#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yqw s LYS 4 N 0.00 4.58 0.28 0.00 -2.85 -1.26 -5.00 119.74 115.49 1yqw s LYS 4 Ca 0.00 1.64 -0.30 0.00 -1.00 0.00 0.00 55.97 56.31 1yqw s LYS 4 Cb 0.00 -3.33 -0.13 0.00 -2.06 0.00 0.00 37.83 32.31 1yqw s LYS 4 CO 0.00 0.03 1.34 1.58 0.10 0.00 0.00 175.35 178.39 1yqw n HIS 5 N 2.91 2.14 -4.30 1.78 -0.00 -1.26 -5.00 115.22 111.49 1yqw n HIS 5 Ca 0.04 0.49 -0.35 0.00 -0.00 0.00 0.00 57.72 57.91 1yqw n HIS 5 Cb 0.47 -2.43 -0.10 0.00 -0.00 0.00 0.00 29.99 27.94 1yqw n HIS 5 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 1yqw s ARG 6 N -0.99 3.25 0.16 1.57 0.52 -1.26 -5.07 118.95 117.12 1yqw s ARG 6 Ca 0.63 -0.40 -0.34 0.00 -0.52 0.00 0.00 55.73 55.10 1yqw s ARG 6 Cb -0.63 -2.89 -0.15 0.00 0.52 0.00 0.00 34.95 31.81 1yqw s ARG 6 CO 0.55 0.58 1.45 -2.30 0.02 0.00 0.00 175.30 175.59 1yqw n PRO 7 N 2.54 1.77 -2.48 3.54 -0.02 -1.26 -4.13 135.00 134.96 1yqw n PRO 7 Ca -0.18 0.63 -0.42 0.00 -2.02 0.00 0.00 63.50 61.51 1yqw n PRO 7 Cb 0.53 -2.33 -0.03 0.00 -0.02 0.00 0.00 33.50 31.66 1yqw n PRO 7 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1yqw s SER 8 N 0.60 7.12 -0.17 2.55 0.15 -1.26 0.27 113.70 122.96 1yqw s SER 8 Ca 0.78 1.92 0.01 0.00 0.70 0.00 0.00 55.95 59.36 1yqw s SER 8 Cb -0.76 -2.57 0.01 0.00 -1.71 0.00 0.00 66.02 60.98 1yqw s SER 8 CO 0.44 -0.45 -0.18 -0.69 1.20 0.00 0.00 173.24 173.55 1yqw s VAL 9 N 1.25 2.27 -0.21 4.45 1.01 0.20 -0.50 120.40 128.87 1yqw s VAL 9 Ca 0.57 -0.88 -0.09 0.00 0.00 0.00 0.00 61.98 61.57 1yqw s VAL 9 Cb -0.27 -1.95 -0.05 0.00 0.00 0.00 0.00 36.38 34.11 1yqw s VAL 9 CO 0.28 0.53 0.12 -0.69 0.00 0.00 0.00 175.10 175.34 1yqw s VAL 10 N 1.15 5.22 -0.21 2.92 1.01 0.21 -1.29 120.40 129.41 1yqw s VAL 10 Ca 0.01 0.12 0.01 0.00 0.00 0.00 0.00 61.98 62.12 1yqw s VAL 10 Cb -0.14 -3.39 0.03 0.00 0.00 0.00 0.00 36.38 32.87 1yqw s VAL 10 CO -0.08 0.41 -0.15 0.86 0.00 0.00 0.00 175.10 176.14 1yqw s TRP 11 N 0.61 2.91 -0.10 5.22 -0.11 -0.84 -0.62 118.94 126.01 1yqw s TRP 11 Ca 0.07 -1.70 -0.02 0.00 1.22 0.00 0.00 56.10 55.66 1yqw s TRP 11 Cb -0.12 -1.95 -0.03 0.00 -1.50 0.00 0.00 33.47 29.86 1yqw s TRP 11 CO 0.01 -0.79 -0.01 -0.51 -4.62 0.00 0.00 176.95 171.03 1yqw s LEU 12 N 1.28 3.52 -0.25 5.86 1.43 -0.34 -4.28 118.68 125.89 1yqw s LEU 12 Ca 0.02 0.09 -0.07 0.00 -1.03 0.00 0.00 54.13 53.14 1yqw s LEU 12 Cb -0.15 -1.81 -0.03 0.00 0.03 0.00 0.00 46.19 44.23 1yqw s LEU 12 CO -0.10 0.33 0.06 -1.00 0.23 0.00 0.00 176.35 175.88 1yqw s HIS 13 N -0.61 3.08 0.00 0.29 3.76 -1.26 -0.89 115.29 119.65 1yqw s HIS 13 Ca 0.10 -0.43 0.00 0.00 -0.15 0.00 0.00 55.06 54.58 1yqw s HIS 13 Cb -0.12 -2.23 0.00 0.00 1.11 0.00 0.00 32.58 31.34 1yqw s HIS 13 CO 0.02 -0.36 0.00 0.09 -0.85 0.00 0.00 174.74 173.65 1yqw n ASN 14 N 4.89 0.00 -4.55 1.40 5.03 0.78 -4.96 115.26 117.85 1yqw n ASN 14 Ca -0.16 0.00 -0.41 0.00 0.87 0.00 0.00 54.58 54.88 1yqw n ASN 14 Cb 0.51 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 39.24 1yqw n ASN 14 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1yqw s ALA 15 N -2.43 2.77 0.17 5.41 0.00 0.20 -4.87 121.76 123.02 1yqw s ALA 15 Ca 0.00 -1.92 -0.06 0.00 0.00 0.00 0.00 51.96 49.98 1yqw s ALA 15 Cb 0.00 -4.37 -0.02 0.00 0.00 0.00 0.00 23.12 18.73 1yqw s ALA 15 CO 0.00 -3.42 0.23 -1.83 0.00 0.00 0.00 175.76 170.73 1yqw s GLU 16 N 5.12 1.15 0.00 0.00 4.04 -1.26 -1.32 118.70 126.44 1yqw s GLU 16 Ca 0.40 -1.32 0.17 0.00 0.04 0.00 0.00 54.97 54.26 1yqw s GLU 16 Cb -0.04 0.34 0.04 0.00 0.02 0.00 0.00 34.13 34.49 1yqw s GLU 16 CO 0.01 -0.40 0.92 0.00 -1.84 0.00 0.00 175.26 173.94 1yqw n THR 18 N 0.25 0.00 0.07 0.00 -1.04 -1.26 -4.87 114.28 107.43 1yqw n THR 18 Ca 0.08 0.00 0.05 0.00 -2.04 0.00 0.00 64.05 62.14 1yqw n THR 18 Cb 0.37 -0.18 0.47 0.00 -1.82 0.00 0.00 70.33 69.18 1yqw n THR 18 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1yqw h GLY 19 N 0.00 0.43 0.86 3.41 