -0.85 0.79 -0.50 4.34 0.11 -1.96 -2.46 132.00 131.48 1tqy h PRO 70 Ca -0.46 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 1tqy h PRO 70 Cb 1.25 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 1tqy h PRO 70 CO 0.61 0.52 0.16 0.66 -0.21 0.00 0.00 178.00 179.74 1tqy h SER 71 N 0.81 0.73 -0.64 -2.05 4.64 -1.90 -2.51 113.55 112.63 1tqy h SER 71 Ca 0.31 -0.21 -0.07 0.00 -0.47 0.00 0.00 61.79 61.36 1tqy h SER 71 Cb 0.20 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 62.07 1tqy h SER 71 CO -0.10 0.74 0.13 0.74 -0.87 0.00 0.00 176.83 177.47 1tqy h THR 72 N 0.68 1.26 -0.75 2.95 2.02 -1.84 -1.00 112.91 116.22 1tqy h THR 72 Ca 0.16 -0.97 -0.00 0.00 0.77 0.00 0.00 66.41 66.37 1tqy h THR 72 Cb 0.27 0.65 -0.04 0.00 -1.74 0.00 0.00 68.15 67.30 1tqy h THR 72 CO -0.01 0.36 0.47 0.03 0.37 0.00 0.00 175.52 176.75 1tqy h ARG 73 N 0.96 1.00 -0.48 6.66 3.08 -1.35 0.13 114.38 124.38 1tqy h ARG 73 Ca 0.20 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 60.13 1tqy h ARG 73 Cb 0.39 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1tqy h ARG 73 CO 0.01 0.69 0.15 -0.07 -1.07 0.00 0.00 179.97 179.68 1tqy h LEU 74 N 1.02 0.71 0.10 3.04 3.38 -1.16 -1.52 115.31 120.87 1tqy h LEU 74 Ca 0.27 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 1tqy h LEU 74 Cb -0.06 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.50 1tqy h LEU 74 CO -0.05 0.73 -0.05 0.00 0.09 0.00 0.00 178.44 179.16 1tqy h ALA 75 N 1.00 -0.13 -0.38 1.53 0.00 -0.60 0.13 119.26 120.81 1tqy h ALA 75 Ca 0.16 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.07 1tqy h ALA 75 Cb 0.28 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1tqy h ALA 75 CO -0.00 -0.58 0.17 -0.07 0.00 0.00 0.00 179.25 178.77 1tqy h LEU 76 N -0.14 0.22 -0.19 0.00 3.38 -0.71 0.63 115.31 118.50 1tqy h LEU 76 Ca -0.01 0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.99 1tqy h LEU 76 Cb 0.11 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1tqy h LEU 76 CO 0.02 0.17 0.11 0.74 0.09 0.00 0.00 178.44 179.56 1tqy h THR 77 N 0.35 1.03 -0.68 0.22 2.02 -1.05 0.15 112.91 114.95 1tqy h THR 77 Ca 0.17 -0.08 -0.01 0.00 0.77 0.00 0.00 66.41 67.26 1tqy h THR 77 Cb 0.11 0.77 -0.03 0.00 -1.74 0.00 0.00 68.15 67.26 1tqy h THR 77 CO -0.14 0.04 0.39 0.00 0.37 0.00 0.00 175.52 176.18 1tqy h ALA 78 N 1.08 0.86 -0.50 6.16 0.00 -0.22 -1.79 119.26 124.85 1tqy h ALA 78 Ca 0.07 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1tqy h ALA 78 Cb -0.01 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1tqy h ALA 78 CO -0.03 0.35 0.24 0.00 0.00 0.00 0.00 179.25 179.81 1tqy h ALA 79 N 1.20 0.65 -0.81 0.00 0.00 0.78 -1.38 119.26 119.69 1tqy h ALA 79 Ca 0.24 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1tqy h ALA 79 Cb -0.00 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1tqy h ALA 79 CO -0.04 0.22 0.50 0.22 0.00 0.00 0.00 179.25 180.15 1tqy h ASP 80 N 0.67 0.96 -0.26 0.00 3.58 -0.71 -1.79 116.42 118.87 1tqy h ASP 80 Ca 0.17 -0.05 -0.08 0.00 0.42 0.00 0.00 57.03 57.49 1tqy h ASP 80 Cb 0.13 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 40.91 1tqy h ASP 80 CO -0.02 0.73 -0.10 -0.50 -2.88 0.00 0.00 179.24 176.48 1tqy h TRP 81 N 1.11 0.71 -0.39 0.28 6.55 -1.06 -2.41 115.95 120.75 1tqy h TRP 81 Ca 0.29 -0.11 -0.11 0.00 0.95 0.00 0.00 58.89 59.91 1tqy h TRP 81 Cb -0.07 -0.19 -0.01 0.00 -0.86 0.00 0.00 29.16 28.03 1tqy h TRP 81 CO -0.01 0.73 -0.21 0.00 -1.05 0.00 0.00 178.44 177.90 1tqy h ALA 82 N 1.29 0.90 -0.29 1.49 0.00 -0.55 0.14 119.26 122.24 1tqy h ALA 82 Ca 0.11 -0.36 -0.16 0.00 0.00 0.00 0.00 54.91 54.50 1tqy h ALA 82 Cb 0.52 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1tqy h ALA 82 CO 0.03 0.62 -0.43 -0.07 0.00 0.00 0.00 179.25 179.41 1tqy h LEU 83 N 0.67 0.88 -0.51 0.00 3.38 -1.18 -2.22 115.31 116.32 1tqy h LEU 83 Ca 0.10 -0.51 -0.16 0.00 0.09 0.00 0.00 57.88 57.40 1tqy h LEU 83 Cb 0.71 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 1tqy h LEU 83 CO 0.05 1.22 -0.74 0.06 0.09 0.00 0.00 178.44 179.12 1tqy h GLN 84 N 0.57 0.00 -0.54 1.13 3.07 -1.36 -0.05 115.11 117.93 1tqy h GLN 84 Ca 0.03 -0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.75 1tqy h GLN 84 Cb 1.02 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 28.56 1tqy h GLN 84 CO 0.10 0.75 0.26 0.22 0.09 0.00 0.00 178.83 180.25 1tqy h ASP 85 N 0.00 0.68 0.11 0.06 -0.00 -0.87 -0.46 116.42 115.94 1tqy h ASP 85 Ca -0.01 -0.06 0.00 0.00 -0.00 0.00 0.00 57.03 56.96 1tqy h ASP 85 Cb 1.32 -0.17 0.00 0.00 -0.00 0.00 0.00 39.33 40.48 1tqy h ASP 85 CO 0.10 0.58 -0.05 0.00 -0.00 0.00 0.00 179.24 179.86 1tqy n ALA 86 N -2.45 2.70 -3.38 -0.78 0.00 -0.85 -4.80 120.51 110.95 1tqy n ALA 86 Ca 0.05 -0.33 -0.24 0.00 0.00 0.00 0.00 53.44 52.92 1tqy n ALA 86 Cb 0.12 -1.30 0.06 0.00 0.00 0.00 0.00 19.45 18.33 1tqy n ALA 86 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1tqy n LYS 87 N -0.50 -6.56 -3.79 0.00 4.01 -0.18 -4.93 118.16 106.21 1tqy n LYS 87 Ca 0.18 0.85 -0.37 0.00 -0.51 0.00 0.00 58.31 58.47 1tqy n LYS 87 Cb 0.27 -5.82 -0.13 0.00 -0.51 0.00 0.00 35.03 28.85 1tqy n LYS 87 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1tqy s ALA 88 N -3.26 3.04 -0.43 7.82 0.00 -0.09 -5.02 121.76 123.82 1tqy s ALA 88 Ca 0.48 -1.30 -0.15 0.00 0.00 0.00 0.00 51.96 50.99 1tqy s ALA 88 Cb -0.21 -2.04 0.04 0.00 0.00 0.00 0.00 23.12 20.91 1tqy s ALA 88 CO 0.59 -0.69 0.32 0.34 0.00 0.00 0.00 175.76 176.31 1tqy s ASP 89 N 1.53 6.08 0.30 0.00 3.68 -1.26 -4.52 116.67 122.48 1tqy s ASP 89 Ca 0.04 -1.04 0.04 0.00 2.13 0.00 0.00 52.55 53.72 1tqy s ASP 89 Cb -0.16 -2.15 0.67 0.00 -1.45 0.00 0.00 42.92 39.82 1tqy s ASP 89 CO 0.02 -0.50 1.82 -0.65 0.13 0.00 0.00 175.17 175.99 1tqy h PRO 90 N 8.65 0.84 0.00 4.34 0.11 -1.93 0.18 132.00 144.19 1tqy h PRO 90 Ca -0.27 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.77 1tqy h PRO 90 Cb 1.12 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.03 1tqy h PRO 90 CO 0.77 0.56 -0.08 0.93 -0.21 0.00 0.00 178.00 179.96 1tqy h GLU 91 N 0.87 0.00 -0.25 1.05 5.08 -1.93 -1.68 114.58 117.71 1tqy h GLU 91 Ca 0.52 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.88 1tqy h GLU 91 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1tqy h GLU 91 CO -0.29 0.08 0.00 0.45 -1.00 0.00 0.00 179.01 178.25 1tqy n SER 92 N -3.38 2.41 -4.50 1.42 2.88 0.03 -4.92 113.62 107.57 1tqy n SER 92 Ca -0.01 -1.84 -0.24 0.00 -1.33 0.00 0.00 58.87 55.45 1tqy n SER 92 Cb 0.25 -0.16 -0.10 0.00 -0.75 0.00 0.00 64.21 63.45 1tqy n SER 92 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1tqy s LEU 93 N -1.53 2.68 -0.23 2.46 1.43 -0.63 -5.01 118.68 117.85 1tqy s LEU 93 Ca 0.34 -1.01 -0.29 0.00 -1.03 0.00 0.00 54.13 52.14 1tqy s LEU 93 Cb 0.19 -1.16 -0.02 0.00 0.03 0.00 0.00 46.19 45.24 1tqy s LEU 93 CO 0.28 -0.00 1.45 -0.89 0.23 0.00 0.00 176.35 177.42 1tqy s THR 94 N -2.50 3.94 0.27 5.49 2.01 -1.26 -4.93 115.64 118.66 1tqy s THR 94 Ca 0.31 1.08 -0.09 0.00 0.31 0.00 0.00 61.69 63.29 1tqy s THR 94 Cb -0.04 -3.90 0.41 0.00 0.01 0.00 0.00 72.50 68.99 1tqy s THR 94 CO 0.16 -0.32 1.57 -2.24 -0.69 0.00 0.00 174.62 173.10 1tqy h ASP 95 N 9.71 -0.89 0.40 3.53 3.04 -1.87 0.58 116.42 130.92 1tqy h ASP 95 Ca -0.30 0.28 0.00 0.00 -3.24 0.00 0.00 57.03 53.77 1tqy h ASP 95 Cb 1.13 0.59 0.00 0.00 -1.04 0.00 0.00 39.33 40.00 1tqy h ASP 95 CO 1.00 -0.31 0.00 -1.22 -2.04 0.00 0.00 179.24 176.68 1tqy n TYR 96 N -5.59 0.73 1.11 4.15 4.01 -1.26 -1.54 117.16 118.77 1tqy n TYR 96 Ca 0.14 0.33 0.09 0.00 -0.16 0.00 0.00 57.90 58.29 1tqy n TYR 96 Cb 0.47 -1.02 0.29 0.00 -0.31 0.00 0.00 39.34 38.77 1tqy n TYR 96 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1tqy n ASP 97 N -2.20 1.71 -3.96 7.72 8.00 0.20 -3.93 116.55 124.10 1tqy n ASP 97 Ca 0.01 -1.82 -0.29 0.00 0.71 0.00 0.00 54.79 53.40 1tqy n ASP 97 Cb 0.14 -0.15 -0.16 0.00 -0.02 0.00 0.00 41.12 40.92 1tqy n ASP 97 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1tqy s MET 98 N -1.69 1.85 0.45 -1.24 -1.94 -0.93 -2.12 119.30 113.67 1tqy s MET 98 Ca 0.29 -0.55 0.07 0.00 -1.71 0.00 0.00 55.69 53.78 1tqy s MET 98 Cb 0.15 -2.05 -0.01 0.00 2.01 0.00 0.00 34.83 34.93 1tqy s MET 98 CO 0.22 -0.34 0.34 0.20 -0.01 0.00 0.00 175.02 175.43 1tqy s GLY 99 N 1.55 2.24 -0.05 -0.03 0.00 -0.18 -0.52 107.32 110.34 1tqy s GLY 99 Ca 0.02 -1.81 -0.02 0.00 0.00 0.00 0.00 44.72 42.92 1tqy s GLY 99 CO -0.09 -1.81 0.04 0.14 0.00 0.00 0.00 173.10 171.38 1tqy s VAL 100 N -2.58 0.02 -0.19 1.40 1.01 -1.25 -1.31 120.40 117.51 1tqy s VAL 100 Ca 0.43 0.33 0.01 0.00 0.00 0.00 0.00 61.98 62.74 1tqy s VAL 100 Cb -0.01 -0.24 0.04 0.00 0.00 0.00 0.00 36.38 36.17 1tqy s VAL 100 CO 0.25 0.19 -0.09 -0.69 0.00 0.00 0.00 175.10 174.76 1tqy s VAL 101 N 2.00 1.51 0.37 2.92 1.01 -0.27 -1.66 120.40 126.27 1tqy s VAL 101 Ca 0.03 -0.92 0.05 0.00 0.00 0.00 0.00 61.98 61.15 1tqy s VAL 101 Cb -0.12 -1.61 -0.07 0.00 0.00 0.00 0.00 36.38 34.57 1tqy s VAL 101 CO -0.03 0.16 0.03 0.42 0.00 0.00 0.00 175.10 175.67 1tqy s THR 102 N 1.45 1.61 0.11 3.92 -4.23 -1.02 -2.39 115.64 115.10 1tqy s THR 102 Ca -0.01 -2.01 0.08 0.00 -1.18 0.00 0.00 61.69 58.58 1tqy s THR 102 Cb -0.16 -2.89 -0.04 0.00 1.34 0.00 0.00 72.50 70.76 1tqy s THR 102 CO -0.08 -0.01 -0.20 0.00 -0.54 0.00 0.00 174.62 173.79 1tqy s ALA 103 N -3.00 1.82 -0.01 3.99 0.00 -0.76 -1.47 121.76 122.34 1tqy s ALA 103 Ca 0.36 -1.29 -0.05 0.00 0.00 0.00 0.00 51.96 50.98 1tqy s ALA 103 Cb 0.09 -0.23 0.00 0.00 0.00 0.00 0.00 23.12 22.99 1tqy s ALA 103 CO 0.17 0.33 0.09 1.21 0.00 0.00 0.00 175.76 177.56 1tqy s ASN 104 N -2.06 0.02 -0.04 0.00 3.84 -0.15 -4.24 114.94 112.32 1tqy s ASN 104 Ca 0.08 -0.12 -0.04 0.00 0.21 0.00 0.00 52.86 52.99 1tqy s ASN 104 Cb -0.09 0.19 -0.02 0.00 -0.55 0.00 0.00 41.25 40.78 1tqy s ASN 104 CO 0.05 -0.24 -0.09 0.00 -2.79 0.00 0.00 177.10 174.03 1tqy n ALA 105 N 2.01 2.54 0.09 1.71 0.00 -1.26 -4.28 120.51 121.32 1tqy n ALA 105 Ca -0.19 -0.25 0.11 0.00 0.00 0.00 0.00 53.44 53.11 1tqy n ALA 105 Cb 0.57 0.35 -0.15 0.00 0.00 0.00 0.00 19.45 20.21 1tqy n ALA 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1tqy n GLY 107 N 1.28 -1.10 3.10 0.00 0.00 -1.26 -3.89 105.19 103.31 1tqy n GLY 107 Ca -0.03 -1.23 -0.43 0.00 0.00 0.00 0.00 46.02 44.33 1tqy n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tqy n GLY 108 N 0.00 4.36 0.27 -0.02 0.00 -0.34 -4.72 105.19 104.74 1tqy n GLY 108 Ca 0.00 -2.19 -0.10 0.00 0.00 0.00 0.00 46.02 43.73 1tqy n GLY 108 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1tqy h PHE 109 N 6.18 1.03 -0.53 1.61 3.57 -1.79 -1.85 116.94 125.16 1tqy h PHE 109 Ca 0.33 -0.20 0.04 0.00 3.53 0.00 0.00 57.97 61.67 1tqy h PHE 109 Cb 0.72 -0.26 -0.04 0.00 2.79 0.00 0.00 35.95 39.16 1tqy h PHE 109 CO 1.14 0.97 0.28 0.22 -2.23 0.00 0.00 178.31 178.69 1tqy h ASP 110 N 0.78 0.42 -0.02 0.41 3.58 -1.87 0.16 116.42 119.89 1tqy h ASP 110 Ca 0.13 0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.61 1tqy h ASP 110 Cb 0.60 -0.06 -0.00 0.00 1.72 0.00 0.00 39.33 41.60 1tqy h ASP 110 CO 0.04 0.29 0.01 0.15 -2.88 0.00 0.00 179.24 176.84 1tqy h PHE 111 N 0.55 0.02 -0.33 0.28 3.04 -1.92 -2.26 116.94 116.32 1tqy h PHE 111 Ca 0.23 -0.00 -0.06 0.00 3.98 0.00 0.00 57.97 62.12 1tqy h PHE 111 Cb 0.11 -0.01 -0.02 0.00 2.56 0.00 0.00 35.95 38.60 1tqy h PHE 111 CO -0.09 0.15 -0.06 0.00 -2.02 0.00 0.00 178.31 176.29 1tqy h THR 112 N -0.11 1.22 -0.83 4.41 