0.00 -1.99 -1.80 103.07 103.98 1yqw h GLY 19 Ca 0.00 -0.16 -0.09 0.00 0.00 0.00 0.00 47.33 47.08 1yqw h GLY 19 CO 0.00 0.16 -0.19 0.00 0.00 0.00 0.00 176.54 176.51 1yqw h THR 21 N 0.24 0.79 -0.55 0.00 2.02 -1.92 -0.49 112.91 113.00 1yqw h THR 21 Ca 0.04 -0.09 0.03 0.00 0.77 0.00 0.00 66.41 67.16 1yqw h THR 21 Cb 0.73 0.51 -0.04 0.00 -1.74 0.00 0.00 68.15 67.61 1yqw h THR 21 CO 0.05 0.05 0.33 -0.33 0.37 0.00 0.00 175.52 175.98 1yqw h GLU 22 N 0.26 0.63 -0.20 6.66 4.39 -1.19 -2.20 114.58 122.93 1yqw h GLU 22 Ca 0.22 -0.04 0.01 0.00 0.34 0.00 0.00 59.36 59.89 1yqw h GLU 22 Cb 0.26 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.75 1yqw h GLU 22 CO -0.26 0.42 0.09 0.00 -1.16 0.00 0.00 179.01 178.10 1yqw h ALA 23 N 1.25 0.23 -0.71 3.43 0.00 -0.66 -2.50 119.26 120.30 1yqw h ALA 23 Ca 0.22 0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.27 1yqw h ALA 23 Cb 0.03 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 17.71 1yqw h ALA 23 CO -0.10 -0.33 0.27 0.00 0.00 0.00 0.00 179.25 179.09 1yqw h ALA 24 N 1.11 0.97 0.00 0.00 0.00 -0.62 -0.56 119.26 120.16 1yqw h ALA 24 Ca 0.08 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1yqw h ALA 24 Cb 0.03 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1yqw h ALA 24 CO -0.06 -0.21 0.00 0.44 0.00 0.00 0.00 179.25 179.42 1yqw n ILE 25 N -5.01 0.03 1.66 0.00 -5.35 -0.87 -1.76 119.36 108.06 1yqw n ILE 25 Ca 0.13 0.01 0.13 0.00 -0.27 0.00 0.00 62.75 62.74 1yqw n ILE 25 Cb 0.37 -0.61 0.61 0.00 -1.74 0.00 0.00 39.64 38.28 1yqw n ILE 25 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1yqw n ARG 26 N -1.04 1.39 -1.74 6.28 5.12 -0.22 -4.69 116.66 121.77 1yqw n ARG 26 Ca 0.18 -0.58 -0.39 0.00 -1.93 0.00 0.00 57.85 55.13 1yqw n ARG 26 Cb 0.10 -1.44 0.03 0.00 -1.16 0.00 0.00 32.46 29.99 1yqw n ARG 26 CO 0.00 0.00 0.00 -2.37 -1.93 0.00 0.00 177.63 173.33 1yqw n THR 27 N -0.27 3.21 -0.53 0.55 5.66 -0.72 -4.93 114.28 117.25 1yqw n THR 27 Ca 0.19 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.69 1yqw n THR 27 Cb 0.24 -1.71 0.00 0.00 -1.55 0.00 0.00 70.33 67.30 1yqw n THR 27 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 175.07 174.32 1yqw n ILE 28 N -0.59 0.09 -3.38 1.09 -5.35 -1.26 -4.14 119.36 105.82 1yqw n ILE 28 Ca 0.08 -0.28 -0.26 0.00 -0.27 0.00 0.00 62.75 62.01 1yqw n ILE 28 Cb 0.43 1.38 -0.09 0.00 -1.74 0.00 0.00 39.64 39.62 1yqw n ILE 28 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 1yqw n LYS 29 N -0.04 0.48 -2.51 6.28 4.81 -1.26 -3.76 118.16 122.15 1yqw n LYS 29 Ca 0.00 -3.31 -0.23 0.00 -0.87 0.00 0.00 58.31 53.89 1yqw n LYS 29 Cb 0.18 -1.62 0.08 0.00 0.02 0.00 0.00 35.03 33.69 1yqw n LYS 29 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1yqw s PRO 30 N -0.41 2.01 0.82 1.64 0.04 -1.26 -4.94 135.00 132.89 1yqw s PRO 30 Ca 0.33 -0.83 -0.11 0.00 0.04 0.00 0.00 61.00 60.43 1yqw s PRO 30 Cb 0.07 -2.33 0.09 0.00 0.04 0.00 0.00 34.50 32.36 1yqw s PRO 30 CO -0.17 -1.21 1.14 0.71 0.04 0.00 0.00 177.00 177.50 1yqw s TYR 31 N -3.07 2.08 0.37 0.56 1.51 -1.25 -4.74 117.35 112.82 1yqw s TYR 31 Ca 0.63 1.67 0.08 0.00 -1.01 0.00 0.00 57.07 58.43 1yqw s TYR 31 Cb -0.08 -3.26 0.81 0.00 -0.11 0.00 0.00 41.96 39.33 1yqw s TYR 31 CO 0.43 -2.36 1.94 0.97 -1.11 0.00 0.00 175.55 175.42 1yqw h ILE 32 N -1.22 0.96 -0.12 2.71 6.09 -1.84 -1.50 117.51 122.59 1yqw h ILE 32 Ca -0.44 -0.23 -0.03 0.00 -1.37 0.00 0.00 64.86 62.79 1yqw h ILE 32 Cb 1.26 0.22 -0.00 0.00 0.47 0.00 0.00 36.82 38.77 1yqw h ILE 32 CO 0.47 0.12 -0.03 -2.24 -3.07 0.00 0.00 178.15 173.40 1yqw h ASP 33 N 0.67 0.23 -0.87 2.19 -0.00 -1.96 -2.26 116.42 114.43 1yqw h ASP 33 Ca 0.33 -0.37 0.03 0.00 -0.00 0.00 0.00 57.03 57.02 1yqw h ASP 33 Cb 0.42 -0.06 -0.05 0.00 -0.00 0.00 0.00 39.33 39.63 1yqw h ASP 33 CO -0.12 0.55 0.56 0.00 -0.00 0.00 0.00 179.24 180.23 1yqw h ALA 34 N 0.69 1.14 0.09 4.15 0.00 -1.83 -0.23 119.26 123.27 1yqw h ALA 34 Ca 0.03 