1.03 -0.94 -2.17 112.91 115.52 1tqy h THR 112 Ca 0.01 -0.92 -0.03 0.00 -0.01 0.00 0.00 66.41 65.46 1tqy h THR 112 Cb 0.13 1.04 -0.04 0.00 -1.07 0.00 0.00 68.15 68.21 1tqy h THR 112 CO -0.00 0.31 0.40 -0.74 -0.01 0.00 0.00 175.52 175.48 1tqy h HIS 113 N 0.51 1.19 -0.17 0.00 -0.00 -0.47 0.67 115.15 116.88 1tqy h HIS 113 Ca 0.10 -0.06 -0.08 0.00 -0.00 0.00 0.00 60.37 60.33 1tqy h HIS 113 Cb 0.42 -0.37 -0.01 0.00 -0.00 0.00 0.00 27.41 27.45 1tqy h HIS 113 CO 0.01 0.86 -0.27 0.00 -0.00 0.00 0.00 177.93 178.54 1tqy h ARG 114 N 1.18 0.32 -0.17 5.26 3.08 -0.96 -1.73 114.38 121.37 1tqy h ARG 114 Ca 0.29 -0.12 -0.18 0.00 0.07 0.00 0.00 59.98 60.04 1tqy h ARG 114 Cb 0.11 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.14 1tqy h ARG 114 CO -0.04 0.57 -0.64 0.93 -1.07 0.00 0.00 179.97 179.72 1tqy h GLU 115 N 0.29 0.61 -0.40 0.04 4.39 -0.72 -1.86 114.58 116.94 1tqy h GLU 115 Ca 0.04 -0.44 -0.01 0.00 0.34 0.00 0.00 59.36 59.30 1tqy h GLU 115 Cb 0.63 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.33 1tqy h GLU 115 CO 0.05 1.06 0.22 0.74 -1.16 0.00 0.00 179.01 179.92 1tqy h PHE 116 N 0.45 0.54 -0.76 4.33 0.04 -0.64 -1.46 116.94 119.44 1tqy h PHE 116 Ca -0.01 -0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.72 1tqy h PHE 116 Cb 1.22 -0.17 -0.04 0.00 2.20 0.00 0.00 35.95 39.16 1tqy h PHE 116 CO 0.06 0.41 0.36 -0.09 -0.60 0.00 0.00 178.31 178.44 1tqy h ARG 117 N 0.52 1.09 -0.48 1.51 2.43 -1.19 -2.31 114.38 115.95 1tqy h ARG 117 Ca 0.14 -0.16 -0.12 0.00 -0.81 0.00 0.00 59.98 59.03 1tqy h ARG 117 Cb 0.04 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 1tqy h ARG 117 CO -0.02 0.85 -0.19 0.87 -1.51 0.00 0.00 179.97 179.97 1tqy h LYS 118 N 1.08 0.97 -0.12 0.20 1.57 -1.05 -0.43 116.57 118.79 1tqy h LYS 118 Ca 0.26 -0.41 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1tqy h LYS 118 Cb 0.12 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1tqy h LYS 118 CO -0.03 1.08 0.07 1.25 -0.57 0.00 0.00 179.45 181.25 1tqy h LEU 119 N 0.82 0.15 0.00 2.94 6.46 -1.05 -0.03 115.31 124.61 1tqy h LEU 119 Ca 0.11 -0.06 0.00 0.00 -0.12 0.00 0.00 57.88 57.82 1tqy h LEU 119 Cb 0.76 -0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.65 1tqy h LEU 119 CO 0.06 0.16 -0.29 0.79 -0.62 0.00 0.00 178.44 178.54 1tqy n TRP 120 N -4.97 0.01 -0.08 1.25 7.02 -0.89 -1.75 117.44 118.03 1tqy n TRP 120 Ca -0.05 0.00 -0.23 0.00 -1.02 0.00 0.00 57.50 56.21 1tqy n TRP 120 Cb 0.06 -0.36 -0.12 0.00 -2.42 0.00 0.00 31.31 28.46 1tqy n TRP 120 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 1tqy n SER 121 N -1.51 1.96 -0.06 -0.99 2.88 -0.17 -4.78 113.62 110.94 1tqy n SER 121 Ca 0.06 0.32 -0.13 0.00 -1.33 0.00 0.00 58.87 57.79 1tqy n SER 121 Cb 0.34 -0.89 -0.05 0.00 -0.75 0.00 0.00 64.21 62.86 1tqy n SER 121 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1tqy n GLU 122 N -4.08 0.27 0.00 -1.46 -0.58 -0.06 -5.07 120.64 109.66 1tqy n GLU 122 Ca -0.36 0.11 0.00 0.00 -0.42 0.00 0.00 57.16 56.50 1tqy n GLU 122 Cb 0.83 -0.99 0.00 0.00 -0.57 0.00 0.00 31.44 30.71 1tqy n GLU 122 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1tqy n GLY 123 N 2.31 3.28 0.34 0.62 0.00 -0.72 -4.95 105.19 106.08 1tqy n GLY 123 Ca -0.24 -1.40 0.18 0.00 0.00 0.00 0.00 46.02 44.55 1tqy n GLY 123 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1tqy h PRO 124 N 0.00 0.00 0.00 1.61 0.13 -1.86 -2.03 132.00 129.86 1tqy h PRO 124 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1tqy h PRO 124 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1tqy h PRO 124 CO 0.00 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 179.40 1tqy n LYS 125 N -3.32 0.21 0.00 0.86 5.02 -1.26 -2.42 118.16 117.25 1tqy n LYS 125 Ca 0.00 0.36 0.14 0.00 -2.02 0.00 0.00 58.31 56.79 1tqy n LYS 125 Cb 0.35 -1.84 0.45 0.00 -0.02 0.00 0.00 35.03 33.96 1tqy n LYS 125 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1tqy n SER 126 N -2.22 1.75 -4.74 4.39 3.41 -0.76 -4.91 113.62 110.54 1tqy n SER 126 Ca 0.03 -1.57 -0.41 0.00 -0.26 0.00 0.00 58.87 56.66 1tqy n SER 126 Cb 0.28 0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.21 1tqy n SER 126 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1tqy s VAL 127 N -2.01 3.23 0.55 -3.33 1.01 -1.02 -4.93 120.40 113.90 1tqy s VAL 127 Ca 0.36 1.00 -0.22 0.00 0.00 0.00 0.00 61.98 63.12 1tqy s VAL 127 Cb 0.21 -3.64 -0.05 0.00 0.00 0.00 0.00 36.38 32.90 1tqy s VAL 127 CO 0.33 0.14 1.35 -0.24 0.00 0.00 0.00 175.10 176.68 1tqy n SER 128 N 2.73 2.62 0.00 3.32 2.88 -1.26 -4.89 113.62 119.02 1tqy n SER 128 Ca 0.06 0.97 0.09 0.00 -1.33 0.00 0.00 58.87 58.67 1tqy n SER 128 Cb 0.43 -1.57 0.55 0.00 -0.75 0.00 0.00 64.21 62.86 1tqy n SER 128 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1tqy n VAL 129 N -1.07 0.00 0.45 2.46 0.24 -1.26 -2.82 118.33 116.34 1tqy n VAL 129 Ca 0.11 0.00 0.05 0.00 -2.04 0.00 0.00 64.34 62.46 1tqy n VAL 129 Cb 0.45 -0.43 -0.06 0.00 -1.47 0.00 0.00 33.84 32.32 1tqy n VAL 129 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 1tqy n TYR 130 N -0.85 0.00 0.18 6.34 4.01 -1.26 -4.49 117.16 121.10 1tqy n TYR 130 Ca 0.14 0.00 0.16 0.00 -0.16 0.00 0.00 57.90 58.04 1tqy n TYR 130 Cb 0.06 -0.03 0.77 0.00 -0.31 0.00 0.00 39.34 39.84 1tqy n TYR 130 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 1tqy h GLU 131 N 0.00 0.00 0.00 -0.72 4.57 -1.91 0.17 114.58 116.70 1tqy h GLU 131 Ca 0.00 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1tqy h GLU 131 Cb 0.28 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.87 1tqy h GLU 131 CO 0.00 0.00 -0.00 0.66 -1.18 0.00 0.00 179.01 178.49 1tqy h SER 132 N 0.00 0.00 0.00 1.04 4.64 -1.79 -3.32 113.55 114.12 1tqy h SER 132 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1tqy h SER 132 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1tqy h SER 132 CO -0.00 0.00 0.00 2.22 -0.87 0.00 0.00 176.83 178.18 1tqy n PHE 133 N -3.10 0.00 0.49 4.77 -1.74 -0.48 -4.84 117.46 112.56 1tqy n PHE 133 Ca -0.02 0.00 0.13 0.00 -0.56 0.00 0.00 57.45 57.00 1tqy n PHE 133 Cb 0.14 0.01 0.32 0.00 1.52 0.00 0.00 39.48 41.47 1tqy n PHE 133 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1tqy h ALA 134 N 0.00 0.97 0.00 1.98 0.00 -0.81 -3.39 119.26 118.01 1tqy h ALA 134 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.56 1tqy h ALA 134 Cb 0.37 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 1tqy h ALA 134 CO 0.00 0.00 -2.16 1.87 0.00 0.00 0.00 179.25 178.96 1tqy n TRP 135 N -2.52 0.00 -1.42 0.00 -0.00 -1.26 -3.96 117.44 108.29 1tqy n TRP 135 Ca 0.05 0.00 -0.45 0.00 -0.00 0.00 0.00 57.50 57.10 1tqy n TRP 135 Cb 0.46 -0.86 -0.02 0.00 -0.00 0.00 0.00 31.31 30.90 1tqy n TRP 135 CO 0.00 0.00 0.00 1.97 -0.00 0.00 0.00 177.69 179.66 1tqy n PHE 136 N -4.26 -0.56 0.30 5.87 -1.74 -1.26 -1.20 117.46 114.61 1tqy n PHE 136 Ca -0.44 0.79 0.15 0.00 -0.56 0.00 0.00 57.45 57.39 1tqy n PHE 136 Cb 0.79 -1.97 0.80 0.00 1.52 0.00 0.00 39.48 40.62 1tqy n PHE 136 CO 0.00 0.00 0.00 1.88 -0.56 0.00 0.00 176.76 178.08 1tqy h TYR 137 N 0.97 0.00 -0.00 2.97 0.05 -1.94 -0.75 116.97 118.26 1tqy h TYR 137 Ca -0.34 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.44 1tqy h TYR 137 Cb 1.42 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.16 1tqy h TYR 137 CO 0.39 0.00 -0.13 0.00 -1.05 0.00 0.00 178.16 177.37 1tqy n ALA 138 N -1.86 2.80 -0.29 3.88 0.00 -1.26 -4.46 120.51 119.32 1tqy n ALA 138 Ca -0.02 -0.30 0.10 0.00 0.00 0.00 0.00 53.44 53.22 1tqy n ALA 138 Cb 0.31 -1.30 0.26 0.00 0.00 0.00 0.00 19.45 18.72 1tqy n ALA 138 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1tqy h VAL 139 N 0.74 0.51 -0.14 0.00 3.04 -1.38 -2.25 116.25 116.77 1tqy h VAL 139 Ca 0.00 -0.13 -0.15 0.00 -1.01 0.00 0.00 66.70 65.41 1tqy h VAL 139 Cb 0.38 0.10 -0.01 0.00 -2.01 0.00 0.00 31.29 29.75 1tqy h VAL 139 CO 0.00 0.07 -0.56 0.78 -1.01 0.00 0.00 177.57 176.85 1tqy h ASN 140 N 0.38 0.49 -0.06 3.17 2.35 -1.84 -1.75 115.58 118.32 1tqy h ASN 140 Ca 0.50 -0.26 -0.00 0.00 -0.55 0.00 0.00 56.30 55.98 1tqy h ASN 140 Cb 0.90 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 39.12 1tqy h ASN 140 CO -0.51 0.95 0.02 0.74 -1.65 0.00 0.00 177.43 176.98 1tqy h THR 141 N 0.34 1.16 -0.24 2.81 2.02 -1.73 -1.19 112.91 116.08 1tqy h THR 141 Ca 0.00 -0.48 0.00 0.00 0.77 0.00 0.00 66.41 66.71 1tqy h THR 141 Cb 1.08 1.37 -0.01 0.00 -1.74 0.00 0.00 68.15 68.85 1tqy h THR 141 CO 0.10 0.13 0.16 1.23 0.37 0.00 0.00 175.52 177.51 1tqy h GLY 142 N -0.08 0.34 1.03 2.16 0.00 -1.38 -0.85 103.07 104.29 1tqy h GLY 142 Ca 0.02 -0.13 -0.06 0.00 0.00 0.00 0.00 47.33 47.16 1tqy h GLY 142 CO -0.00 0.13 0.17 1.46 0.00 0.00 0.00 176.54 178.30 1tqy h GLN 143 N 0.32 1.03 -0.17 4.80 1.08 -1.30 -0.65 115.11 120.22 1tqy h GLN 143 Ca 0.09 -0.24 -0.02 0.00 -1.45 0.00 0.00 58.65 57.02 1tqy h GLN 143 Cb -0.03 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 27.26 1tqy h GLN 143 CO -0.02 0.92 0.02 0.82 -0.95 0.00 0.00 178.83 179.62 1tqy h ILE 144 N 0.96 1.23 -0.22 2.54 2.04 -1.08 -1.30 117.51 121.68 1tqy h ILE 144 Ca 0.21 -0.76 0.06 0.00 1.00 0.00 0.00 64.86 65.36 1tqy h ILE 144 Cb 0.34 1.41 -0.06 0.00 -0.74 0.00 0.00 36.82 37.77 1tqy h ILE 144 CO -0.00 0.23 -0.20 -1.28 0.00 0.00 0.00 178.15 176.90 1tqy h SER 145 N 0.06 -0.64 -0.55 1.72 0.87 -0.97 -2.06 113.55 111.97 1tqy h SER 145 Ca 0.05 0.12 -0.03 0.00 -1.23 0.00 0.00 61.79 60.71 1tqy h SER 145 Cb 0.33 0.31 -0.02 0.00 -0.44 0.00 0.00 62.40 62.58 1tqy h SER 145 CO 0.00 -0.24 0.24 0.40 -0.53 0.00 0.00 176.83 176.70 1tqy h ILE 146 N -0.21 1.21 -0.49 2.23 2.04 -1.07 -0.79 117.51 120.43 1tqy h ILE 146 Ca 0.13 -0.64 -0.02 0.00 1.00 0.00 0.00 64.86 65.33 1tqy h ILE 146 Cb 0.41 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 1tqy h ILE 146 CO -0.34 0.25 0.22 -0.09 0.00 0.00 0.00 178.15 178.18 1tqy h ARG 147 N 0.75 0.68 -0.43 2.37 2.43 -0.82 -3.06 114.38 116.29 1tqy h ARG 147 Ca 0.19 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1tqy h ARG 147 Cb 0.16 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.58 1tqy h ARG 147 CO -0.02 0.54 0.00 0.72 -1.51 0.00 0.00 179.97 179.71 1tqy n HIS 148 N -4.37 0.72 -3.62 2.20 8.25 -0.81 -4.98 115.22 112.60 1tqy n HIS 148 Ca 0.04 -0.56 -0.24 0.00 -0.26 0.00 0.00 57.72 56.70 1tqy n HIS 148 Cb 0.13 -0.08 0.07 0.00 1.12 0.00 0.00 29.99 31.23 1tqy n HIS 148 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1tqy n GLY 149 N 0.63 -0.52 3.55 -1.41 0.00 -0.43 -4.67 105.19 102.35 1tqy n GLY 149 Ca 0.16 0.23 -0.41 0.00 0.00 0.00 0.00 46.02 46.01 1tqy n GLY 149 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1tqy s MET 150 N -6.24 3.63 0.00 1.61 -1.94 -0.44 -4.56 119.30 111.36 1tqy s MET 150 Ca 0.52 -0.29 0.09 0.00 -1.71 0.00 0.00 55.69 54.30 1tqy s MET 150 Cb -0.23 -3.79 0.21 0.00 2.01 0.00 0.00 34.83 33.02 1tqy s MET 150 CO 0.74 -0.53 1.10 0.54 -0.01 0.00 0.00 175.02 176.86 1tqy n ARG 151 N 5.48 2.18 -1.61 2.03 1.74 -0.59 -4.70 116.66 121.19 1tqy n ARG 151 Ca -0.08 -1.71 -0.29 0.00 -0.77 0.00 0.00 57.85 55.00 1tqy n ARG 151 Cb 0.49 -1.21 0.16 0.00 -1.02 0.00 0.00 32.46 30.88 1tqy n ARG 151 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1tqy s GLY 152 N -0.94 1.63 0.15 -0.13 0.00 0.33 -4.71 107.32 103.65 1tqy s GLY 152 Ca 0.17 -0.78 -0.34 0.00 0.00 0.00 0.00 44.72 43.77 1tqy s GLY 152 CO 0.13 -0.12 1.39 -1.05 0.00 0.00 0.00 173.10 173.44 1tqy n PRO 153 N -3.86 1.58 -4.23 2.90 -0.02 -1.26 -4.54 135.00 125.55 1tqy n PRO 153 Ca 0.10 0.57 -0.14 0.00 -2.02 0.00 0.00 63.50 62.01 1tqy n PRO 153 Cb 0.60 -2.22 -0.10 0.00 -0.02 0.00 0.00 33.50 31.75 1tqy n PRO 153 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1tqy s SER 154 N 0.50 0.50 0.24 2.55 0.01 -1.26 -3.75 113.70 112.49 1tqy s SER 154 Ca 0.78 -1.42 -0.21 0.00 1.31 0.00 0.00 55.95 56.42 1tqy s SER 154 Cb -0.81 0.35 0.07 0.00 0.21 0.00 0.00 66.02 65.84 1tqy s SER 154 CO 0.45 -0.84 0.95 -0.55 0.41 0.00 0.00 173.24 173.66 1tqy s SER 155 N -3.21 -0.04 -0.12 2.44 0.15 -0.66 -4.96 113.70 107.30 1tqy s SER 155 Ca 0.39 -0.75 -0.06 0.00 0.70 0.00 0.00 55.95 56.22 1tqy s SER 155 Cb 0.07 0.60 0.05 0.00 -1.71 0.00 0.00 66.02 65.03 1tqy s SER 155 CO 0.14 -1.18 0.28 0.00 1.20 0.00 0.00 173.24 173.68 1tqy s ALA 156 N -2.47 -0.66 0.25 5.45 0.00 -1.26 -2.43 121.76 120.64 1tqy s ALA 156 Ca 0.18 1.11 0.11 0.00 0.00 0.00 0.00 51.96 53.37 1tqy s ALA 156 Cb -0.03 -0.70 -0.05 0.00 0.00 0.00 0.00 23.12 22.34 1tqy s ALA 156 CO 0.06 -0.21 -0.18 -0.51 0.00 0.00 0.00 175.76 174.92 1tqy s LEU 157 N 1.30 2.63 -0.04 0.00 1.43 -0.54 -4.97 118.68 118.48 1tqy s LEU 157 Ca -0.09 -0.92 -0.01 0.00 -1.03 0.00 0.00 54.13 52.08 1tqy s LEU 157 Cb -0.10 -1.22 0.03 0.00 0.03 0.00 0.00 46.19 44.93 1tqy s LEU 157 CO -0.09 0.06 0.02 -0.69 0.23 0.00 0.00 176.35 175.88 1tqy s VAL 158 N -2.22 0.14 -0.31 -1.59 1.01 -1.26 -0.97 120.40 115.20 1tqy s VAL 158 Ca 0.27 0.20 0.06 0.00 0.00 0.00 0.00 61.98 62.52 1tqy s VAL 158 Cb -0.06 -0.30 0.23 0.00 0.00 0.00 0.00 36.38 36.25 1tqy s VAL 158 CO 0.14 0.19 1.18 0.00 0.00 0.00 0.00 175.10 176.61 1tqy n ALA 159 N 4.78 -0.07 -0.02 5.51 0.00 -1.26 -4.94 120.51 124.50 1tqy n ALA 159 Ca -0.14 -0.78 0.00 0.00 0.00 0.00 0.00 53.44 52.52 1tqy n ALA 159 Cb 0.50 -0.91 0.00 0.00 0.00 0.00 0.00 19.45 19.04 1tqy n ALA 159 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1tqy n GLU 160 N -0.67 0.00 0.08 0.00 0.00 -1.26 -0.74 120.64 118.04 1tqy n GLU 160 Ca -0.14 0.00 0.10 0.00 0.00 0.00 0.00 57.16 57.12 1tqy n GLU 160 Cb 0.74 0.00 0.42 0.00 0.00 0.00 0.00 31.44 32.60 1tqy n GLU 160 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.13 178.07 1tqy n GLN 161 N 14.00 0.12 0.08 5.31 7.27 -1.26 -2.16 117.38 140.74 1tqy n GLN 161 Ca 0.00 0.35 -0.04 0.00 0.07 0.00 0.00 57.00 57.38 1tqy n GLN 161 Cb 0.00 -1.72 -0.05 0.00 2.41 0.00 0.00 30.24 30.88 1tqy n GLN 161 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1tqy h ALA 162 N 2.36 0.49 -0.75 1.69 0.00 -0.90 -3.37 119.26 118.78 1tqy h ALA 162 Ca 0.00 -0.78 0.14 0.00 0.00 0.00 0.00 54.91 54.26 1tqy h ALA 162 Cb 0.32 -0.14 -0.14 0.00 0.00 0.00 0.00 17.79 17.83 1tqy h ALA 162 CO 0.00 1.07 -0.29 0.78 0.00 0.00 0.00 179.25 180.81 1tqy h GLY 163 N 2.92 0.19 0.72 0.00 0.00 -0.70 -2.22 103.07 103.98 1tqy h GLY 163 Ca -0.01 0.39 0.09 0.00 0.00 0.00 0.00 47.33 47.80 1tqy h GLY 163 CO 0.11 -0.24 0.60 -1.33 0.00 0.00 0.00 176.54 175.68 1tqy h GLY 164 N -0.07 1.38 1.10 4.60 0.00 -1.73 0.11 103.07 108.46 1tqy h GLY 164 Ca 0.31 -0.40 -0.17 0.00 0.00 0.00 0.00 47.33 47.07 1tqy h GLY 164 CO -0.80 0.24 -0.48 -2.00 0.00 0.00 0.00 176.54 173.50 1tqy h LEU 165 N 0.98 0.93 -1.29 3.11 5.85 -1.67 -2.93 115.31 120.29 1tqy h LEU 165 Ca 0.42 -0.52 0.04 0.00 0.84 0.00 0.00 57.88 58.66 1tqy h LEU 165 Cb 0.34 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 1tqy h LEU 165 CO -0.18 1.27 0.50 0.44 -0.34 0.00 0.00 178.44 180.13 1tqy h ASP 166 N 0.62 0.80 -0.40 1.25 3.45 -0.57 -1.77 116.42 119.78 1tqy h ASP 166 Ca 0.02 -0.01 -0.05 0.00 0.43 0.00 0.00 57.03 57.43 1tqy h ASP 166 Cb 1.09 -0.18 -0.02 0.00 -0.56 0.00 0.00 39.33 39.66 1tqy h ASP 166 CO 0.11 0.55 0.06 0.00 -1.57 0.00 0.00 179.24 178.39 1tqy h ALA 167 N 1.56 0.53 -0.61 3.45 0.00 -0.76 0.21 119.26 123.63 1tqy h ALA 167 Ca 0.30 -0.22 0.07 0.00 0.00 0.00 0.00 54.91 55.07 1tqy h ALA 167 Cb 0.06 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 1tqy h ALA 167 CO -0.09 0.25 0.29 -0.07 0.00 0.00 0.00 179.25 179.63 1tqy h LEU 168 N 0.52 0.38 -0.74 0.00 4.07 -1.25 0.65 115.31 118.93 1tqy h LEU 168 Ca 0.12 0.05 -0.07 0.00 0.08 0.00 0.00 57.88 58.07 1tqy h LEU 168 Cb 0.37 -0.01 -0.03 0.00 1.08 0.00 0.00 40.66 42.07 1tqy h LEU 168 CO 0.01 0.24 0.19 1.23 -1.08 0.00 0.00 178.44 179.03 1tqy h GLY 169 N 0.53 1.23 1.12 0.83 0.00 -0.85 -0.54 103.07 105.39 1tqy h GLY 169 Ca 0.29 -0.76 -0.09 0.00 0.00 0.00 0.00 47.33 46.78 1tqy h GLY 169 CO -0.23 0.71 0.05 0.84 0.00 0.00 0.00 176.54 177.90 1tqy h HIS 170 N 1.09 1.14 -0.65 5.60 -0.00 0.65 -2.02 115.15 120.96 1tqy h HIS 170 Ca 0.23 -0.18 -0.05 0.00 -0.00 0.00 0.00 60.37 60.38 1tqy h HIS 170 Cb 0.35 -0.31 -0.03 0.00 -0.00 0.00 0.00 27.41 27.43 1tqy h HIS 170 CO 0.03 0.98 0.22 0.00 -0.00 0.00 0.00 177.93 179.17 1tqy h ALA 171 N 1.06 0.85 -0.62 5.26 0.00 0.76 -1.63 119.26 124.94 1tqy h ALA 171 Ca 0.18 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 54.94 1tqy h ALA 171 Cb 0.50 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 1tqy h ALA 171 CO 0.02 0.51 0.34 -0.09 0.00 0.00 0.00 179.25 180.03 1tqy h ARG 172 N 0.94 0.63 -0.27 0.00 2.43 -0.76 -0.67 114.38 116.67 1tqy h ARG 172 Ca 0.21 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1tqy h ARG 172 Cb 0.26 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 1tqy h ARG 172 CO -0.01 0.42 0.17 -0.09 -1.51 0.00 0.00 179.97 178.95 1tqy h ARG 173 N 0.65 0.37 -0.52 0.20 2.43 -0.91 -1.73 114.38 114.87 1tqy h ARG 173 Ca 0.27 -0.03 0.06 0.00 -0.81 0.00 0.00 59.98 59.47 1tqy h ARG 173 Cb 0.14 -0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.56 1tqy h ARG 173 CO -0.16 0.28 0.23 1.15 -1.51 0.00 0.00 179.97 179.96 1tqy h THR 174 N 0.35 0.89 -0.51 0.20 2.02 -0.60 -1.68 112.91 113.58 1tqy h THR 174 Ca 0.10 -0.15 -0.00 0.00 0.77 0.00 0.00 66.41 67.13 1tqy h THR 174 Cb 0.00 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 1tqy h THR 174 CO -0.02 0.08 0.31 0.40 0.37 0.00 0.00 175.52 176.67 1tqy h ILE 175 N 0.45 1.15 0.00 3.11 2.04 -0.88 -1.46 117.51 121.91 1tqy h ILE 175 Ca 0.24 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.78 1tqy h ILE 175 Cb 0.21 0.45 0.00 0.00 -0.74 0.00 0.00 36.82 36.74 1tqy h ILE 175 CO -0.21 0.15 0.00 0.03 0.00 0.00 0.00 178.15 178.12 1tqy h ARG 176 N 0.68 0.00 0.00 2.37 3.08 -0.63 -2.26 114.38 117.62 1tqy h ARG 176 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.23 1tqy h ARG 176 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.02 1tqy h ARG 176 CO -0.04 0.00 -0.68 0.54 -1.07 0.00 0.00 179.97 178.72 1tqy n ARG 177 N -2.69 0.09 0.00 0.04 1.74 -0.58 -4.95 116.66 110.31 1tqy n ARG 177 Ca -0.00 0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 1tqy n ARG 177 Cb 0.17 -1.54 0.00 0.00 -1.02 0.00 0.00 32.46 30.07 1tqy n ARG 177 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1tqy n GLY 178 N 1.46 0.60 3.51 -0.13 0.00 -0.85 -5.10 105.19 104.68 1tqy n GLY 178 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 1tqy n GLY 178 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1tqy s THR 179 N 0.00 4.79 0.39 2.61 2.01 -1.13 -4.95 115.64 119.37 1tqy s THR 179 Ca 0.00 0.10 0.12 0.00 0.31 0.00 0.00 61.69 62.22 1tqy s THR 179 Cb 0.00 -4.24 0.34 0.00 0.01 0.00 0.00 72.50 68.61 1tqy s THR 179 CO 0.00 -0.65 1.88 -0.65 -0.69 0.00 0.00 174.62 174.51 1tqy h PRO 180 N 8.92 0.54 -3.96 4.92 0.11 -1.82 -3.33 132.00 137.39 1tqy h PRO 180 Ca -0.26 -0.03 -0.30 0.00 0.11 0.00 0.00 66.00 65.52 1tqy h PRO 180 Cb 1.09 -0.12 -0.30 0.00 0.11 0.00 0.00 31.00 31.78 1tqy h PRO 180 CO 0.92 0.36 -0.74 -1.17 -0.21 0.00 0.00 178.00 177.15 1tqy s LEU 181 N -9.61 1.78 -0.03 2.35 0.20 -0.90 -0.85 118.68 111.61 1tqy s LEU 181 Ca -0.09 -0.04 -0.01 0.00 0.69 0.00 0.00 54.13 54.68 1tqy s LEU 181 Cb 0.22 -0.17 0.03 0.00 -0.43 0.00 0.00 46.19 45.84 1tqy s LEU 181 CO 0.78 -0.00 0.03 -0.69 -0.29 0.00 0.00 176.35 176.17 1tqy s VAL 182 N 0.23 0.05 -0.30 1.68 1.01 0.10 -1.01 120.40 122.16 1tqy s VAL 182 Ca -0.02 0.22 -0.19 0.00 0.00 0.00 0.00 61.98 61.99 1tqy s VAL 182 Cb -0.05 -0.21 -0.01 0.00 0.00 0.00 0.00 36.38 36.11 1tqy s VAL 182 CO -0.01 0.15 0.59 -0.69 0.00 0.00 0.00 175.10 175.14 1tqy s VAL 183 N 1.45 4.98 0.05 2.92 1.01 -0.42 -1.12 120.40 129.27 1tqy s VAL 183 Ca -0.04 0.80 0.01 0.00 0.00 0.00 0.00 61.98 62.74 1tqy s VAL 183 Cb -0.13 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 32.27 1tqy s VAL 183 CO -0.03 -0.10 -0.05 -0.55 0.00 0.00 0.00 175.10 174.38 1tqy s SER 184 N 1.63 0.65 0.00 3.32 0.15 -0.11 -1.12 113.70 118.23 1tqy s SER 184 Ca 0.23 -0.77 0.00 0.00 0.70 0.00 0.00 55.95 56.12 1tqy s SER 184 Cb -0.15 0.11 0.00 0.00 -1.71 0.00 0.00 66.02 64.27 1tqy s SER 184 CO 0.11 -0.40 0.00 0.61 1.20 0.00 0.00 173.24 174.76 1tqy n GLY 185 N 0.78 -0.26 3.63 9.45 0.00 -1.00 -0.01 105.19 117.77 1tqy n GLY 185 Ca -0.18 -0.91 -0.03 0.00 0.00 0.00 0.00 46.02 44.90 1tqy n GLY 185 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tqy s GLY 186 N 0.00 -0.09 -0.07 -0.02 0.00 -0.58 -1.82 107.32 104.73 1tqy s GLY 186 Ca 0.00 2.27 -0.10 0.00 0.00 0.00 0.00 44.72 46.89 1tqy s GLY 186 CO 0.00 0.85 0.26 0.14 0.00 0.00 0.00 173.10 174.34 1tqy s VAL 187 N -1.61 0.02 0.08 1.40 1.01 -1.26 -2.03 120.40 118.01 1tqy s VAL 187 Ca 0.09 -0.15 -0.00 0.00 0.00 0.00 0.00 61.98 61.92 1tqy s VAL 187 Cb -0.01 -0.42 -0.04 0.00 0.00 0.00 0.00 36.38 35.91 1tqy s VAL 187 CO -0.05 -0.08 -0.02 -1.81 0.00 0.00 0.00 175.10 173.14 1tqy s ASP 188 N -0.26 0.58 -0.29 3.32 1.11 -1.05 -4.72 116.67 115.36 1tqy s ASP 188 Ca -0.04 -1.05 -0.15 0.00 0.18 0.00 0.00 52.55 51.48 1tqy s ASP 188 Cb -0.03 0.20 0.15 0.00 1.07 0.00 0.00 42.92 44.31 1tqy s ASP 188 CO 0.01 -0.61 0.97 -0.55 1.18 0.00 0.00 175.17 176.17 1tqy s SER 189 N -2.98 -0.56 -0.43 0.27 0.15 -1.26 -1.11 113.70 107.79 1tqy s SER 189 Ca 0.12 0.84 0.08 0.00 0.70 0.00 0.00 55.95 57.69 1tqy s SER 189 Cb 0.07 1.40 0.27 0.00 -1.71 0.00 0.00 66.02 66.05 1tqy s SER 189 CO -0.06 -0.13 0.75 0.00 1.20 0.00 0.00 173.24 175.00 1tqy n ALA 190 N 4.20 0.73 -1.39 5.45 0.00 -1.26 -4.50 120.51 123.74 1tqy n ALA 190 Ca -0.15 -2.52 -0.23 0.00 0.00 0.00 0.00 53.44 50.54 1tqy n ALA 190 Cb 0.56 -1.04 0.14 0.00 0.00 0.00 0.00 19.45 19.10 1tqy n ALA 190 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1tqy n LEU 191 N 1.15 6.27 -4.91 0.00 4.77 -1.26 -3.72 117.00 119.30 1tqy n LEU 191 Ca 0.16 -3.96 -0.20 0.00 -0.03 0.00 0.00 56.01 51.98 1tqy n LEU 191 Cb 0.61 -0.79 -0.02 0.00 -2.33 0.00 0.00 43.42 40.89 1tqy n LEU 191 CO 0.12 1.33 0.02 1.51 -1.33 0.00 0.00 177.39 179.04 1tqy s ASP 192 N -1.96 5.31 0.21 -1.43 1.47 -1.26 -4.72 116.67 114.29 1tqy s ASP 192 Ca 0.56 -0.57 -0.10 0.00 1.18 0.00 0.00 52.55 53.62 1tqy s ASP 192 Cb 0.47 -0.74 0.29 0.00 -0.34 0.00 0.00 42.92 42.60 1tqy s ASP 192 CO 0.04 -0.59 1.72 -0.65 0.68 0.00 0.00 175.17 176.37 1tqy h PRO 193 N 0.99 0.29 -0.24 2.11 0.11 -1.93 0.02 132.00 133.35 1tqy h PRO 193 Ca -0.42 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 65.56 1tqy h PRO 193 Cb 1.27 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1tqy h PRO 193 CO 0.55 0.19 -0.29 2.35 -0.21 0.00 0.00 178.00 180.59 1tqy h TRP 194 N 0.30 0.75 -0.15 0.65 7.01 -1.96 -1.54 115.95 121.01 1tqy h TRP 194 Ca 0.31 -0.24 -0.04 0.00 2.11 0.00 0.00 58.89 61.04 1tqy h TRP 194 Cb 0.44 -0.15 -0.01 0.00 -2.10 0.00 0.00 29.16 27.34 1tqy h TRP 194 CO -0.22 0.96 -0.07 