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1yqw h ALA 34 Cb 0.45 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1yqw h ALA 34 CO 0.01 0.41 -0.17 1.25 0.00 0.00 0.00 179.25 180.75 1yqw h LEU 35 N 1.09 -0.47 0.00 0.00 5.85 -1.16 0.55 115.31 121.17 1yqw h LEU 35 Ca 0.34 0.06 0.00 0.00 0.84 0.00 0.00 57.88 59.12 1yqw h LEU 35 Cb -0.00 0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.21 1yqw h LEU 35 CO -0.11 -0.25 -0.16 0.16 -0.34 0.00 0.00 178.44 177.74 1yqw h ILE 36 N -0.33 0.00 0.04 4.05 3.07 -1.22 -0.42 117.51 122.70 1yqw h ILE 36 Ca 0.03 -0.58 -0.31 0.00 1.55 0.00 0.00 64.86 65.55 1yqw h ILE 36 Cb 0.35 1.48 -0.04 0.00 -0.27 0.00 0.00 36.82 38.34 1yqw h ILE 36 CO -0.10 0.00 -1.75 -0.07 -1.05 0.00 0.00 178.15 175.18 1yqw h LEU 37 N 0.00 0.12 0.00 0.16 3.38 -0.94 -3.42 115.31 114.60 1yqw h LEU 37 Ca 0.00 -0.26 -0.14 0.00 0.09 0.00 0.00 57.88 57.57 1yqw h LEU 37 Cb 0.79 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 1yqw h LEU 37 CO 0.00 1.23 -1.53 0.47 0.09 0.00 0.00 178.44 178.70 1yqw n ASP 38 N -3.18 3.14 -0.05 -0.43 10.43 0.18 -4.93 116.55 121.71 1yqw n ASP 38 Ca -0.20 -0.01 -0.09 0.00 2.57 0.00 0.00 54.79 57.06 1yqw n ASP 38 Cb 1.05 0.57 -0.04 0.00 1.84 0.00 0.00 41.12 44.53 1yqw n ASP 38 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 177.20 176.54 1yqw n THR 39 N -2.35 0.59 -4.43 -3.53 -1.04 -0.25 -4.98 114.28 98.29 1yqw n THR 39 Ca -0.13 -0.19 -0.21 0.00 -2.04 0.00 0.00 64.05 61.48 1yqw n THR 39 Cb 0.74 -1.25 -0.10 0.00 -1.82 0.00 0.00 70.33 67.90 1yqw n THR 39 CO 0.00 0.00 0.00 0.27 -0.64 0.00 0.00 175.07 174.70 1yqw s ILE 40 N -2.20 1.76 -0.42 12.58 -4.36 -0.67 -4.07 121.20 123.81 1yqw s ILE 40 Ca -0.15 -2.16 -0.07 0.00 -0.26 0.00 0.00 60.65 58.01 1yqw s ILE 40 Cb 0.05 -2.40 0.09 0.00 1.25 0.00 0.00 42.46 41.45 1yqw s ILE 40 CO 0.21 -0.34 0.24 -0.55 0.24 0.00 0.00 174.94 174.74 1yqw s SER 41 N -3.44 5.49 -0.69 4.36 0.15 0.14 -4.44 113.70 115.26 1yqw s SER 41 Ca 0.29 -1.70 -0.25 0.00 0.70 0.00 0.00 55.95 54.99 1yqw s SER 41 Cb 0.02 -1.93 0.05 0.00 -1.71 0.00 0.00 66.02 62.45 1yqw s SER 41 CO 0.12 -0.55 1.14 -0.22 1.20 0.00 0.00 173.24 174.93 1yqw s LEU 42 N 1.32 3.69 0.00 3.45 2.96 -1.26 -0.62 118.68 128.22 1yqw s LEU 42 Ca 0.04 -0.63 0.21 0.00 -0.22 0.00 0.00 54.13 53.53 1yqw s LEU 42 Cb -0.23 -2.55 -0.14 0.00 0.50 0.00 0.00 46.19 43.77 1yqw s LEU 42 CO -0.00 -1.64 0.94 0.47 -1.32 0.00 0.00 176.35 174.79 1yqw n ASP 43 N 8.59 1.34 -3.63 3.68 10.43 -0.41 -4.82 116.55 131.73 1yqw n ASP 43 Ca 0.01 -1.17 -0.04 0.00 2.57 0.00 0.00 54.79 56.15 1yqw n ASP 43 Cb 0.48 0.81 -0.06 0.00 1.84 0.00 0.00 41.12 44.18 1yqw n ASP 43 CO 0.00 0.00 0.00 -0.47 -1.07 0.00 0.00 177.20 175.66 1yqw s TYR 44 N -2.73 -1.08 -0.30 1.24 5.04 -1.25 -4.63 117.35 113.64 1yqw s TYR 44 Ca 0.11 2.04 -0.02 0.00 -2.44 0.00 0.00 57.07 56.76 1yqw s TYR 44 Cb 0.16 0.65 0.19 0.00 0.35 0.00 0.00 41.96 43.31 1yqw s TYR 44 CO 0.73 -0.54 0.75 -1.14 -1.34 0.00 0.00 175.55 174.02 1yqw s GLN 45 N 2.05 0.43 0.44 4.97 -0.44 -1.26 -1.98 119.66 123.86 1yqw s GLN 45 Ca -0.08 0.57 0.09 0.00 -2.50 0.00 0.00 55.36 53.45 1yqw s GLN 45 Cb -0.07 0.29 0.96 0.00 -1.64 0.00 0.00 33.01 32.55 1yqw s GLN 45 CO -0.19 -0.64 2.07 0.93 0.50 0.00 0.00 175.29 177.96 1yqw h GLU 46 N 7.87 0.41 -0.35 1.67 5.08 -1.95 -1.09 114.58 126.21 1yqw h GLU 46 Ca -0.11 -0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.14 1yqw h GLU 46 Cb 1.18 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.32 1yqw h GLU 46 CO 0.10 0.27 -0.13 1.15 -1.00 0.00 0.00 179.01 179.40 1yqw h THR 47 N 0.43 1.25 0.00 1.13 2.02 -1.97 -3.35 112.91 112.42 1yqw h THR 47 Ca 0.13 -1.11 0.00 0.00 0.77 0.00 0.00 66.41 66.20 1yqw h THR 47 Cb -0.01 1.