0.78 -2.79 0.00 0.00 178.44 177.10 1tqy h GLY 195 N 0.32 0.25 0.65 2.65 0.00 -1.76 -0.33 103.07 104.84 1tqy h GLY 195 Ca 0.03 -0.13 -0.05 0.00 0.00 0.00 0.00 47.33 47.17 1tqy h GLY 195 CO 0.07 0.13 -0.16 -0.25 0.00 0.00 0.00 176.54 176.33 1tqy h TRP 196 N 0.22 0.33 -0.05 5.60 2.91 -0.83 -1.94 115.95 122.20 1tqy h TRP 196 Ca 0.05 -0.12 -0.09 0.00 1.13 0.00 0.00 58.89 59.86 1tqy h TRP 196 Cb 0.27 -0.06 -0.01 0.00 -0.51 0.00 0.00 29.16 28.85 1tqy h TRP 196 CO 0.00 0.76 -0.40 -0.24 -1.03 0.00 0.00 178.44 177.53 1tqy h VAL 197 N -0.20 1.30 -0.53 2.65 3.04 -1.11 -1.55 116.25 119.83 1tqy h VAL 197 Ca 0.00 -1.42 -0.08 0.00 -1.01 0.00 0.00 66.70 64.20 1tqy h VAL 197 Cb 0.73 1.71 -0.02 0.00 -2.01 0.00 0.00 31.29 31.70 1tqy h VAL 197 CO 0.04 0.41 0.04 0.28 -1.01 0.00 0.00 177.57 177.32 1tqy h SER 198 N 0.08 0.89 -0.51 3.17 0.02 -1.00 -1.20 113.55 115.01 1tqy h SER 198 Ca 0.01 -0.29 -0.06 0.00 -0.84 0.00 0.00 61.79 60.61 1tqy h SER 198 Cb 0.74 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 63.02 1tqy h SER 198 CO 0.06 0.96 0.12 1.56 -1.14 0.00 0.00 176.83 178.39 1tqy h GLN 199 N 0.80 0.87 -0.47 3.45 4.20 -0.76 -1.75 115.11 121.45 1tqy h GLN 199 Ca 0.16 -0.19 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 1tqy h GLN 199 Cb 0.48 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.11 1tqy h GLN 199 CO 0.02 0.79 0.14 0.82 -0.67 0.00 0.00 178.83 179.93 1tqy h ILE 200 N 0.84 1.20 0.00 2.54 2.04 -0.83 -1.97 117.51 121.32 1tqy h ILE 200 Ca 0.18 -0.67 0.00 0.00 1.00 0.00 0.00 64.86 65.37 1tqy h ILE 200 Cb 0.32 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1tqy h ILE 200 CO 0.00 0.25 0.00 0.00 0.00 0.00 0.00 178.15 178.40 1tqy n ALA 201 N -2.47 1.07 0.28 1.87 0.00 -0.50 -0.88 120.51 119.88 1tqy n ALA 201 Ca 0.03 0.09 0.17 0.00 0.00 0.00 0.00 53.44 53.73 1tqy n ALA 201 Cb 0.19 -1.16 0.65 0.00 0.00 0.00 0.00 19.45 19.13 1tqy n ALA 201 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1tqy h SER 202 N 0.00 0.00 -0.17 0.00 4.64 -1.38 -3.46 113.55 113.18 1tqy h SER 202 Ca 0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 1tqy h SER 202 Cb 0.02 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.09 1tqy h SER 202 CO 0.00 0.00 -0.06 0.61 -0.87 0.00 0.00 176.83 176.51 1tqy n GLY 203 N 0.10 0.56 0.00 -0.77 0.00 -0.06 -4.85 105.19 100.17 1tqy n GLY 203 Ca 0.01 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1tqy n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tqy n ARG 204 N -1.56 2.71 -3.24 1.61 1.74 -1.26 -5.04 116.66 111.62 1tqy n ARG 204 Ca -0.03 -1.42 -0.38 0.00 -0.77 0.00 0.00 57.85 55.24 1tqy n ARG 204 Cb 0.28 -0.98 -0.06 0.00 -1.02 0.00 0.00 32.46 30.68 1tqy n ARG 204 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1tqy s ILE 205 N -0.92 5.09 0.28 0.55 1.01 -1.26 -0.86 121.20 125.09 1tqy s ILE 205 Ca 0.00 1.11 -0.30 0.00 0.00 0.00 0.00 60.65 61.46 1tqy s ILE 205 Cb 0.00 -3.88 -0.11 0.00 0.01 0.00 0.00 42.46 38.48 1tqy s ILE 205 CO 0.00 0.34 1.49 -0.55 0.00 0.00 0.00 174.94 176.22 1tqy s SER 206 N 0.42 6.54 -0.11 3.58 0.15 0.50 -4.77 113.70 120.01 1tqy s SER 206 Ca 0.29 2.79 0.17 0.00 0.70 0.00 0.00 55.95 59.91 1tqy s SER 206 Cb -0.16 -2.63 0.66 0.00 -1.71 0.00 0.00 66.02 62.17 1tqy s SER 206 CO 0.13 -0.78 1.57 0.35 1.20 0.00 0.00 173.24 175.72 1tqy n THR 207 N 2.08 1.83 -1.05 6.45 -2.24 -1.26 -4.53 114.28 115.56 1tqy n THR 207 Ca 0.07 -1.27 -0.30 0.00 -2.27 0.00 0.00 64.05 60.27 1tqy n THR 207 Cb 0.39 0.11 0.13 0.00 -2.10 0.00 0.00 70.33 68.87 1tqy n THR 207 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1tqy s ALA 208 N -1.90 1.67 -0.05 6.98 0.00 -1.26 -4.80 121.76 122.40 1tqy s ALA 208 Ca 0.47 0.23 0.03 0.00 0.00 0.00 0.00 51.96 52.69 1tqy s ALA 208 Cb 0.31 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 20.10 1tqy s ALA 208 CO 0.22 -2.33 0.08 0.25 0.00 0.00 0.00 175.76 173.97 1tqy n THR 209 N -3.90 0.00 -2.95 0.00 -2.24 -1.26 -4.43 114.28 99.50 1tqy n THR 209 Ca 0.09 -0.20 -0.43 0.00 -2.27 0.00 0.00 64.05 61.24 1tqy n THR 209 Cb 0.53 0.64 -0.05 0.00 -2.10 0.00 0.00 70.33 69.35 1tqy n THR 209 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1tqy s ASP 210 N -1.92 6.44 0.54 3.42 -1.08 -1.26 -4.93 116.67 117.87 1tqy s ASP 210 Ca -0.00 -0.03 0.21 0.00 -0.52 0.00 0.00 52.55 52.20 1tqy s ASP 210 Cb 0.02 -2.39 1.40 0.00 -1.46 0.00 0.00 42.92 40.48 1tqy s ASP 210 CO 0.11 -0.91 2.12 -0.65 0.52 0.00 0.00 175.17 176.37 1tqy h PRO 211 N 8.93 0.00 0.00 4.34 0.11 -1.91 -1.53 132.00 141.93 1tqy h PRO 211 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1tqy h PRO 211 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1tqy h PRO 211 CO 0.96 0.00 0.00 -0.44 -0.21 0.00 0.00 178.00 178.31 1tqy h ASP 212 N 0.00 0.00 -1.80 -2.05 3.32 -1.93 -3.36 116.42 110.61 1tqy h ASP 212 Ca 0.06 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.61 1tqy h ASP 212 Cb 0.27 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 39.41 1tqy h ASP 212 CO -0.00 0.00 -0.98 0.54 -1.72 0.00 0.00 179.24 177.08 1tqy n ARG 213 N -3.08 2.00 0.00 3.56 1.74 -0.58 -4.58 116.66 115.71 1tqy n ARG 213 Ca 0.03 -3.93 0.00 0.00 -0.77 0.00 0.00 57.85 53.18 1tqy n ARG 213 Cb 0.46 -1.84 0.00 0.00 -1.02 0.00 0.00 32.46 30.06 1tqy n ARG 213 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1tqy n ALA 214 N -0.05 2.56 -3.61 7.54 0.00 -1.18 -4.78 120.51 120.99 1tqy n ALA 214 Ca 0.25 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.30 1tqy n ALA 214 Cb 0.62 0.49 -0.08 0.00 0.00 0.00 0.00 19.45 20.47 1tqy n ALA 214 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1tqy s TYR 215 N -1.99 3.49 -0.61 0.00 5.04 -1.26 -4.63 117.35 117.39 1tqy s TYR 215 Ca 0.00 -2.23 0.06 0.00 -2.44 0.00 0.00 57.07 52.46 1tqy s TYR 215 Cb 0.00 -3.41 0.27 0.00 0.35 0.00 0.00 41.96 39.17 1tqy s TYR 215 CO 0.00 -0.94 0.78 1.28 -1.34 0.00 0.00 175.55 175.33 1tqy n LEU 216 N 4.30 3.70 -4.72 6.97 4.77 -1.26 -4.80 117.00 125.96 1tqy n LEU 216 Ca 0.01 -5.46 -0.42 0.00 -0.03 0.00 0.00 56.01 50.11 1tqy n LEU 216 Cb 0.41 -0.56 -0.03 0.00 -2.33 0.00 0.00 43.42 40.92 1tqy n LEU 216 CO 0.37 2.13 1.33 -0.81 -1.33 0.00 0.00 177.39 179.08 1tqy n PRO 217 N 0.62 2.71 -0.95 3.23 -0.04 -1.26 -1.78 135.00 137.53 1tqy n PRO 217 Ca 0.30 0.98 0.00 0.00 -0.04 0.00 0.00 63.50 64.73 1tqy n PRO 217 Cb 0.42 -2.80 0.00 0.00 -0.04 0.00 0.00 33.50 31.08 1tqy n PRO 217 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1tqy n PHE 218 N 3.45 0.00 -3.43 0.54 0.99 -1.26 -4.93 117.46 112.82 1tqy n PHE 218 Ca 0.14 0.00 -0.32 0.00 -0.00 0.00 0.00 57.45 57.27 1tqy n PHE 218 Cb 0.35 -0.18 -0.05 0.00 -1.00 0.00 0.00 39.48 38.60 1tqy n PHE 218 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 1tqy s ASP 219 N -2.72 6.62 0.61 4.37 2.15 -0.73 -4.03 116.67 122.95 1tqy s ASP 219 Ca 0.00 0.91 0.40 0.00 0.43 0.00 0.00 52.55 54.29 1tqy s ASP 219 Cb 0.00 -2.22 1.95 0.00 -0.30 0.00 0.00 42.92 42.35 1tqy s ASP 219 CO 0.00 -0.06 2.20 1.05 -0.17 0.00 0.00 175.17 178.18 1tqy h GLU 220 N 2.58 0.00 -0.13 4.34 4.11 -1.26 -1.29 114.58 122.93 1tqy h GLU 220 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 1tqy h GLU 220 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 1tqy h GLU 220 CO 0.69 0.00 0.00 0.54 0.07 0.00 0.00 179.01 180.31 1tqy n ARG 221 N -3.08 1.87 -1.58 1.06 5.12 -1.26 -4.96 116.66 113.82 1tqy n ARG 221 Ca -0.01 -1.28 -0.55 0.00 -1.93 0.00 0.00 57.85 54.07 1tqy n ARG 221 Cb 0.18 -1.44 -0.07 0.00 -1.16 0.00 0.00 32.46 29.97 1tqy n ARG 221 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1tqy n ALA 222 N 0.52 -1.68 -2.37 7.54 0.00 -0.49 -4.88 120.51 119.16 1tqy n ALA 222 Ca 0.17 0.53 0.01 0.00 0.00 0.00 0.00 53.44 54.15 1tqy n ALA 222 Cb 0.40 -1.99 -0.00 0.00 0.00 0.00 0.00 19.45 17.85 1tqy n ALA 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1tqy n ALA 223 N 2.50 2.75 0.00 0.00 0.00 -1.22 -4.59 120.51 119.95 1tqy n ALA 223 Ca 0.20 -1.90 0.00 0.00 0.00 0.00 0.00 53.44 51.74 1tqy n ALA 223 Cb 0.15 -0.63 0.00 0.00 0.00 0.00 0.00 19.45 18.97 1tqy n ALA 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tqy n GLY 224 N 0.34 3.49 3.97 0.00 0.00 -0.35 -4.13 105.19 108.52 1tqy n GLY 224 Ca -0.03 -1.86 -0.21 0.00 0.00 0.00 0.00 46.02 43.92 1tqy n GLY 224 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1tqy s TYR 225 N -2.70 2.90 -0.16 1.61 -0.85 -0.04 -4.13 117.35 113.99 1tqy s TYR 225 Ca 0.00 0.01 -0.02 0.00 -0.52 0.00 0.00 57.07 56.54 1tqy s TYR 225 Cb 0.00 -2.70 -0.01 0.00 0.38 0.00 0.00 41.96 39.63 1tqy s TYR 225 CO 0.00 -0.81 -0.10 0.08 -1.52 0.00 0.00 175.55 173.20 1tqy s VAL 226 N -2.73 3.18 0.64 -3.49 1.01 -1.26 -0.37 120.40 117.38 1tqy s VAL 226 Ca 0.56 -0.60 -0.15 0.00 0.00 0.00 0.00 61.98 61.80 1tqy s VAL 226 Cb -0.10 -2.38 -0.01 0.00 0.00 0.00 0.00 36.38 33.89 1tqy s VAL 226 CO 0.38 0.49 1.09 -2.84 0.00 0.00 0.00 175.10 174.23 1tqy s PRO 227 N 0.72 2.95 0.26 2.72 0.02 -1.26 -0.81 135.00 139.59 1tqy s PRO 227 Ca -0.05 1.32 -0.03 0.00 0.02 0.00 0.00 61.00 62.26 1tqy s PRO 227 Cb -0.15 -1.97 -0.02 0.00 0.02 0.00 0.00 34.50 32.37 1tqy s PRO 227 CO 0.02 -1.13 0.30 0.20 -0.33 0.00 0.00 177.00 176.07 1tqy s GLY 228 N -2.68 1.32 0.03 0.52 0.00 -0.85 0.02 107.32 105.69 1tqy s GLY 228 Ca 0.66 -1.50 0.07 0.00 0.00 0.00 0.00 44.72 43.94 1tqy s GLY 228 CO 0.41 -1.13 -0.19 -1.83 0.00 0.00 0.00 173.10 170.36 1tqy s GLU 229 N -3.83 1.30 0.00 2.90 -1.05 -0.17 -4.53 118.70 113.32 1tqy s GLU 229 Ca 0.33 -0.86 0.00 0.00 -0.15 0.00 0.00 54.97 54.29 1tqy s GLU 229 Cb 0.03 -1.37 0.00 0.00 -0.44 0.00 0.00 34.13 32.35 1tqy s GLU 229 CO 0.15 0.35 0.00 0.41 0.95 0.00 0.00 175.26 177.12 1tqy n GLY 230 N 1.98 0.68 0.00 -3.83 0.00 -0.27 -4.20 105.19 99.55 1tqy n GLY 230 Ca -0.17 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 43.76 1tqy n GLY 230 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tqy n GLY 231 N 0.00 -0.50 3.41 -0.02 0.00 -0.12 -2.53 105.19 105.42 1tqy n GLY 231 Ca 0.00 -0.72 -0.14 0.00 0.00 0.00 0.00 46.02 45.16 1tqy n GLY 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tqy s ALA 232 N -1.00 -1.40 0.01 4.61 0.00 -0.86 -1.92 121.76 121.19 1tqy s ALA 232 Ca 0.00 0.62 0.06 0.00 0.00 0.00 0.00 51.96 52.64 1tqy s ALA 232 Cb 0.00 0.45 -0.02 0.00 0.00 0.00 0.00 23.12 23.55 1tqy s ALA 232 CO 0.00 -0.54 -0.18 0.42 0.00 0.00 0.00 175.76 175.46 1tqy s ILE 233 N -2.61 1.41 0.08 0.00 -1.09 0.05 -1.52 121.20 117.52 1tqy s ILE 233 Ca -0.04 -0.89 0.03 0.00 -2.23 0.00 0.00 60.65 57.51 1tqy s ILE 233 Cb -0.01 -1.20 -0.03 0.00 -1.58 0.00 0.00 42.46 39.64 1tqy s ILE 233 CO -0.03 0.29 -0.09 -1.48 -1.23 0.00 0.00 174.94 172.40 1tqy s LEU 234 N -0.70 2.37 -0.27 2.97 2.34 0.99 -0.08 118.68 126.29 1tqy s LEU 234 Ca 0.06 -0.75 -0.10 0.00 0.06 0.00 0.00 54.13 53.40 1tqy s LEU 234 Cb -0.07 -0.21 -0.05 0.00 -0.56 0.00 0.00 46.19 45.30 1tqy s LEU 234 CO 0.00 -0.28 0.17 -0.69 -1.06 0.00 0.00 176.35 174.49 1tqy s VAL 235 N -2.26 5.15 -0.03 1.48 1.01 0.83 -0.93 120.40 125.65 1tqy s VAL 235 Ca 0.01 0.12 0.06 0.00 0.00 0.00 0.00 61.98 62.16 1tqy s VAL 235 Cb -0.04 -3.44 -0.02 0.00 0.00 0.00 0.00 36.38 32.87 1tqy s VAL 235 CO -0.01 0.27 -0.19 -0.76 0.00 0.00 0.00 175.10 174.41 1tqy s LEU 236 N 1.66 2.44 0.12 3.92 1.43 -0.27 -0.99 118.68 126.99 1tqy s LEU 236 Ca 0.07 -0.32 -0.17 0.00 -1.03 0.00 0.00 54.13 52.68 1tqy s LEU 236 Cb -0.16 -1.46 0.04 0.00 0.03 0.00 0.00 46.19 44.64 1tqy s LEU 