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 1yqw h THR 47 CO -0.03 0.37 0.00 2.30 0.37 0.00 0.00 175.52 178.53 1yqw n ILE 48 N -4.18 0.00 -2.41 3.11 -5.35 -1.03 -5.08 119.36 104.42 1yqw n ILE 48 Ca 0.01 -0.44 -0.35 0.00 -0.27 0.00 0.00 62.75 61.70 1yqw n ILE 48 Cb 0.35 1.06 -0.02 0.00 -1.74 0.00 0.00 39.64 39.29 1yqw n ILE 48 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1yqw s MET 49 N -0.49 3.69 0.06 6.28 0.23 -0.44 -4.97 119.30 123.66 1yqw s MET 49 Ca 0.00 1.52 -0.17 0.00 -1.03 0.00 0.00 55.69 56.01 1yqw s MET 49 Cb 0.00 -2.16 -0.15 0.00 -1.53 0.00 0.00 34.83 30.99 1yqw s MET 49 CO 0.00 -0.55 1.29 0.00 -2.03 0.00 0.00 175.02 173.73 1yqw h ALA 50 N 1.63 0.26 -2.62 3.16 0.00 -1.95 -3.45 119.26 116.29 1yqw h ALA 50 Ca -0.49 -0.46 -0.50 0.00 0.00 0.00 0.00 54.91 53.45 1yqw h ALA 50 Cb 1.24 -0.04 0.06 0.00 0.00 0.00 0.00 17.79 19.06 1yqw h ALA 50 CO 0.59 0.37 0.45 0.00 0.00 0.00 0.00 179.25 180.66 1yqw s ALA 51 N -3.93 2.83 0.26 0.00 0.00 -1.26 -5.06 121.76 114.60 1yqw s ALA 51 Ca -0.13 0.86 0.03 0.00 0.00 0.00 0.00 51.96 52.72 1yqw s ALA 51 Cb 0.06 -3.36 -0.05 0.00 0.00 0.00 0.00 23.12 19.77 1yqw s ALA 51 CO 0.82 -0.68 0.02 0.00 0.00 0.00 0.00 175.76 175.92 1yqw s ALA 52 N -1.68 1.93 0.00 0.00 0.00 -1.26 -4.49 121.76 116.26 1yqw s ALA 52 Ca 0.68 -1.84 0.00 0.00 0.00 0.00 0.00 51.96 50.80 1yqw s ALA 52 Cb -0.25 0.59 0.00 0.00 0.00 0.00 0.00 23.12 23.45 1yqw s ALA 52 CO 0.30 -0.28 0.00 0.41 0.00 0.00 0.00 175.76 176.19 1yqw n GLY 53 N -0.49 2.96 0.32 0.00 0.00 -1.26 -2.23 105.19 104.48 1yqw n GLY 53 Ca -0.04 -0.36 0.08 0.00 0.00 0.00 0.00 46.02 45.70 1yqw n GLY 53 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1yqw h GLU 54 N 0.00 0.39 -0.67 1.61 5.08 -1.99 -0.99 114.58 118.02 1yqw h GLU 54 Ca 0.00 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.26 1yqw h GLU 54 Cb 0.00 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 1yqw h GLU 54 CO 0.00 0.26 0.14 0.00 -1.00 0.00 0.00 179.01 178.41 1yqw h ALA 55 N 1.77 0.89 -0.30 3.43 0.00 -1.84 -0.37 119.26 122.83 1yqw h ALA 55 Ca 0.17 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 1yqw h ALA 55 Cb 0.17 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1yqw h ALA 55 CO -0.04 0.63 -0.16 0.00 0.00 0.00 0.00 179.25 179.69 1yqw h ALA 56 N 1.06 0.42 -0.75 0.00 0.00 -0.90 -0.75 119.26 118.34 1yqw h ALA 56 Ca 0.21 -0.34 0.08 0.00 0.00 0.00 0.00 54.91 54.86 1yqw h ALA 56 Cb 0.41 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 18.03 1yqw h ALA 56 CO 0.01 0.33 0.42 1.49 0.00 0.00 0.00 179.25 181.49 1yqw h GLU 57 N 0.39 0.71 -0.65 0.00 4.81 -1.05 -0.64 114.58 118.14 1yqw h GLU 57 Ca 0.07 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.18 1yqw h GLU 57 Cb 0.68 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.88 1yqw h GLU 57 CO 0.05 0.47 0.10 0.00 -0.73 0.00 0.00 179.01 178.90 1yqw h ALA 58 N 1.41 0.96 -0.68 2.92 0.00 -0.91 -1.29 119.26 121.67 1yqw h ALA 58 Ca 0.35 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 55.03 1yqw h ALA 58 Cb 0.29 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 1yqw h ALA 58 CO -0.23 0.65 0.41 0.00 0.00 0.00 0.00 179.25 180.09 1yqw h ALA 59 N 1.11 0.89 -0.13 0.00 0.00 -0.33 0.10 119.26 120.90 1yqw h ALA 59 Ca 0.20 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.12 1yqw h ALA 59 Cb 0.43 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1yqw h ALA 59 CO 0.01 0.15 -0.03 1.25 0.00 0.00 0.00 179.25 180.63 1yqw h LEU 60 N 0.79 -0.12 -0.51 0.00 5.85 -0.68 -2.16 115.31 118.48 1yqw h LEU 60 Ca 0.28 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 59.02 1yqw h LEU 60 Cb 0.07 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 1yqw h LEU 60 CO -0.13 -0.04 0.25 -0.74 -0.34 0.00 0.00 178.44 177.43 1yqw h HIS 61 N -0.00 0.74 -0.81 1.25 2.76 -0.81 -0.38 115.15 117.90 1yqw h HIS 61 Ca 0.06 -0.04 0.08 0.00 -2.20 0.00 0.00 60.37 58.28 1yqw h HIS 61 Cb 0.10 -0.23 -0.07 0.00 1.55 0.00 0.00 27.41 28.76 1yqw h HIS 61 CO -0.17 0.58 0.47 1.96 -1.30 0.00 0.00 177.93 179.47 1yqw h GLN 62 N 0.68 0.79 -0.16 5.26 4.20 -0.66 -0.95 115.11 124.28 1yqw h GLN 62 Ca 0.18 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.79 1yqw h GLN 62 Cb 0.12 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 27.71 1yqw h GLN 62 CO -0.02 0.53 -0.09 0.00 -0.67 0.00 0.00 178.83 178.57 1yqw h ALA 63 N 1.42 0.22 -0.36 3.87 0.00 -0.89 -1.99 119.26 121.54 1yqw h ALA 63 Ca 0.38 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1yqw h ALA 63 Cb 0.29 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1yqw h ALA 63 CO -0.22 0.05 0.24 -0.07 0.00 0.00 0.00 179.25 179.25 1yqw h LEU 64 N 0.00 0.34 -1.56 0.00 3.38 -0.77 -1.55 115.31 115.14 1yqw h LEU 64 Ca 0.03 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1yqw h LEU 64 Cb 0.58 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1yqw h LEU 64 CO 0.03 0.23 0.00 -0.62 0.09 0.00 0.00 178.44 178.17 1yqw n GLU 65 N -4.49 2.01 -1.67 1.13 -0.58 -0.39 -4.94 120.64 111.72 1yqw n GLU 65 Ca 0.03 -1.54 -0.44 0.00 -0.42 0.00 0.00 57.16 54.80 1yqw n GLU 65 Cb 0.14 -1.42 -0.02 0.00 -0.57 0.00 0.00 31.44 29.57 1yqw n GLU 65 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1yqw n GLY 66 N 1.25 0.51 0.32 0.62 0.00 -0.59 -4.88 105.19 102.42 1yqw n GLY 66 Ca 0.17 0.39 0.02 0.00 0.00 0.00 0.00 46.02 46.60 1yqw n GLY 66 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yqw h LYS 67 N 3.09 0.71 -0.01 1.61 6.56 -1.90 -2.61 116.57 124.03 1yqw h LYS 67 Ca -0.45 -0.06 0.00 0.00 -1.06 0.00 0.00 60.65 59.08 1yqw h LYS 67 Cb 1.29 -0.15 0.00 0.00 -0.57 0.00 0.00 32.23 32.80 1yqw h LYS 67 CO 0.67 0.50 -0.05 -0.25 -2.06 0.00 0.00 179.45 178.27 1yqw n ASP 68 N -4.42 0.78 -0.26 0.86 8.00 -1.26 -5.05 116.55 115.20 1yqw n ASP 68 Ca 0.05 -1.08 0.03 0.00 0.71 0.00 0.00 54.79 54.49 1yqw n ASP 68 Cb 0.08 -0.01 -0.01 0.00 -0.02 0.00 0.00 41.12 41.17 1yqw n ASP 68 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yqw n GLY 69 N 1.16 -2.09 3.38 0.44 0.00 -0.98 -4.96 105.19 102.13 1yqw n GLY 69 Ca 0.19 -1.42 -0.10 0.00 0.00 0.00 0.00 46.02 44.68 1yqw n GLY 69 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1yqw s TYR 70 N -0.83 -0.05 0.08 1.61 -0.85 -1.26 -4.39 117.35 111.66 1yqw s TYR 70 Ca 0.00 -0.29 0.02 0.00 -0.52 0.00 0.00 57.07 56.28 1yqw s TYR 70 Cb 0.00 0.23 -0.04 0.00 0.38 0.00 0.00 41.96 42.53 1yqw s TYR 70 CO 0.00 -0.76 0.14 0.71 -1.52 0.00 0.00 175.55 174.12 1yqw s TYR 71 N -3.86 3.31 -0.16 -3.49 1.51 0.35 0.25 117.35 115.26 1yqw s TYR 71 Ca 0.07 0.13 0.01 0.00 -1.01 0.00 0.00 57.07 56.27 1yqw s TYR 71 Cb 0.01 -1.66 0.01 0.00 -0.11 0.00 0.00 41.96 40.21 1yqw s TYR 71 CO -0.07 0.54 -0.17 -1.17 -1.11 0.00 0.00 175.55 173.57 1yqw s LEU 72 N -2.53 2.33 -0.19 -1.29 2.96 -0.54 -0.62 118.68 118.80 1yqw s LEU 72 Ca 0.32 -0.55 -0.08 0.00 -0.22 0.00 0.00 54.13 53.60 1yqw s LEU 72 Cb -0.12 -1.53 -0.04 0.00 0.50 0.00 0.00 46.19 45.00 1yqw s LEU 72 CO 0.24 0.05 0.08 -0.69 -1.32 0.00 0.00 176.35 174.72 1yqw s VAL 73 N 1.02 4.95 -0.12 1.68 1.01 0.21 -0.38 120.40 128.77 1yqw s VAL 73 Ca -0.02 0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.00 1yqw s VAL 73 Cb -0.15 -3.24 -0.01 0.00 0.00 0.00 0.00 36.38 32.98 1yqw s VAL 73 CO -0.04 0.45 -0.17 -0.69 0.00 0.00 0.00 175.10 174.64 1yqw s VAL 74 N 0.45 2.68 -0.13 2.92 1.01 0.16 -1.20 120.40 126.28 1yqw s VAL 74 Ca 0.04 -0.80 0.03 0.00 0.00 0.00 0.00 61.98 61.26 1yqw s VAL 74 Cb -0.12 -2.09 0.01 0.00 0.00 0.00 0.00 36.38 34.17 1yqw s VAL 74 CO 0.00 0.54 -0.22 -0.70 0.00 0.00 0.00 175.10 174.72 1yqw s GLU 75 N 0.36 3.04 0.00 2.72 2.12 -0.07 -1.23 118.70 125.63 1yqw s GLU 75 Ca -0.14 -0.85 0.00 0.00 0.36 0.00 0.00 54.97 54.34 1yqw s GLU 75 Cb -0.17 -2.42 0.00 0.00 0.26 0.00 0.00 34.13 31.80 1yqw s GLU 75 CO 0.07 0.02 0.00 0.41 -0.54 0.00 0.00 175.26 175.22 1yqw n GLY 76 N 3.96 1.85 3.72 -1.50 0.00 -1.26 -0.15 105.19 111.81 1yqw n GLY 76 Ca -0.20 -1.87 -0.25 0.00 0.00 0.00 0.00 46.02 43.70 1yqw n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yqw