236 CO 0.09 0.33 0.42 -1.83 0.23 0.00 0.00 176.35 175.59 1tqy s GLU 237 N -0.72 1.08 0.25 1.70 -1.05 -0.58 -0.72 118.70 118.66 1tqy s GLU 237 Ca 0.11 -0.67 -0.31 0.00 -0.15 0.00 0.00 54.97 53.95 1tqy s GLU 237 Cb -0.10 0.48 -0.12 0.00 -0.44 0.00 0.00 34.13 33.94 1tqy s GLU 237 CO 0.00 -0.42 1.60 -3.47 0.95 0.00 0.00 175.26 173.92 1tqy n ASP 238 N -0.20 3.67 -0.07 0.83 -0.08 -0.03 -1.56 116.55 119.11 1tqy n ASP 238 Ca -0.16 1.12 -0.07 0.00 -1.51 0.00 0.00 54.79 54.16 1tqy n ASP 238 Cb 0.64 -1.55 -0.01 0.00 2.34 0.00 0.00 41.12 42.54 1tqy n ASP 238 CO 0.00 0.00 0.00 -1.28 0.12 0.00 0.00 177.20 176.04 1tqy h SER 239 N 5.37 -0.24 -0.50 1.67 0.87 -1.60 0.10 113.55 119.22 1tqy h SER 239 Ca -0.45 0.08 -0.08 0.00 -1.23 0.00 0.00 61.79 60.11 1tqy h SER 239 Cb 1.23 0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 63.34 1tqy h SER 239 CO 0.84 -0.09 0.00 0.00 -0.53 0.00 0.00 176.83 177.06 1tqy h ALA 240 N 1.27 0.68 -0.46 6.23 0.00 -1.90 -2.43 119.26 122.66 1tqy h ALA 240 Ca 0.13 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1tqy h ALA 240 Cb 0.20 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1tqy h ALA 240 CO -0.28 0.49 0.02 0.00 0.00 0.00 0.00 179.25 179.48 1tqy h ALA 241 N 0.94 1.18 -0.31 0.00 0.00 -1.85 -1.87 119.26 117.35 1tqy h ALA 241 Ca 0.14 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 1tqy h ALA 241 Cb 0.52 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1tqy h ALA 241 CO 0.03 0.54 -0.13 0.00 0.00 0.00 0.00 179.25 179.68 1tqy h ALA 242 N 1.33 1.19 -0.02 0.00 0.00 -0.78 -1.98 119.26 119.00 1tqy h ALA 242 Ca 0.14 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1tqy h ALA 242 Cb 0.40 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1tqy h ALA 242 CO 0.01 0.52 -0.03 0.93 0.00 0.00 0.00 179.25 180.68 1tqy h GLU 243 N 0.50 0.06 -0.16 0.00 5.08 -0.94 0.18 114.58 119.30 1tqy h GLU 243 Ca 0.09 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.46 1tqy h GLU 243 Cb 0.52 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1tqy h GLU 243 CO 0.03 0.55 0.15 0.00 -1.00 0.00 0.00 179.01 178.74 1tqy h ALA 244 N 0.51 1.90 0.00 3.43 0.00 -1.28 0.30 119.26 124.11 1tqy h ALA 244 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1tqy h ALA 244 Cb 0.54 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1tqy h ALA 244 CO 0.01 -0.23 0.00 -0.09 0.00 0.00 0.00 179.25 178.94 1tqy h ARG 245 N 0.00 0.00 0.00 0.00 2.43 -1.18 -3.46 114.38 112.16 1tqy h ARG 245 Ca 0.08 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1tqy h ARG 245 Cb 0.37 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 1tqy h ARG 245 CO -0.00 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 178.87 1tqy n GLY 246 N 0.74 0.80 3.22 2.80 0.00 0.11 -5.03 105.19 107.83 1tqy n GLY 246 Ca 0.03 -0.34 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 1tqy n GLY 246 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1tqy s ARG 247 N -0.65 3.14 -0.41 1.61 6.06 0.59 -4.89 118.95 124.40 1tqy s ARG 247 Ca 0.00 -2.50 0.05 0.00 -2.50 0.00 0.00 55.73 50.79 1tqy s ARG 247 Cb 0.00 -4.12 0.66 0.00 0.06 0.00 0.00 34.95 31.55 1tqy s ARG 247 CO 0.00 -1.24 1.84 0.72 -2.50 0.00 0.00 175.30 174.12 1tqy n HIS 248 N 3.75 2.72 -4.19 5.12 8.25 -1.26 -3.95 115.22 125.65 1tqy n HIS 248 Ca 0.11 -1.74 -0.19 0.00 -0.26 0.00 0.00 57.72 55.64 1tqy n HIS 248 Cb 0.43 -0.85 -0.16 0.00 1.12 0.00 0.00 29.99 30.53 1tqy n HIS 248 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1tqy s ASP 249 N -1.45 0.87 0.02 0.41 2.15 -1.26 -5.14 116.67 112.27 1tqy s ASP 249 Ca 0.55 -0.12 -0.20 0.00 0.43 0.00 0.00 52.55 53.21 1tqy s ASP 249 Cb 0.46 -0.35 0.04 0.00 -0.30 0.00 0.00 42.92 42.78 1tqy s ASP 249 CO 0.10 -0.02 0.44 0.00 -0.17 0.00 0.00 175.17 175.52 1tqy s ALA 250 N 0.62 -1.11 0.21 3.66 0.00 -1.26 -4.78 121.76 119.11 1tqy s ALA 250 Ca -0.08 0.50 0.10 0.00 0.00 0.00 0.00 51.96 52.48 1tqy s ALA 250 Cb -0.11 0.24 0.23 0.00 0.00 0.00 0.00 23.12 23.47 1tqy s ALA 250 CO 0.00 -0.41 1.53 1.88 0.00 0.00 0.00 175.76 178.77 1tqy h TYR 251 N 3.17 0.00 0.00 0.00 0.05 -1.12 -3.43 116.97 115.64 1tqy h TYR 251 Ca -0.30 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.48 1tqy h TYR 251 Cb 1.19 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.93 1tqy h TYR 251 CO 0.42 0.69 0.00 0.41 -1.05 0.00 0.00 178.16 178.64 1tqy n GLY 252 N 0.56 -2.21 3.56 3.88 0.00 -1.24 -4.13 105.19 105.61 1tqy n GLY 252 Ca -0.01 -1.23 -0.34 0.00 0.00 0.00 0.00 46.02 44.45 1tqy n GLY 252 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1tqy s GLU 253 N -1.88 2.89 -1.10 1.61 2.12 -0.48 -0.59 118.70 121.27 1tqy s GLU 253 Ca 0.00 -0.55 -0.16 0.00 0.36 0.00 0.00 54.97 54.62 1tqy s GLU 253 Cb 0.00 -2.63 0.15 0.00 0.26 0.00 0.00 34.13 31.91 1tqy s GLU 253 CO 0.00 0.59 1.34 -1.17 -0.54 0.00 0.00 175.26 175.48 1tqy s LEU 254 N -0.62 4.94 0.27 2.70 0.20 0.27 -1.99 118.68 124.45 1tqy s LEU 254 Ca 0.09 -2.57 0.01 0.00 0.69 0.00 0.00 54.13 52.36 1tqy s LEU 254 Cb -0.12 -2.41 0.36 0.00 -0.43 0.00 0.00 46.19 43.59 1tqy s LEU 254 CO 0.02 -0.91 1.69 0.00 -0.29 0.00 0.00 176.35 176.86 1tqy h ALA 255 N 7.87 1.04 -2.23 5.97 0.00 -1.58 -3.42 119.26 126.91 1tqy h ALA 255 Ca 0.26 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1tqy h ALA 255 Cb 0.93 -0.12 -0.18 0.00 0.00 0.00 0.00 17.79 18.42 1tqy h ALA 255 CO 1.21 0.58 0.10 0.20 0.00 0.00 0.00 179.25 181.34 1tqy s GLY 256 N -4.00 -0.50 0.04 0.00 0.00 -1.13 -3.71 107.32 98.01 1tqy s GLY 256 Ca -0.07 0.99 -0.12 0.00 0.00 0.00 0.00 44.72 45.53 1tqy s GLY 256 CO 0.80 0.67 0.25 0.00 0.00 0.00 0.00 173.10 174.81 1tqy s ALA 258 N -2.50 -1.88 -0.01 0.00 0.00 -0.40 -4.52 121.76 112.44 1tqy s ALA 258 Ca -0.05 1.69 0.05 0.00 0.00 0.00 0.00 51.96 53.65 1tqy s ALA 258 Cb -0.01 -0.85 -0.01 0.00 0.00 0.00 0.00 23.12 22.24 1tqy s ALA 258 CO -0.03 -0.31 -0.17 -1.12 0.00 0.00 0.00 175.76 174.13 1tqy s SER 259 N -0.47 2.02 0.18 0.00 0.01 -1.26 -1.30 113.70 112.88 1tqy s SER 259 Ca -0.02 -0.31 -0.02 0.00 1.31 0.00 0.00 55.95 56.91 1tqy s SER 259 Cb -0.02 -0.24 -0.04 0.00 0.21 0.00 0.00 66.02 65.93 1tqy s SER 259 CO 0.01 0.21 0.14 0.42 0.41 0.00 0.00 173.24 174.43 1tqy s THR 260 N -0.38 0.03 -0.02 1.44 -4.23 -0.58 -4.98 115.64 106.92 1tqy s THR 260 Ca 0.06 -1.90 0.01 0.00 -1.18 0.00 0.00 61.69 58.68 1tqy s THR 260 Cb -0.07 -2.31 0.02 0.00 1.34 0.00 0.00 72.50 71.48 1tqy s THR 260 CO -0.01 -0.16 -0.02 0.12 -0.54 0.00 0.00 174.62 174.02 1tqy s PHE 261 N -4.11 0.40 0.75 3.99 5.36 -1.26 -0.81 117.98 122.29 1tqy s PHE 261 Ca 0.32 -0.06 -0.13 0.00 -0.96 0.00 0.00 56.93 56.10 1tqy s PHE 261 Cb 0.06 -0.39 0.05 0.00 -0.34 0.00 0.00 43.02 42.41 1tqy s PHE 261 CO 0.08 -0.10 1.15 -0.51 -1.46 0.00 0.00 175.22 174.39 1tqy s ASP 262 N 0.62 4.29 0.69 6.13 1.01 -0.49 -4.71 116.67 124.22 1tqy s ASP 262 Ca -0.07 2.14 -0.13 0.00 0.71 0.00 0.00 52.55 55.21 1tqy s ASP 262 Cb -0.10 -2.56 0.02 0.00 1.01 0.00 0.00 42.92 41.28 1tqy s ASP 262 CO -0.01 -2.19 1.09 -2.16 0.21 0.00 0.00 175.17 172.11 1tqy s PRO 263 N -4.24 2.71 0.48 8.23 0.04 -1.26 -4.94 135.00 136.02 1tqy s PRO 263 Ca 0.69 1.21 -0.20 0.00 0.04 0.00 0.00 61.00 62.74 1tqy s PRO 263 Cb -0.24 -1.95 -0.13 0.00 0.04 0.00 0.00 34.50 32.23 1tqy s PRO 263 CO 0.48 -1.29 0.30 0.00 0.04 0.00 0.00 177.00 176.52 1tqy n ALA 264 N -2.87 -2.04 -1.76 8.56 0.00 -1.26 -4.83 120.51 116.32 1tqy n ALA 264 Ca 0.09 0.05 -0.42 0.00 0.00 0.00 0.00 53.44 53.17 1tqy n ALA 264 Cb 0.53 -1.65 -0.01 0.00 0.00 0.00 0.00 19.45 18.32 1tqy n ALA 264 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1tqy n PRO 265 N 0.76 2.62 0.00 0.00 -0.02 -1.26 -1.81 135.00 135.30 1tqy n PRO 265 Ca 0.11 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.51 1tqy n PRO 265 Cb 0.44 -2.66 0.00 0.00 -0.02 0.00 0.00 33.50 31.26 1tqy n PRO 265 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1tqy n GLY 266 N 1.12 2.65 0.20 -1.23 0.00 -1.26 -4.85 105.19 101.82 1tqy n GLY 266 Ca 0.04 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.20 1tqy n GLY 266 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1tqy h SER 267 N 0.00 0.00 0.00 1.61 4.64 -1.68 -3.44 113.55 114.68 1tqy h SER 267 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1tqy h SER 267 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1tqy h SER 267 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1tqy n GLY 268 N -0.96 1.11 3.67 -0.77 0.00 -1.26 -4.94 105.19 102.04 1tqy n GLY 268 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 1tqy n GLY 268 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tqy n ARG 269 N -1.55 -0.35 -2.10 1.61 1.74 -1.26 -4.96 116.66 109.79 1tqy n ARG 269 Ca 0.00 -0.03 -0.34 0.00 -0.77 0.00 0.00 57.85 56.71 1tqy n ARG 269 Cb 0.00 -2.39 0.01 0.00 -1.02 0.00 0.00 32.46 29.07 1tqy n ARG 269 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1tqy s PRO 270 N -4.54 3.23 0.90 5.56 0.04 -1.26 -4.85 135.00 134.08 1tqy s PRO 270 Ca 0.68 1.45 -0.11 0.00 0.04 0.00 0.00 61.00 63.06 1tqy s PRO 270 Cb -0.24 -2.00 0.13 0.00 0.04 0.00 0.00 34.50 32.43 1tqy s PRO 270 CO 0.57 -0.92 1.10 0.00 0.04 0.00 0.00 177.00 177.79 1tqy s ALA 271 N -2.08 1.48 -1.48 8.56 0.00 -1.26 -4.51 121.76 122.48 1tqy s ALA 271 Ca 0.69 0.23 0.19 0.00 0.00 0.00 0.00 51.96 53.07 1tqy s ALA 271 Cb -0.21 -3.30 0.60 0.00 0.00 0.00 0.00 23.12 20.21 1tqy s ALA 271 CO 0.32 -2.49 1.51 0.41 0.00 0.00 0.00 175.76 175.51 1tqy n GLY 272 N -0.50 2.68 0.18 0.00 0.00 -1.26 -4.51 105.19 101.78 1tqy n GLY 272 Ca 0.09 -0.74 -0.10 0.00 0.00 0.00 0.00 46.02 45.26 1tqy n GLY 272 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1tqy h LEU 273 N 3.74 0.51 -0.21 0.99 5.85 -1.93 -1.22 115.31 123.03 1tqy h LEU 273 Ca 0.00 -0.20 0.02 0.00 0.84 0.00 0.00 57.88 58.54 1tqy h LEU 273 Cb 1.09 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.96 1tqy h LEU 273 CO 0.07 0.58 0.06 -0.08 -0.34 0.00 0.00 178.44 178.72 1tqy h GLU 274 N 0.42 0.14 -0.85 1.25 4.81 -1.88 -1.12 114.58 117.36 1tqy h GLU 274 Ca 0.11 -0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.42 1tqy h GLU 274 Cb 0.24 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.52 1tqy h GLU 274 CO -0.00 0.09 0.50 -0.09 -0.73 0.00 0.00 179.01 178.78 1tqy h ARG 275 N 0.15 0.84 -0.69 1.92 2.43 -1.81 -1.59 114.38 115.63 1tqy h ARG 275 Ca 0.09 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.18 1tqy h ARG 275 Cb 0.08 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.41 1tqy h ARG 275 CO -0.11 0.56 0.29 0.00 -1.51 0.00 0.00 179.97 179.19 1tqy h ALA 276 N 1.44 0.90 0.38 2.80 0.00 -0.36 0.24 119.26 124.66 1tqy h ALA 276 Ca 0.40 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1tqy h ALA 276 Cb 0.30 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1tqy h ALA 276 CO -0.22 0.51 -0.23 0.82 0.00 0.00 0.00 179.25 180.13 1tqy h ILE 277 N 0.98 0.53 -0.60 0.00 2.04 -0.35 -1.50 117.51 118.61 1tqy h ILE 277 Ca 0.23 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.14 1tqy h ILE 277 Cb 0.19 0.53 -0.03 0.00 -0.74 0.00 0.00 36.82 36.77 1tqy h ILE 277 CO -0.02 0.00 0.40 0.03 0.00 0.00 0.00 178.15 178.56 1tqy h ARG 278 N -0.57 0.63 -0.47 2.37 3.08 -1.03 -0.11 114.38 118.27 1tqy h ARG 278 Ca -0.04 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 59.88 1tqy h ARG 278 Cb 0.47 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 1tqy h ARG 278 CO 0.05 0.42 -0.05 -0.07 -1.07 0.00 0.00 