n GLY 77 N 1.70 -0.41 3.16 -0.02 0.00 -0.43 -2.87 105.19 106.32 1yqw n GLY 77 Ca 0.00 -1.87 -0.34 0.00 0.00 0.00 0.00 46.02 43.81 1yqw n GLY 77 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yqw s LEU 78 N 0.00 3.21 -0.16 0.99 1.43 -0.20 -0.63 118.68 123.31 1yqw s LEU 78 Ca 0.68 -1.00 -0.29 0.00 -1.03 0.00 0.00 54.13 52.48 1yqw s LEU 78 Cb -0.03 -1.63 -0.01 0.00 0.03 0.00 0.00 46.19 44.55 1yqw s LEU 78 CO 0.46 -0.14 1.23 -2.16 0.23 0.00 0.00 176.35 175.97 1yqw s PRO 79 N 1.27 4.25 -0.01 1.29 0.04 -1.26 -1.09 135.00 139.48 1yqw s PRO 79 Ca -0.02 1.63 0.15 0.00 0.04 0.00 0.00 61.00 62.80 1yqw s PRO 79 Cb -0.17 -3.73 -0.19 0.00 0.04 0.00 0.00 34.50 30.45 1yqw s PRO 79 CO -0.05 -0.67 0.52 0.25 0.04 0.00 0.00 177.00 177.09 1yqw n THR 80 N 5.29 0.00 -1.71 1.26 -2.24 -0.60 -4.32 114.28 111.95 1yqw n THR 80 Ca 0.13 -0.22 -0.37 0.00 -2.27 0.00 0.00 64.05 61.32 1yqw n THR 80 Cb 0.45 0.69 0.07 0.00 -2.10 0.00 0.00 70.33 69.44 1yqw n THR 80 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1yqw s ILE 81 N -2.64 2.03 -1.30 2.28 2.07 -0.82 -2.59 121.20 120.24 1yqw s ILE 81 Ca 0.01 0.02 -0.00 0.00 -1.41 0.00 0.00 60.65 59.27 1yqw s ILE 81 Cb 0.11 -2.98 0.00 0.00 0.13 0.00 0.00 42.46 39.72 1yqw s ILE 81 CO 0.62 -0.00 0.74 0.47 -1.91 0.00 0.00 174.94 174.85 1yqw n ASP 82 N -1.98 -1.32 -1.97 4.50 8.00 -1.26 -1.64 116.55 120.89 1yqw n ASP 82 Ca 0.16 -0.80 -0.19 0.00 0.71 0.00 0.00 54.79 54.67 1yqw n ASP 82 Cb 0.48 -4.18 -0.05 0.00 -0.02 0.00 0.00 41.12 37.36 1yqw n ASP 82 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yqw n GLY 83 N -1.53 0.73 1.75 0.44 0.00 -1.22 -1.85 105.19 103.52 1yqw n GLY 83 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1yqw n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yqw n GLY 84 N -0.66 0.54 0.00 -0.02 0.00 -0.65 -4.88 105.19 99.53 1yqw n GLY 84 Ca -0.21 -0.16 0.13 0.00 0.00 0.00 0.00 46.02 45.78 1yqw n GLY 84 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1yqw n GLN 85 N -2.87 0.23 0.00 1.61 6.02 -0.77 -3.17 117.38 118.43 1yqw n GLN 85 Ca 0.00 0.04 0.15 0.00 -0.01 0.00 0.00 57.00 57.17 1yqw n GLN 85 Cb 0.00 -1.50 0.70 0.00 1.02 0.00 0.00 30.24 30.46 1yqw n GLN 85 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 1yqw n TRP 86 N -1.37 0.00 -3.56 1.08 7.02 -1.26 -4.51 117.44 114.84 1yqw n TRP 86 Ca 0.10 0.00 -0.25 0.00 -1.02 0.00 0.00 57.50 56.34 1yqw n TRP 86 Cb 0.25 -0.13 -0.15 0.00 -2.42 0.00 0.00 31.31 28.86 1yqw n TRP 86 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 1yqw s GLY 87 N -2.32 0.28 0.02 6.99 0.00 -1.19 -5.03 107.32 106.06 1yqw s GLY 87 Ca 0.34 -0.37 0.03 0.00 0.00 0.00 0.00 44.72 44.73 1yqw s GLY 87 CO 0.43 1.94 -0.11 1.06 0.00 0.00 0.00 173.10 176.43 1yqw s MET 88 N 2.18 0.78 -0.05 2.90 -1.94 -1.26 -0.26 119.30 121.65 1yqw s MET 88 Ca 0.05 -0.55 0.01 0.00 -1.71 0.00 0.00 55.69 53.50 1yqw s MET 88 Cb -0.16 -0.74 0.02 0.00 2.01 0.00 0.00 34.83 35.96 1yqw s MET 88 CO -0.17 0.19 -0.07 0.08 -0.01 0.00 0.00 175.02 175.04 1yqw s VAL 89 N -0.62 0.73 -1.69 -6.03 1.01 -0.27 -4.81 120.40 108.73 1yqw s VAL 89 Ca 0.01 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 61.75 1yqw s VAL 89 Cb -0.06 -0.72 0.00 0.00 0.00 0.00 0.00 36.38 35.60 1yqw s VAL 89 CO 0.00 0.27 0.00 0.00 0.00 0.00 0.00 175.10 175.37 1yqw n ALA 90 N 3.98 -0.55 -0.75 5.51 0.00 -1.26 -1.43 120.51 126.01 1yqw n ALA 90 Ca -0.24 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1yqw n ALA 90 Cb 0.51 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 18.01 1yqw n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yqw n GLY 91 N -0.77 0.62 3.30 0.00 0.00 -1.26 -5.04 105.19 102.04 1yqw n GLY 91 Ca -0.21 -0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.50 1yqw n GLY 91 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1yqw s HIS 92 N -2.00 2.41 0.27 1.61 0.09 -0.51 -5.10 115.29 112.05 1yqw s HIS 92 Ca 0.00 -0.57 -0.30 