179.97 179.24 1tqy h LEU 279 N 0.65 0.85 -0.39 3.04 4.07 -0.69 -1.39 115.31 121.45 1tqy h LEU 279 Ca 0.25 -0.33 -0.07 0.00 0.08 0.00 0.00 57.88 57.81 1tqy h LEU 279 Cb 0.18 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.67 1tqy h LEU 279 CO -0.07 0.98 -0.03 0.00 -1.08 0.00 0.00 178.44 178.23 1tqy h ALA 280 N 0.90 0.52 -0.51 1.53 0.00 -0.43 -0.69 119.26 120.58 1tqy h ALA 280 Ca 0.13 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 1tqy h ALA 280 Cb 0.57 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1tqy h ALA 280 CO 0.03 0.33 0.31 -0.07 0.00 0.00 0.00 179.25 179.85 1tqy h LEU 281 N 0.52 0.62 -0.62 0.00 3.38 -0.97 -1.64 115.31 116.59 1tqy h LEU 281 Ca 0.11 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1tqy h LEU 281 Cb 0.52 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1tqy h LEU 281 CO 0.03 0.50 0.28 0.78 0.09 0.00 0.00 178.44 180.11 1tqy h ASN 282 N 0.68 0.83 -0.87 -0.43 2.35 -1.09 -0.08 115.58 116.97 1tqy h ASN 282 Ca 0.18 -0.15 0.04 0.00 -0.55 0.00 0.00 56.30 55.83 1tqy h ASN 282 Cb -0.00 -0.22 -0.06 0.00 0.05 0.00 0.00 38.32 38.10 1tqy h ASN 282 CO -0.03 0.75 0.56 -0.78 -1.65 0.00 0.00 177.43 176.27 1tqy h ASP 283 N 0.86 0.91 0.53 5.81 3.58 -0.80 0.43 116.42 127.74 1tqy h ASP 283 Ca 0.21 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.66 1tqy h ASP 283 Cb 0.15 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.01 1tqy h ASP 283 CO -0.02 0.61 -0.01 0.00 -2.88 0.00 0.00 179.24 176.93 1tqy n ALA 284 N -2.35 2.52 -3.27 -0.78 0.00 -0.65 -4.79 120.51 111.19 1tqy n ALA 284 Ca 0.12 -0.16 -0.15 0.00 0.00 0.00 0.00 53.44 53.25 1tqy n ALA 284 Cb 0.12 -1.48 0.08 0.00 0.00 0.00 0.00 19.45 18.17 1tqy n ALA 284 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tqy n GLY 285 N 1.28 -0.67 3.09 0.00 0.00 0.14 -4.91 105.19 104.11 1tqy n GLY 285 Ca 0.15 0.30 -0.13 0.00 0.00 0.00 0.00 46.02 46.34 1tqy n GLY 285 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1tqy s THR 286 N -3.36 -0.01 0.59 2.61 -1.32 -0.25 -5.02 115.64 108.87 1tqy s THR 286 Ca 0.20 0.03 -0.05 0.00 -1.21 0.00 0.00 61.69 60.67 1tqy s THR 286 Cb -0.03 -0.32 0.02 0.00 -1.51 0.00 0.00 72.50 70.66 1tqy s THR 286 CO 0.70 0.01 0.88 -0.83 -2.21 0.00 0.00 174.62 173.17 1tqy s GLY 287 N 0.34 1.63 0.36 6.08 0.00 -1.26 -4.26 107.32 110.21 1tqy s GLY 287 Ca -0.02 -0.82 0.11 0.00 0.00 0.00 0.00 44.72 43.99 1tqy s GLY 287 CO -0.01 -0.54 1.85 -2.55 0.00 0.00 0.00 173.10 171.85 1tqy h PRO 288 N -0.15 0.61 0.00 2.90 0.11 -1.97 -0.95 132.00 132.54 1tqy h PRO 288 Ca -0.45 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 1tqy h PRO 288 Cb 1.27 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 1tqy h PRO 288 CO 0.60 0.40 -0.10 0.93 -0.21 0.00 0.00 178.00 179.62 1tqy h GLU 289 N 0.63 0.00 0.00 1.05 3.07 -1.93 -2.39 114.58 115.01 1tqy h GLU 289 Ca 0.48 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 59.29 1tqy h GLU 289 Cb 0.88 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.78 1tqy h GLU 289 CO -0.23 0.10 -0.25 -0.44 -1.40 0.00 0.00 179.01 176.79 1tqy h ASP 290 N 0.00 0.00 -3.01 1.42 3.45 -1.54 -3.45 116.42 113.29 1tqy h ASP 290 Ca -0.00 0.00 -0.53 0.00 0.43 0.00 0.00 57.03 56.93 1tqy h ASP 290 Cb 0.24 0.00 0.03 0.00 -0.56 0.00 0.00 39.33 39.04 1tqy h ASP 290 CO 0.01 0.25 0.74 -0.69 -1.57 0.00 0.00 179.24 177.99 1tqy s VAL 291 N -3.27 3.20 -0.12 -1.35 1.01 -0.90 -4.61 120.40 114.37 1tqy s VAL 291 Ca 0.04 0.87 0.20 0.00 0.00 0.00 0.00 61.98 63.09 1tqy s VAL 291 Cb 0.08 -3.56 -0.29 0.00 0.00 0.00 0.00 36.38 32.61 1tqy s VAL 291 CO 0.68 0.07 0.30 0.47 0.00 0.00 0.00 175.10 176.62 1tqy n ASP 292 N 3.84 0.04 -3.62 3.32 10.43 -0.43 -4.96 116.55 125.16 1tqy n ASP 292 Ca 0.11 0.02 -0.15 0.00 2.57 0.00 0.00 54.79 57.34 1tqy n ASP 292 Cb 0.42 1.43 -0.07 0.00 1.84 0.00 0.00 41.12 44.73 1tqy n ASP 292 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1tqy s VAL 293 N -2.99 0.00 -0.21 2.53 0.11 -1.19 -4.20 120.40 114.45 1tqy s VAL 293 Ca -0.09 -0.02 -0.01 0.00 -2.93 0.00 0.00 61.98 58.94 1tqy s VAL 293 Cb 0.10 -0.92 0.02 0.00 -1.53 0.00 0.00 36.38 34.05 1tqy s VAL 293 CO 0.87 -0.01 -0.12 -0.69 -3.33 0.00 0.00 175.10 171.81 1tqy s VAL 294 N -0.09 2.56 -0.79 2.04 1.01 -0.09 -1.41 120.40 123.62 1tqy s VAL 294 Ca -0.03 -0.92 -0.20 0.00 0.00 0.00 0.00 61.98 60.83 1tqy s VAL 294 Cb -0.04 -2.19 0.12 0.00 0.00 0.00 0.00 36.38 34.27 1tqy s VAL 294 CO 0.03 0.38 0.99 -0.36 0.00 0.00 0.00 175.10 176.14 1tqy s PHE 295 N 1.32 3.02 0.80 5.22 0.40 0.38 -1.13 117.98 127.99 1tqy s PHE 295 Ca 0.03 -1.13 -0.11 0.00 -0.60 0.00 0.00 56.93 55.12 1tqy s PHE 295 Cb -0.15 -4.21 0.07 0.00 0.51 0.00 0.00 43.02 39.24 1tqy s PHE 295 CO -0.08 -1.47 1.11 0.00 0.70 0.00 0.00 175.22 175.48 1tqy s ALA 296 N 2.91 2.09 0.17 5.36 0.00 -0.88 -1.14 121.76 130.27 1tqy s ALA 296 Ca 0.25 0.37 -0.12 0.00 0.00 0.00 0.00 51.96 52.47 1tqy s ALA 296 Cb -0.12 -3.32 0.07 0.00 0.00 0.00 0.00 23.12 19.75 1tqy s ALA 296 CO -0.01 -1.96 1.70 0.22 0.00 0.00 0.00 175.76 175.71 1tqy h ASP 297 N -1.20 0.84 -5.37 0.00 3.58 -1.90 -3.44 116.42 108.93 1tqy h ASP 297 Ca -0.44 -0.20 -0.24 0.00 0.42 0.00 0.00 57.03 56.57 1tqy h ASP 297 Cb 1.24 -0.22 0.19 0.00 1.72 0.00 0.00 39.33 42.26 1tqy h ASP 297 CO 0.49 0.81 -0.83 0.61 -2.88 0.00 0.00 179.24 177.45 1tqy n GLY 298 N -0.74 -1.07 0.32 -0.78 0.00 -1.26 -4.94 105.19 96.73 1tqy n GLY 298 Ca 0.03 0.54 0.07 0.00 0.00 0.00 0.00 46.02 46.66 1tqy n GLY 298 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tqy h ALA 299 N -0.04 1.34 0.00 4.61 0.00 -1.92 -3.44 119.26 119.81 1tqy h ALA 299 Ca -0.59 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1tqy h ALA 299 Cb 1.30 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1tqy h ALA 299 CO 0.43 0.01 0.00 0.41 0.00 0.00 0.00 179.25 180.10 1tqy n GLY 300 N -1.33 0.55 3.19 0.00 0.00 -1.26 -4.10 105.19 102.24 1tqy n GLY 300 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 1tqy n GLY 300 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tqy s VAL 301 N -2.05 2.65 0.11 1.61 1.01 -1.26 -1.21 120.40 121.25 1tqy s VAL 301 Ca 0.00 -0.92 -0.21 0.00 0.00 0.00 0.00 61.98 60.85 1tqy s VAL 301 Cb 0.00 -2.25 -0.05 0.00 0.00 0.00 0.00 36.38 34.08 1tqy s VAL 301 CO 0.00 0.35 1.12 -2.65 0.00 0.00 0.00 175.10 173.92 1tqy n PRO 302 N 4.66 -0.29 -0.17 2.72 -0.02 -1.26 -0.05 135.00 140.59 1tqy n PRO 302 Ca -0.18 1.10 -0.02 0.00 -2.02 0.00 0.00 63.50 62.38 1tqy n PRO 302 Cb 0.49 -1.62 0.08 0.00 -0.02 0.00 0.00 33.50 32.42 1tqy n PRO 302 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1tqy h GLU 303 N 0.00 0.33 -0.45 -0.52 4.81 -1.98 0.17 114.58 116.94 1tqy h GLU 303 Ca 0.11 -0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.19 1tqy h GLU 303 Cb 0.27 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1tqy h GLU 303 CO -0.62 0.22 -0.20 -0.07 -0.73 0.00 0.00 179.01 177.60 1tqy h LEU 304 N 0.34 0.96 -0.75 1.64 3.38 -1.35 -2.07 115.31 117.45 1tqy h LEU 304 Ca 0.26 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 1tqy h LEU 304 Cb 0.31 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.76 1tqy h LEU 304 CO -0.28 1.14 0.42 0.44 0.09 0.00 0.00 178.44 180.25 1tqy h ASP 305 N 0.77 0.93 -0.72 -0.43 3.32 0.07 -1.24 116.42 119.12 1tqy h ASP 305 Ca 0.10 -0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 1tqy h ASP 305 Cb 0.78 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 40.05 1tqy h ASP 305 CO 0.06 0.76 0.36 0.00 -1.72 0.00 0.00 179.24 178.70 1tqy h ALA 306 N 1.22 0.93 -0.45 3.45 0.00 -0.45 -0.37 119.26 123.59 1tqy h ALA 306 Ca 0.27 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.90 1tqy h ALA 306 Cb 0.02 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1tqy h ALA 306 CO -0.04 0.49 -0.26 0.00 0.00 0.00 0.00 179.25 179.43 1tqy h ALA 307 N 1.18 0.68 -0.29 0.00 0.00 -1.04 -2.13 119.26 117.66 1tqy h ALA 307 Ca 0.25 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1tqy h ALA 307 Cb 0.10 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1tqy h ALA 307 CO -0.03 0.67 0.02 1.49 0.00 0.00 0.00 179.25 181.40 1tqy h GLU 308 N 0.82 0.50 -0.58 0.00 4.81 -0.96 -1.92 114.58 117.24 1tqy h GLU 308 Ca 0.10 -0.15 0.02 0.00 -0.13 0.00 0.00 59.36 59.19 1tqy h GLU 308 Cb 0.84 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.14 1tqy h GLU 308 CO 0.07 0.63 0.39 0.00 -0.73 0.00 0.00 179.01 179.37 1tqy h ALA 309 N 0.85 1.64 -0.37 2.92 0.00 -1.06 -1.59 119.26 121.65 1tqy h ALA 309 Ca 0.08 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1tqy h ALA 309 Cb 0.40 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1tqy h ALA 309 CO 0.01 0.32 0.07 -0.09 0.00 0.00 0.00 179.25 179.56 1tqy h ARG 310 N 0.74 0.61 -0.49 0.00 2.43 -1.03 -1.41 114.38 115.22 1tqy h ARG 310 Ca 0.22 -0.16 -0.11 0.00 -0.81 0.00 0.00 59.98 59.13 1tqy h ARG 310 Cb -0.01 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 1tqy h ARG 310 CO -0.05 0.66 -0.11 0.00 -1.51 0.00 0.00 179.97 178.96 1tqy h ALA 311 N 0.92 0.86 -0.53 2.80 0.00 -0.89 -1.88 119.26 120.54 1tqy h ALA 311 Ca 0.11 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 1tqy h ALA 311 Cb 0.35 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1tqy h ALA 311 CO 0.01 0.64 0.07 0.82 0.00 0.00 0.00 179.25 180.79 1tqy h ILE 312 N 0.82 1.26 -0.01 0.00 2.04 -1.18 -2.70 117.51 117.73 1tqy h ILE 312 Ca 0.13 -0.99 -0.09 0.00 1.00 0.00 0.00 64.86 64.91 1tqy h ILE 312 Cb 0.65 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 1tqy h ILE 312 CO 0.04 0.36 -0.43 1.23 0.00 0.00 0.00 178.15 179.35 1tqy h GLY 313 N 0.78 0.02 2.00 5.37 0.00 -1.07 0.76 103.07 110.93 1tqy h GLY 313 Ca 0.16 -0.01 -0.08 0.00 0.00 0.00 0.00 47.33 47.40 1tqy h GLY 313 CO 0.01 0.01 -0.38 3.21 0.00 0.00 0.00 176.54 179.40 1tqy h ARG 314 N 0.01 0.00 0.06 4.80 3.08 -1.12 0.42 114.38 121.63 1tqy h ARG 314 Ca -0.00 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.70 1tqy h ARG 314 Cb 0.77 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.79 1tqy h ARG 314 CO 0.06 0.38 -1.99 0.28 -1.07 0.00 0.00 179.97 177.63 1tqy n VAL 315 N -3.52 1.64 0.67 2.04 0.31 -1.04 -4.61 118.33 113.83 1tqy n VAL 315 Ca -0.00 -0.47 0.08 0.00 -0.01 0.00 0.00 64.34 63.94 1tqy n VAL 315 Cb 0.52 -1.76 -0.10 0.00 -0.91 0.00 0.00 33.84 31.59 1tqy n VAL 315 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1tqy n PHE 316 N -3.73 0.00 0.00 3.52 3.72 0.24 -4.82 117.46 116.38 1tqy n PHE 316 Ca -0.37 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.03 1tqy n PHE 316 Cb 0.94 -0.07 0.00 0.00 -0.94 0.00 0.00 39.48 39.41 1tqy n PHE 316 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1tqy n GLY 317 N 1.42 0.94 3.74 1.37 0.00 0.15 -4.29 105.19 108.52 1tqy n GLY 317 Ca 0.02 -1.58 -0.42 0.00 0.00 0.00 0.00 46.02 44.05 1tqy n GLY 317 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tqy n ARG 318 N 1.19 2.71 -1.40 1.61 1.74 -1.24 -0.20 116.66 121.07 1tqy n ARG 318 Ca 0.00 0.96 -0.14 0.00 -0.77 0.00 0.00 57.85 57.90 1tqy n ARG 318 Cb 0.00 -2.75 -0.06 0.00 -1.02 0.00 0.00 32.46 28.62 1tqy n ARG 318 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1tqy n GLU 319 N 2.39 -1.38 0.00 5.56 4.71 0.10 -4.84 120.64 127.19 1tqy n GLU 319 Ca 0.10 0.87 0.14 0.00 -0.01 0.00 0.00 57.16 58.25 1tqy n GLU 319 Cb 0.36 -5.14 0.68 0.00 -1.01 0.00 0.00 31.44 26.34 1tqy n GLU 319 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1tqy n GLY 320 N -0.22 -1.25 3.48 0.62 0.00 0.72 -4.63 105.19 103.91 1tqy n GLY 320 Ca -0.14 -0.12 -0.14 0.00 0.00 0.00 0.00 46.02 45.61 1tqy n GLY 320 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tqy s VAL 321 N -2.65 0.00 0.29 1.61 0.11 -1.26 -4.88 120.40 113.61 1tqy s VAL 321 Ca 0.24 -0.04 -0.30 0.00 -2.93 0.00 0.00 61.98 58.95 1tqy s VAL 321 Cb 0.19 -0.83 -0.11 0.00 -1.53 0.00 0.00 36.38 34.09 1tqy s VAL 321 CO 0.44 -0.02 1.55 -2.84 -3.33 0.00 0.00 175.10 170.90 1tqy s PRO 322 N -0.04 4.16 0.07 1.54 0.02 -1.26 -4.28 135.00 135.20 1tqy s PRO 322 Ca -0.03 2.51 0.10 0.00 0.02 0.00 0.00 61.00 63.60 1tqy s PRO 322 Cb -0.04 -3.04 -0.03 0.00 0.02 0.00 0.00 34.50 31.41 1tqy s PRO 322 CO 0.02 -0.58 -0.27 0.08 -0.33 0.00 0.00 177.00 175.93 1tqy s VAL 323 N -0.05 2.17 -0.02 3.83 1.01 0.07 -0.92 120.40 126.51 1tqy s VAL 323 Ca 0.62 -1.52 -0.19 0.00 0.00 0.00 0.00 61.98 60.89 1tqy s VAL 323 Cb -0.46 -1.88 0.04 0.00 0.00 0.00 0.00 36.38 34.07 1tqy s VAL 323 CO 0.47 0.27 0.41 0.28 0.00 0.00 0.00 175.10 176.53 1tqy s THR 324 N -0.90 0.04 -0.46 3.92 -1.32 -0.29 -0.42 115.64 116.22 1tqy s THR 324 Ca 0.12 -0.37 0.04 0.00 -1.21 0.00 0.00 61.69 60.28 1tqy s THR 324 Cb -0.10 -0.75 0.17 0.00 -1.51 0.00 0.00 72.50 70.31 1tqy s THR 324 CO 0.03 -0.20 0.35 -0.69 -2.21 0.00 0.00 174.62 171.91 1tqy s VAL 325 N -1.44 0.76 0.25 5.08 1.01 -1.26 -2.08 120.40 122.72 1tqy s VAL 325 Ca -0.12 -2.85 0.36 0.00 0.00 0.00 0.00 61.98 59.37 1tqy s VAL 325 Cb -0.03 -1.53 0.39 0.00 0.00 0.00 0.00 36.38 35.21 1tqy s VAL 325 CO 0.05 -1.18 2.09 -0.65 0.00 0.00 0.00 175.10 175.41 1tqy h PRO 326 N 5.71 0.00 0.00 2.72 0.11 -1.87 -2.77 132.00 135.89 1tqy h PRO 326 Ca 0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.34 1tqy h PRO 326 Cb 0.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1tqy h PRO 326 CO 0.42 0.00 0.00 0.36 -0.21 0.00 0.00 178.00 178.57 1tqy n LYS 327 N -2.98 0.13 0.27 1.05 2.85 -1.26 -0.61 118.16 117.61 1tqy n LYS 327 Ca -0.01 0.18 0.18 0.00 -1.05 0.00 0.00 58.31 57.62 1tqy n LYS 327 Cb 0.20 -1.50 0.89 0.00 -0.65 0.00 0.00 35.03 33.98 1tqy n LYS 327 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 1tqy h THR 328 N 0.00 0.00 -0.00 0.58 1.35 -1.82 0.19 112.91 113.21 1tqy h THR 328 Ca 0.00 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.68 1tqy h THR 328 Cb 0.06 1.08 0.00 0.00 -1.73 0.00 0.00 68.15 67.55 1tqy h THR 328 CO 0.00 0.00 -0.41 0.35 -0.25 0.00 0.00 175.52 175.21 1tqy n THR 329 N -2.87 0.00 0.00 6.82 -2.24 0.22 -4.49 114.28 111.71 1tqy n THR 329 Ca -0.01 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1tqy n THR 329 Cb 0.15 0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 1tqy n THR 329 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1tqy n THR 330 N -1.08 0.00 0.00 4.28 -2.24 -0.24 -0.53 114.28 114.48 1tqy n THR 330 Ca 0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 1tqy n THR 330 Cb 0.34 0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 1tqy n THR 330 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tqy n GLY 331 N 1.62 0.24 3.65 3.38 0.00 0.50 -4.32 105.19 110.26 1tqy n GLY 331 Ca 0.00 -1.86 -0.42 0.00 0.00 0.00 0.00 46.02 43.74 1tqy n GLY 331 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1tqy s ARG 332 N -1.82 4.21 -0.10 1.61 0.52 0.01 -4.67 118.95 118.72 1tqy s ARG 332 Ca 0.00 0.99 0.16 0.00 -0.52 0.00 0.00 55.73 56.36 1tqy s ARG 332 Cb 0.00 -3.63 0.62 0.00 0.52 0.00 0.00 34.95 32.46 1tqy s ARG 332 CO 0.00 -0.49 1.50 1.28 0.02 0.00 0.00 175.30 177.62 1tqy n LEU 333 N 5.87 4.14 0.00 2.53 4.77 -1.26 -2.01 117.00 131.04 1tqy n LEU 333 Ca 0.06 -2.09 0.00 0.00 -0.03 0.00 0.00 56.01 53.95 1tqy n LEU 333 Cb 0.48 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 1tqy n LEU 333 CO 0.48 0.71 0.00 -1.22 -1.33 0.00 0.00 177.39 176.03 1tqy n TYR 334 N 0.95 0.00 0.38 -1.77 4.01 -1.26 -1.05 117.16 118.42 1tqy n TYR 334 Ca 0.22 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 58.09 1tqy n TYR 334 Cb 0.78 0.00 0.52 0.00 -0.31 0.00 0.00 39.34 40.33 1tqy n TYR 334 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1tqy h SER 335 N 0.00 0.00 1.02 7.72 4.64 -1.87 -2.49 113.55 122.57 1tqy h SER 335 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1tqy h SER 335 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1tqy h SER 335 CO 0.00 0.00 -0.73 1.23 -0.87 0.00 0.00 176.83 176.46 1tqy h GLY 336 N 2.20 0.00 0.92 -0.77 0.00 -1.20 -3.35 103.07 100.87 1tqy h GLY 336 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1tqy h GLY 336 CO 0.00 0.00 -0.29 -1.33 0.00 0.00 0.00 176.54 174.92 1tqy h GLY 337 N 4.25 -0.81 0.81 4.60 0.00 -1.54 -1.60 103.07 108.78 1tqy h GLY 337 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.66 1tqy h GLY 337 CO 0.00 -0.30 -0.16 -1.33 0.00 0.00 0.00 176.54 174.75 1tqy h GLY 338 N -0.77 -0.35 0.35 4.60 0.00 -1.77 -0.10 103.07 105.03 1tqy h GLY 338 Ca -0.07 0.19 0.09 0.00 0.00 0.00 0.00 47.33 47.54 1tqy h GLY 338 CO 0.08 -0.16 0.10 -2.55 0.00 0.00 0.00 176.54 174.02 1tqy h PRO 339 N -0.36 0.23 -0.59 4.80 0.11 -1.77 0.07 132.00 134.49 1tqy h PRO 339 Ca 0.00 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.04 1tqy h PRO 339 Cb 0.34 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 31.37 1tqy h PRO 339 CO -0.04 0.16 0.16 1.25 -0.21 0.00 0.00 178.00 179.32 1tqy h LEU 340 N 0.24 0.85 -0.87 2.35 5.85 -1.08 -1.64 115.31 121.02 1tqy h LEU 340 Ca 0.25 -0.15 -0.09 0.00 0.84 0.00 0.00 57.88 58.74 1tqy h LEU 340 Cb 0.34 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 1tqy h LEU 340 CO -0.33 0.81 -0.10 0.44 -0.34 0.00 0.00 178.44 178.93 1tqy h ASP 341 N 0.88 0.72 -0.31 1.25 5.19 -0.18 -0.74 116.42 123.23 1tqy h ASP 341 Ca 0.19 -0.21 -0.02 0.00 -0.62 0.00 0.00 57.03 56.38 1tqy h ASP 341 Cb 0.29 -0.19 -0.01 0.00 0.18 0.00 0.00 39.33 39.59 1tqy h ASP 341 CO -0.00 0.85 0.13 0.58 -3.12 0.00 0.00 179.24 177.68 1tqy h VAL 342 N 0.67 1.17 -0.12 -1.35 2.07 -0.36 -0.25 116.25 118.08 1tqy h VAL 342 Ca 0.12 -0.51 0.03 0.00 0.82 0.00 0.00 66.70 67.16 1tqy h VAL 342 Cb 0.56 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 31.23 1tqy h VAL 342 CO 0.03 0.18 -0.05 0.58 0.02 0.00 0.00 177.57 178.33 1tqy h VAL 343 N 0.36 0.83 -0.82 2.57 2.07 -1.04 0.25 116.25 120.47 1tqy h VAL 343 Ca 0.10 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.63 1tqy h VAL 343 Cb 0.16 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 30.72 1tqy h VAL 343 CO -0.01 0.00 0.52 0.74 0.02 0.00 0.00 177.57 178.84 1tqy h THR 344 N -0.03 1.22 0.12 2.57 2.02 -0.92 0.59 112.91 118.47 1tqy h THR 344 Ca 0.06 -0.43 -0.01 0.00 0.77 0.00 0.00 66.41 66.81 1tqy h THR 344 Cb 0.13 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.58 1tqy h THR 344 CO -0.14 0.22 -0.06 0.00 0.37 0.00 0.00 175.52 175.91 1tqy h ALA 345 N 1.46 -0.16 -0.73 6.16 0.00 -0.56 -1.33 119.26 124.09 1tqy h ALA 345 Ca 0.30 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 55.12 1tqy h ALA 345 Cb -0.09 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 17.69 1tqy h ALA 345 CO -0.06 -0.42 0.38 -0.07 0.00 0.00 0.00 179.25 179.08 1tqy h LEU 346 N -0.51 0.51 -1.18 0.00 3.38 -0.15 0.33 115.31 117.70 1tqy h LEU 346 Ca -0.02 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1tqy h LEU 346 Cb 0.41 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 1tqy h LEU 346 CO 0.03 0.29 0.20 0.24 0.09 0.00 0.00 178.44 179.29 1tqy h MET 347 N 0.65 0.78 -0.42 1.13 2.86 -0.79 -0.44 114.93 118.69 1tqy h MET 347 Ca 0.36 -0.12 -0.04 0.00 -2.06 0.00 0.00 59.70 57.84 1tqy h MET 347 Cb 0.36 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 1tqy h MET 347 CO -0.26 0.65 0.11 0.77 1.06 0.00 0.00 176.91 179.24 1tqy h SER 348 N 0.76 0.62 -0.20 1.22 0.02 0.21 -0.26 113.55 115.93 1tqy h SER 348 Ca 0.18 -0.22 -0.00 0.00 -0.84 0.00 0.00 61.79 60.91 1tqy h SER 348 Cb 0.17 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 1tqy h SER 348 CO -0.01 0.68 0.10 -0.07 -1.14 0.00 0.00 176.83 176.39 1tqy h LEU 349 N 0.53 0.25 -0.50 5.07 3.38 -0.83 -0.06 115.31 123.14 1tqy h LEU 349 Ca 0.13 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1tqy h LEU 349 Cb 0.29 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1tqy h LEU 349 CO -0.00 0.27 0.21 -0.09 0.09 0.00 0.00 178.44 178.92 1tqy h ARG 350 N 0.21 0.74 0.00 1.13 2.43 -0.88 -3.05 114.38 114.96 1tqy h ARG 350 Ca 0.07 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1tqy h ARG 350 Cb 0.08 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 1tqy h ARG 350 CO -0.01 0.65 -0.17 0.39 -1.51 0.00 0.00 179.97 179.32 1tqy n GLU 351 N -4.57 0.19 -0.89 0.20 4.71 -0.13 -4.94 120.64 115.21 1tqy n GLU 351 Ca 0.02 0.13 0.00 0.00 -0.01 0.00 0.00 57.16 57.29 1tqy n GLU 351 Cb 0.14 -1.69 0.00 0.00 -1.01 0.00 0.00 31.44 28.88 1tqy n GLU 351 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1tqy n GLY 352 N 1.37 0.52 3.17 0.62 0.00 -0.09 -5.00 105.19 105.78 1tqy n GLY 352 Ca 0.05 -0.33 -0.16 0.00 0.00 0.00 0.00 46.02 45.59 1tqy n GLY 352 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1tqy s VAL 353 N -2.00 0.99 -0.18 1.61 -7.23 -0.86 -1.07 120.40 111.66 1tqy s VAL 353 Ca 0.00 -1.51 -0.16 0.00 -1.81 0.00 0.00 61.98 58.50 1tqy s VAL 353 Cb 0.00 -1.23 -0.04 0.00 0.56 0.00 0.00 36.38 35.67 1tqy s VAL 353 CO 0.00 -0.44 0.41 -0.63 -0.31 0.00 0.00 175.10 174.14 1tqy s ILE 354 N -2.00 5.20 0.27 -0.62 1.01 0.11 -4.28 121.20 120.89 1tqy s ILE 354 Ca 0.02 0.76 -0.31 0.00 0.00 0.00 0.00 60.65 61.13 1tqy s ILE 354 Cb -0.06 -3.75 -0.12 0.00 0.01 0.00 0.00 42.46 38.55 1tqy s ILE 354 CO 0.01 0.27 1.60 0.00 0.00 0.00 0.00 174.94 176.82 1tqy n ALA 355 N 4.28 2.44 -1.94 9.38 0.00 -1.26 -2.37 120.51 131.04 1tqy n ALA 355 Ca -0.08 0.38 -0.25 0.00 0.00 0.00 0.00 53.44 53.49 1tqy n ALA 355 Cb 0.51 -2.45 0.08 0.00 0.00 0.00 0.00 19.45 17.58 1tqy n ALA 355 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1tqy s PRO 356 N -0.15 2.09 -0.14 0.00 0.04 -1.26 -4.79 135.00 130.79 1tqy s PRO 356 Ca 0.67 -0.36 -0.06 0.00 0.04 0.00 0.00 61.00 61.29 1tqy s PRO 356 Cb -0.52 -2.19 -0.04 0.00 0.04 0.00 0.00 34.50 31.80 1tqy s PRO 356 CO 0.45 -1.28 0.07 0.99 0.04 0.00 0.00 177.00 177.27 1tqy s THR 357 N -3.24 4.87 0.31 1.26 2.01 0.13 -4.14 115.64 116.83 1tqy s THR 357 Ca 0.61 -0.02 0.06 0.00 0.31 0.00 0.00 61.69 62.65 1tqy s THR 357 Cb -0.10 -3.14 -0.02 0.00 0.01 0.00 0.00 72.50 69.26 1tqy s THR 357 CO 0.45 0.54 0.43 0.00 -0.69 0.00 0.00 174.62 175.34 1tqy s ALA 358 N -0.29 4.14 0.00 7.40 0.00 -1.26 -3.00 121.76 128.75 1tqy s ALA 358 Ca 0.09 -1.41 0.00 0.00 0.00 0.00 0.00 51.96 50.63 1tqy s ALA 358 Cb -0.12 -1.66 0.00 0.00 0.00 0.00 0.00 23.12 21.34 1tqy s ALA 358 CO 0.01 0.04 0.00 0.41 0.00 0.00 0.00 175.76 176.23 1tqy n GLY 359 N -1.57 0.77 3.70 0.00 0.00 -1.26 -4.89 105.19 101.95 1tqy n GLY 359 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 1tqy n GLY 359 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1tqy n VAL 360 N 0.00 0.18 0.00 1.61 0.31 -1.26 -4.89 118.33 114.28 1tqy n VAL 360 Ca 0.00 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 1tqy n VAL 360 Cb 0.00 -2.04 0.00 0.00 -0.91 0.00 0.00 33.84 30.89 1tqy n VAL 360 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1tqy n THR 361 N 4.31 0.00 -3.60 2.52 -2.24 -1.26 -4.88 114.28 109.14 1tqy n THR 361 Ca 0.17 -0.11 -0.29 0.00 -2.27 0.00 0.00 64.05 61.55 1tqy n THR 361 