0.00 -0.00 0.00 0.00 55.06 54.19 1yqw s HIS 92 Cb 0.00 -1.56 -0.13 0.00 -0.00 0.00 0.00 32.58 30.89 1yqw s HIS 92 CO 0.00 -0.12 1.31 -2.30 -0.00 0.00 0.00 174.74 173.63 1yqw n PRO 93 N 2.69 1.90 -0.32 8.40 -0.02 -1.26 -1.11 135.00 145.28 1yqw n PRO 93 Ca -0.17 0.67 0.03 0.00 -2.02 0.00 0.00 63.50 62.02 1yqw n PRO 93 Cb 0.52 -2.26 0.22 0.00 -0.02 0.00 0.00 33.50 31.95 1yqw n PRO 93 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 1yqw h MET 94 N 3.43 1.05 -0.60 -0.52 2.86 -0.79 -1.92 114.93 118.44 1yqw h MET 94 Ca -0.44 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.11 1yqw h MET 94 Cb 1.29 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 32.69 1yqw h MET 94 CO 0.70 0.69 0.30 0.97 1.06 0.00 0.00 176.91 180.63 1yqw h ILE 95 N 1.08 1.19 -0.38 -1.22 2.10 -1.84 -1.66 117.51 116.77 1yqw h ILE 95 Ca 0.40 -0.53 -0.12 0.00 1.08 0.00 0.00 64.86 65.69 1yqw h ILE 95 Cb 0.18 0.42 -0.01 0.00 -1.09 0.00 0.00 36.82 36.32 1yqw h ILE 95 CO -0.15 0.22 -0.24 -0.33 -1.08 0.00 0.00 178.15 176.57 1yqw h GLU 96 N 0.84 0.84 -0.32 2.19 5.08 -1.73 -1.72 114.58 119.76 1yqw h GLU 96 Ca 0.21 -0.39 -0.10 0.00 -1.00 0.00 0.00 59.36 58.07 1yqw h GLU 96 Cb 0.07 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1yqw h GLU 96 CO -0.03 1.03 -0.20 1.15 -1.00 0.00 0.00 179.01 179.96 1yqw h THR 97 N 0.64 1.29 -0.47 1.13 2.02 -1.31 -2.11 112.91 114.10 1yqw h THR 97 Ca 0.08 -1.34 -0.08 0.00 0.77 0.00 0.00 66.41 65.84 1yqw h THR 97 Cb 0.81 1.45 -0.02 0.00 -1.74 0.00 0.00 68.15 68.65 1yqw h THR 97 CO 0.07 0.43 -0.05 0.74 0.37 0.00 0.00 175.52 177.08 1yqw h THR 98 N 0.48 1.25 -0.35 3.16 2.02 -1.33 -0.63 112.91 117.51 1yqw h THR 98 Ca 0.07 -1.08 -0.01 0.00 0.77 0.00 0.00 66.41 66.15 1yqw h THR 98 Cb 0.75 0.94 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 1yqw h THR 98 CO 0.06 0.38 0.18 0.50 0.37 0.00 0.00 175.52 177.00 1yqw h LYS 99 N 0.74 0.49 -0.10 6.66 3.64 -1.25 0.31 116.57 127.07 1yqw h LYS 99 Ca 0.14 -0.07 0.01 0.00 -1.27 0.00 0.00 60.65 59.45 1yqw h LYS 99 Cb 0.52 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1yqw h LYS 99 CO 0.03 0.43 0.05 -0.22 -2.27 0.00 0.00 179.45 177.47 1yqw h LYS 100 N 0.43 0.11 -0.39 1.90 1.63 -1.16 -2.17 116.57 116.92 1yqw h LYS 100 Ca 0.12 -0.01 -0.05 0.00 -0.85 0.00 0.00 60.65 59.87 1yqw h LYS 100 Cb 0.09 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.68 1yqw h LYS 100 CO -0.02 0.07 0.05 0.00 -3.45 0.00 0.00 179.45 176.10 1yqw h ALA 101 N 1.05 0.51 -0.51 5.00 0.00 -0.95 -2.98 119.26 121.38 1yqw h ALA 101 Ca 0.04 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1yqw h ALA 101 Cb 0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1yqw h ALA 101 CO -0.03 0.24 0.25 0.00 0.00 0.00 0.00 179.25 179.71 1yqw h ALA 102 N 0.91 1.48 -0.85 0.00 0.00 -0.33 -2.64 119.26 117.84 1yqw h ALA 102 Ca 0.12 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.97 1yqw h ALA 102 Cb 0.39 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 1yqw h ALA 102 CO 0.01 0.42 0.55 0.00 0.00 0.00 0.00 179.25 180.23 1yqw h ALA 103 N 1.56 1.53 -0.01 0.00 0.00 -1.22 -2.99 119.26 118.13 1yqw h ALA 103 Ca 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1yqw h ALA 103 Cb 0.07 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1yqw h ALA 103 CO -0.02 0.36 -0.56 1.63 0.00 0.00 0.00 179.25 180.66 1yqw n LYS 104 N -4.47 1.48 -1.94 0.00 5.02 -1.15 -5.02 118.16 112.09 1yqw n LYS 104 Ca 0.12 -0.50 -0.38 0.00 -2.02 0.00 0.00 58.31 55.53 1yqw n LYS 104 Cb 0.16 -1.32 0.02 0.00 -0.02 0.00 0.00 35.03 33.88 1yqw n LYS 104 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1yqw s ALA 105 N -2.30 2.90 0.36 7.82 0.00 -1.01 -4.73 121.76 124.81 1yqw s ALA 105 Ca 0.11 1.21 0.11 0.00 0.00 0.00 0.00 51.96 53.39 1yqw s ALA 105 Cb 0.14 -3.51 0.70 0.00 0.00 0.00 0.00 23.12 20.45 1yqw s ALA 105 CO 0.56 -1.12 1.83 0.87 0.00 0.00 0.00 175.76 177.90 1yqw h LYS 106 N 1.73 0.10 -1.82 