Cb 0.36 0.55 -0.15 0.00 -2.10 0.00 0.00 70.33 68.99 1tqy n THR 361 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1tqy s SER 362 N -1.25 3.68 -0.21 3.42 0.15 -1.26 -5.10 113.70 113.13 1tqy s SER 362 Ca 0.00 -1.42 -0.17 0.00 0.70 0.00 0.00 55.95 55.06 1tqy s SER 362 Cb 0.00 -0.51 -0.03 0.00 -1.71 0.00 0.00 66.02 63.77 1tqy s SER 362 CO 0.00 -0.43 0.47 -0.69 1.20 0.00 0.00 173.24 173.79 1tqy s VAL 363 N 1.93 5.14 0.31 4.45 1.01 -1.26 -0.75 120.40 131.22 1tqy s VAL 363 Ca 0.09 0.84 -0.29 0.00 0.00 0.00 0.00 61.98 62.62 1tqy s VAL 363 Cb -0.17 -3.79 -0.11 0.00 0.00 0.00 0.00 36.38 32.31 1tqy s VAL 363 CO -0.33 0.20 1.52 -2.84 0.00 0.00 0.00 175.10 173.65 1tqy s PRO 364 N 1.59 4.16 0.52 2.72 0.02 -1.26 -4.88 135.00 137.88 1tqy s PRO 364 Ca 0.22 2.50 0.22 0.00 0.02 0.00 0.00 61.00 63.96 1tqy s PRO 364 Cb -0.15 -3.03 1.33 0.00 0.02 0.00 0.00 34.50 32.67 1tqy s PRO 364 CO 0.09 -0.54 2.03 -0.09 -0.33 0.00 0.00 177.00 178.16 1tqy h ARG 365 N 4.38 0.04 -0.99 5.54 9.65 -1.98 -1.27 114.38 129.75 1tqy h ARG 365 Ca -0.48 -0.00 0.20 0.00 -1.10 0.00 0.00 59.98 58.59 1tqy h ARG 365 Cb 1.22 -0.01 -0.10 0.00 -1.39 0.00 0.00 29.97 29.70 1tqy h ARG 365 CO 0.75 0.03 0.61 1.49 2.80 0.00 0.00 179.97 185.65 1tqy h GLU 366 N 0.04 0.66 0.00 0.20 4.81 -2.02 -0.91 114.58 117.36 1tqy h GLU 366 Ca 0.20 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.33 1tqy h GLU 366 Cb 0.74 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.96 1tqy h GLU 366 CO -0.01 0.43 -0.28 1.88 -0.73 0.00 0.00 179.01 180.30 1tqy h TYR 367 N 0.68 0.00 -6.28 0.92 0.05 -1.60 -3.48 116.97 107.26 1tqy h TYR 367 Ca 0.55 0.00 -0.45 0.00 0.05 0.00 0.00 58.73 58.88 1tqy h TYR 367 Cb 0.98 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.73 1tqy h TYR 367 CO -0.00 0.28 -0.87 0.41 -1.05 0.00 0.00 178.16 176.92 1tqy n GLY 368 N 0.25 -0.38 3.29 3.88 0.00 -0.35 -4.66 105.19 107.22 1tqy n GLY 368 Ca 0.00 0.19 -0.20 0.00 0.00 0.00 0.00 46.02 46.01 1tqy n GLY 368 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1tqy s ILE 369 N -3.77 1.59 -1.00 -0.61 -4.36 -1.26 0.01 121.20 111.80 1tqy s ILE 369 Ca 0.08 -1.80 -0.11 0.00 -0.26 0.00 0.00 60.65 58.56 1tqy s ILE 369 Cb -0.03 -1.68 0.25 0.00 1.25 0.00 0.00 42.46 42.25 1tqy s ILE 369 CO 0.85 -0.34 0.98 -0.62 0.24 0.00 0.00 174.94 176.05 1tqy s ASP 370 N -2.52 7.10 -0.06 4.36 2.15 -1.26 -4.79 116.67 121.66 1tqy s ASP 370 Ca 0.12 -3.24 -0.25 0.00 0.43 0.00 0.00 52.55 49.62 1tqy s ASP 370 Cb -0.06 -2.21 -0.03 0.00 -0.30 0.00 0.00 42.92 40.32 1tqy s ASP 370 CO 0.05 -0.40 0.75 -0.22 -0.17 0.00 0.00 175.17 175.18 1tqy s LEU 371 N -0.69 4.32 -0.44 -1.34 0.20 -1.26 -0.75 118.68 118.72 1tqy s LEU 371 Ca 0.26 1.27 -0.29 0.00 0.69 0.00 0.00 54.13 56.06 1tqy s LEU 371 Cb -0.10 -3.17 0.02 0.00 -0.43 0.00 0.00 46.19 42.51 1tqy s LEU 371 CO -0.08 -0.15 1.20 -0.69 -0.29 0.00 0.00 176.35 176.33 1tqy s VAL 372 N 0.88 4.17 0.09 1.68 1.01 0.44 -4.92 120.40 123.74 1tqy s VAL 372 Ca 0.40 1.21 0.09 0.00 0.00 0.00 0.00 61.98 63.68 1tqy s VAL 372 Cb -0.18 -4.49 -0.03 0.00 0.00 0.00 0.00 36.38 31.67 1tqy s VAL 372 CO 0.20 -0.90 -0.23 -0.76 0.00 0.00 0.00 175.10 173.41 1tqy s LEU 373 N 4.59 2.25 0.00 3.92 1.43 -1.26 -0.70 118.68 128.91 1tqy s LEU 373 Ca 0.51 -0.64 0.00 0.00 -1.03 0.00 0.00 54.13 52.96 1tqy s LEU 373 Cb -0.09 -1.01 0.00 0.00 0.03 0.00 0.00 46.19 45.12 1tqy s LEU 373 CO 0.30 0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.62 1tqy n GLY 374 N 1.33 1.78 3.89 -3.19 0.00 -1.16 -4.87 105.19 102.96 1tqy n GLY 374 Ca -0.18 -0.25 -0.29 0.00 0.00 0.00 0.00 46.02 45.30 1tqy n GLY 374 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1tqy s GLU 375 N 0.00 3.58 0.54 1.61 0.41 -1.26 -4.71 118.70 118.87 1tqy s GLU 375 Ca 0.00 0.47 -0.20 0.00 -0.41 0.00 0.00 54.97 54.83 1tqy s GLU 375 Cb 0.00 -2.23 -0.05 0.00 -1.78 0.00 0.00 34.13 30.07 1tqy s GLU 375 CO 0.00 -0.38 1.17 -2.14 -0.49 0.00 0.00 175.26 173.42 1tqy s PRO 376 N -4.94 3.30 -0.26 0.39 0.02 -1.26 -4.63 135.00 127.62 1tqy s PRO 376 Ca 0.51 1.74 -0.09 0.00 0.02 0.00 0.00 61.00 63.18 1tqy s PRO 376 Cb -0.11 -2.07 -0.03 0.00 0.02 0.00 0.00 34.50 32.31 1tqy s PRO 376 CO 0.49 -0.92 0.12 0.50 -0.33 0.00 0.00 177.00 176.86 1tqy s ARG 377 N -3.17 3.72 -1.21 5.54 3.52 -1.00 -4.85 118.95 121.50 1tqy s ARG 377 Ca 0.72 -0.45 -0.15 0.00 -0.13 0.00 0.00 55.73 55.72 1tqy s ARG 377 Cb -0.28 -3.45 0.14 0.00 -1.56 0.00 0.00 34.95 29.80 1tqy s ARG 377 CO 0.31 -0.21 1.49 -1.54 -0.81 0.00 0.00 175.30 174.55 1tqy s SER 378 N 1.66 6.97 0.00 -2.12 1.04 -1.26 0.05 113.70 120.04 1tqy s SER 378 Ca 0.06 -2.76 0.18 0.00 0.48 0.00 0.00 55.95 53.91 1tqy s SER 378 Cb -0.16 -2.45 -0.01 0.00 0.10 0.00 0.00 66.02 63.50 1tqy s SER 378 CO 0.06 -0.89 0.91 0.35 0.98 0.00 0.00 173.24 174.65 1tqy n THR 379 N 5.17 0.00 -3.57 2.02 -2.24 -1.23 -4.98 114.28 109.46 1tqy n THR 379 Ca 0.39 -0.31 -0.23 0.00 -2.27 0.00 0.00 64.05 61.63 1tqy n THR 379 Cb 0.44 1.20 0.05 0.00 -2.10 0.00 0.00 70.33 69.92 1tqy n THR 379 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1tqy n ALA 380 N -0.13 -2.31 -1.43 6.98 0.00 -0.23 -4.92 120.51 118.47 1tqy n ALA 380 Ca 0.07 -0.11 -0.35 0.00 0.00 0.00 0.00 53.44 53.06 1tqy n ALA 380 Cb 0.37 -3.66 0.09 0.00 0.00 0.00 0.00 19.45 16.24 1tqy n ALA 380 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1tqy s PRO 381 N -5.55 2.22 0.00 0.00 0.04 -1.26 -4.96 135.00 125.49 1tqy s PRO 381 Ca 0.27 1.81 0.00 0.00 0.04 0.00 0.00 61.00 63.13 1tqy s PRO 381 Cb -0.07 -1.84 0.00 0.00 0.04 0.00 0.00 34.50 32.63 1tqy s PRO 381 CO 0.81 -1.79 0.00 0.54 0.04 0.00 0.00 177.00 176.60 1tqy n ARG 382 N -2.56 2.24 -4.32 4.56 1.74 -1.26 -4.56 116.66 112.50 1tqy n ARG 382 Ca 0.14 0.00 -0.26 0.00 -0.77 0.00 0.00 57.85 56.96 1tqy n ARG 382 Cb 0.50 -0.93 -0.17 0.00 -1.02 0.00 0.00 32.46 30.85 1tqy n ARG 382 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1tqy s THR 383 N -1.78 1.18 0.05 0.55 2.01 -1.26 -0.10 115.64 116.29 1tqy s THR 383 Ca 0.00 -0.45 0.09 0.00 0.31 0.00 0.00 61.69 61.64 1tqy s THR 383 Cb 0.00 -1.12 -0.03 0.00 0.01 0.00 0.00 72.50 71.36 1tqy s THR 383 CO 0.00 0.38 -0.25 0.00 -0.69 0.00 0.00 174.62 174.06 1tqy s ALA 384 N 1.10 2.15 -0.13 7.40 0.00 0.46 -1.31 121.76 131.43 1tqy s ALA 384 Ca -0.06 -1.23 -0.01 0.00 0.00 0.00 0.00 51.96 50.66 1tqy s ALA 384 Cb -0.14 -0.45 -0.02 0.00 0.00 0.00 0.00 23.12 22.51 1tqy s ALA 384 CO -0.02 0.50 -0.10 -1.17 0.00 0.00 0.00 175.76 174.97 1tqy s LEU 385 N -1.24 2.88 -0.12 0.00 2.96 -0.50 -0.16 118.68 122.51 1tqy s LEU 385 Ca 0.11 -0.26 0.02 0.00 -0.22 0.00 0.00 54.13 53.79 1tqy s LEU 385 Cb -0.10 -1.66 -0.00 0.00 0.50 0.00 0.00 46.19 44.93 1tqy s LEU 385 CO 0.02 0.18 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.34 1tqy s VAL 386 N 0.27 2.36 0.07 1.68 1.01 0.52 -0.47 120.40 125.86 1tqy s VAL 386 Ca -0.08 -0.90 0.08 0.00 0.00 0.00 0.00 61.98 61.08 1tqy s VAL 386 Cb -0.15 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 1tqy s VAL 386 CO 0.05 0.55 -0.19 -0.76 0.00 0.00 0.00 175.10 174.74 1tqy s LEU 387 N 0.42 2.60 -0.13 3.92 1.43 -0.29 -1.35 118.68 125.28 1tqy s LEU 387 Ca -0.15 -0.50 -0.12 0.00 -1.03 0.00 0.00 54.13 52.33 1tqy s LEU 387 Cb -0.17 -1.50 0.03 0.00 0.03 0.00 0.00 46.19 44.59 1tqy s LEU 387 CO 0.06 0.22 0.34 0.00 0.23 0.00 0.00 176.35 177.21 1tqy s ALA 388 N -1.00 -0.85 0.08 4.21 0.00 -0.33 -3.35 121.76 120.52 1tqy s ALA 388 Ca 0.16 0.98 0.09 0.00 0.00 0.00 0.00 51.96 53.18 1tqy s ALA 388 Cb -0.10 -0.57 -0.03 0.00 0.00 0.00 0.00 23.12 22.41 1tqy s ALA 388 CO 0.07 -0.17 -0.22 1.03 0.00 0.00 0.00 175.76 176.47 1tqy s ARG 389 N 0.24 1.32 -0.03 0.00 0.52 -1.26 -0.50 118.95 119.23 1tqy s ARG 389 Ca -0.00 -1.13 0.05 0.00 -0.52 0.00 0.00 55.73 54.13 1tqy s ARG 389 Cb -0.03 -1.57 -0.03 0.00 0.52 0.00 0.00 34.95 33.84 1tqy s ARG 389 CO -0.00 0.38 -0.16 0.20 0.02 0.00 0.00 175.30 175.74 1tqy s GLY 390 N -1.65 1.51 0.14 -3.53 0.00 0.76 -3.20 107.32 101.34 1tqy s GLY 390 Ca 0.09 -1.03 -0.34 0.00 0.00 0.00 0.00 44.72 43.44 1tqy s GLY 390 CO 0.04 -0.84 1.11 -2.13 0.00 0.00 0.00 173.10 171.28 1tqy n ARG 391 N 2.19 0.88 -0.65 2.90 0.63 -1.26 -1.49 116.66 119.85 1tqy n ARG 391 Ca -0.17 0.31 0.00 0.00 -0.92 0.00 0.00 57.85 57.08 1tqy n ARG 391 Cb 0.52 -1.79 0.00 0.00 0.45 0.00 0.00 32.46 31.64 1tqy n ARG 391 CO 0.00 0.00 0.00 0.91 -2.51 0.00 0.00 177.63 176.03 1tqy n TRP 392 N 1.49 0.00 0.00 -0.14 5.03 -1.26 -4.47 117.44 118.10 1tqy n TRP 392 Ca 0.16 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.69 1tqy n TRP 392 Cb 0.21 -0.03 0.00 0.00 -1.03 0.00 0.00 31.31 30.46 1tqy n TRP 392 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 1tqy n GLY 393 N -2.65 0.93 3.72 6.99 0.00 -0.80 -4.75 105.19 108.63 1tqy n GLY 393 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1tqy n GLY 393 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1tqy s PHE 394 N -2.00 3.25 -0.07 1.61 0.40 -0.56 -1.39 117.98 119.23 1tqy s PHE 394 Ca 0.00 0.99 0.05 0.00 -0.60 0.00 0.00 56.93 57.37 1tqy s PHE 394 Cb 0.00 -3.66 -0.00 0.00 0.51 0.00 0.00 43.02 39.86 1tqy s PHE 394 CO 0.00 -2.29 -0.22 -0.80 0.70 0.00 0.00 175.22 172.61 1tqy s ASN 395 N 1.04 2.77 0.00 1.36 0.01 0.00 -0.17 114.94 119.95 1tqy s ASN 395 Ca 0.64 -0.47 0.01 0.00 -0.71 0.00 0.00 52.86 52.33 1tqy s ASN 395 Cb -0.36 -0.94 -0.01 0.00 0.41 0.00 0.00 41.25 40.35 1tqy s ASN 395 CO 0.31 0.19 -0.05 -0.55 -1.51 0.00 0.00 177.10 175.48 1tqy s SER 396 N 0.08 0.57 -0.07 -1.22 0.15 0.35 -1.53 113.70 112.03 1tqy s SER 396 Ca -0.09 -0.14 -0.05 0.00 0.70 0.00 0.00 55.95 56.37 1tqy s SER 396 Cb -0.15 -0.05 0.02 0.00 -1.71 0.00 0.00 66.02 64.14 1tqy s SER 396 CO 0.05 0.02 0.18 0.00 1.20 0.00 0.00 173.24 174.68 1tqy s ALA 397 N -0.28 -0.42 0.00 5.45 0.00 -0.42 -1.19 121.76 124.91 1tqy s ALA 397 Ca 0.00 0.58 0.01 0.00 0.00 0.00 0.00 51.96 52.55 1tqy s ALA 397 Cb -0.03 -0.35 -0.01 0.00 0.00 0.00 0.00 23.12 22.73 1tqy s ALA 397 CO -0.00 -0.11 -0.05 0.00 0.00 0.00 0.00 175.76 175.60 1tqy s ALA 398 N 0.40 0.39 -0.12 0.00 0.00 -0.46 -1.28 121.76 120.70 1tqy s ALA 398 Ca -0.03 -0.24 0.01 0.00 0.00 0.00 0.00 51.96 51.70 1tqy s ALA 398 Cb -0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 23.12 22.98 1tqy s ALA 398 CO -0.02 0.08 -0.14 0.54 0.00 0.00 0.00 175.76 176.23 1tqy s VAL 399 N -0.21 3.00 0.05 0.00 0.11 0.40 -0.35 120.40 123.40 1tqy s VAL 399 Ca 0.01 -0.69 0.07 0.00 -2.93 0.00 0.00 61.98 58.44 1tqy s VAL 399 Cb -0.02 -2.24 -0.03 0.00 -1.53 0.00 0.00 36.38 32.55 1tqy s VAL 399 CO -0.00 0.54 -0.17 -0.76 -3.33 0.00 0.00 175.10 171.37 1tqy s LEU 400 N 0.19 2.67 0.04 2.54 1.43 0.78 -1.62 118.68 124.71 1tqy s LEU 400 Ca -0.08 -0.43 0.08 0.00 -1.03 0.00 0.00 54.13 52.67 1tqy s LEU 400 Cb -0.15 -1.55 -0.03 0.00 0.03 0.00 0.00 46.19 44.49 1tqy s LEU 400 CO 0.05 0.24 -0.23 -0.13 0.23 0.00 0.00 176.35 176.51 1tqy s ARG 401 N -1.58 1.55 0.43 1.70 0.52 -0.84 -0.40 118.95 120.32 1tqy s ARG 401 Ca 0.16 -1.00 -0.26 0.00 -0.52 0.00 0.00 55.73 54.11 1tqy s ARG 401 Cb -0.11 -1.68 -0.09 0.00 0.52 0.00 0.00 34.95 33.60 1tqy s ARG 401 CO 0.06 0.43 1.41 0.50 0.02 0.00 0.00 175.30 177.72 1tqy s ARG 402 N -1.17 3.84 0.00 3.54 3.00 0.86 -1.38 118.95 127.63 1tqy s ARG 402 Ca 0.09 2.38 0.18 0.00 -1.00 0.00 0.00 55.73 57.38 1tqy s ARG 402 Cb -0.09 -2.74 1.10 0.00 0.00 0.00 0.00 34.95 33.21 1tqy s ARG 402 CO 0.02 -0.68 1.49 0.34 0.00 0.00 0.00 175.30 176.47