0.00 1.57 -0.55 -3.46 116.57 114.13 1yqw h LYS 106 Ca -0.50 -0.04 0.09 0.00 -1.87 0.00 0.00 60.65 58.33 1yqw h LYS 106 Cb 1.28 -0.01 -0.20 0.00 0.08 0.00 0.00 32.23 33.38 1yqw h LYS 106 CO 0.58 0.41 0.51 0.20 -0.57 0.00 0.00 179.45 180.59 1yqw s GLY 107 N -4.23 -0.35 -0.15 3.86 0.00 -1.26 -5.04 107.32 100.14 1yqw s GLY 107 Ca -0.04 1.64 0.02 0.00 0.00 0.00 0.00 44.72 46.34 1yqw s GLY 107 CO 0.73 0.79 -0.21 -0.42 0.00 0.00 0.00 173.10 173.99 1yqw s ILE 108 N -1.81 2.07 -0.22 0.90 1.01 -1.26 -1.46 121.20 120.42 1yqw s ILE 108 Ca 0.00 -0.97 -0.05 0.00 0.00 0.00 0.00 60.65 59.64 1yqw s ILE 108 Cb -0.01 -1.84 -0.01 0.00 0.01 0.00 0.00 42.46 40.61 1yqw s ILE 108 CO -0.01 0.55 -0.02 -0.63 0.00 0.00 0.00 174.94 174.83 1yqw s ILE 109 N 0.96 3.62 -0.52 2.92 1.01 0.49 -0.39 121.20 129.29 1yqw s ILE 109 Ca -0.03 -0.41 -0.20 0.00 0.00 0.00 0.00 60.65 60.00 1yqw s ILE 109 Cb -0.15 -2.66 0.05 0.00 0.01 0.00 0.00 42.46 39.72 1yqw s ILE 109 CO -0.05 0.41 0.70 0.00 0.00 0.00 0.00 174.94 175.99 1yqw s ILE 111 N 2.94 4.63 0.00 0.00 2.07 -0.37 -0.96 121.20 129.51 1yqw s ILE 111 Ca 0.19 1.53 0.00 0.00 -1.41 0.00 0.00 60.65 60.96 1yqw s ILE 111 Cb -0.18 -4.30 0.00 0.00 0.13 0.00 0.00 42.46 38.11 1yqw s ILE 111 CO 0.14 -0.37 0.00 0.61 -1.91 0.00 0.00 174.94 173.40 1yqw n GLY 112 N 3.97 1.07 0.37 1.50 0.00 0.61 -4.32 105.19 108.39 1yqw n GLY 112 Ca 0.09 -1.72 0.14 0.00 0.00 0.00 0.00 46.02 44.53 1yqw n GLY 112 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1yqw h THR 113 N 0.00 0.84 0.55 2.61 2.02 -1.70 -1.15 112.91 116.08 1yqw h THR 113 Ca 0.00 -0.14 -0.03 0.00 0.77 0.00 0.00 66.41 67.01 1yqw h THR 113 Cb 0.00 0.39 0.01 0.00 -1.74 0.00 0.00 68.15 66.80 1yqw h THR 113 CO 0.00 0.08 -0.27 0.00 0.37 0.00 0.00 175.52 175.70 1yqw h SER 115 N -0.94 0.91 0.15 0.00 4.64 -1.44 0.95 113.55 117.82 1yqw h SER 115 Ca -0.08 -0.23 -0.01 0.00 -0.47 0.00 0.00 61.79 61.00 1yqw h SER 115 Cb 0.63 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1yqw h SER 115 CO 0.12 0.91 -0.07 0.00 -0.87 0.00 0.00 176.83 176.92 1yqw h ALA 116 N 1.04 -0.21 0.00 5.18 0.00 -1.20 0.33 119.26 124.41 1yqw h ALA 116 Ca 0.19 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1yqw h ALA 116 Cb 0.36 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1yqw h ALA 116 CO 0.00 -0.59 -0.02 0.66 0.00 0.00 0.00 179.25 179.30 1yqw n TYR 117 N -5.16 0.00 0.00 0.00 4.01 0.43 -4.29 117.16 112.15 1yqw n TYR 117 Ca -0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.65 1yqw n TYR 117 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.16 1yqw n TYR 117 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1yqw n GLY 118 N 0.62 3.27 7.00 2.72 0.00 0.33 -3.82 105.19 115.30 1yqw n GLY 118 Ca 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.93 1yqw n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yqw n GLY 119 N 0.00 0.14 0.34 -0.02 0.00 -1.22 -3.72 105.19 100.71 1yqw n GLY 119 Ca 0.00 -0.93 -0.04 0.00 0.00 0.00 0.00 46.02 45.06 1yqw n GLY 119 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1yqw h VAL 120 N 0.00 1.24 0.00 1.61 3.04 -1.94 -0.94 116.25 119.26 1yqw h VAL 120 Ca 0.00 -0.49 0.00 0.00 -1.01 0.00 0.00 66.70 65.20 1yqw h VAL 120 Cb 0.00 -0.01 0.00 0.00 -2.01 0.00 0.00 31.29 29.27 1yqw h VAL 120 CO 0.00 0.24 0.00 0.06 -1.01 0.00 0.00 177.57 176.86 1yqw h GLN 121 N 1.20 0.00 0.00 4.17 -0.00 -1.93 -2.44 115.11 116.11 1yqw h GLN 121 Ca 0.32 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.97 1yqw h GLN 121 Cb -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.40 1yqw h GLN 121 CO -0.06 0.00 -0.26 -0.22 -0.00 0.00 0.00 178.83 178.29 1yqw h LYS 122 N 0.00 0.00 -6.73 0.06 3.64 -1.25 -3.41 116.57 108.89 1yqw h LYS 122 Ca 0.00 0.00 -0.57 0.00 -1.27 0.00 0.00 60.65 58.81 1yqw h LYS 122 Cb 0.44 0.00 0.13 0.00 -0.41 0.00 0.00 32.23 32.39 1yqw h LYS 122 CO 0.00 0.00 0.27 0.00 -2.27 0.00 0.00 179.45 177.45 1yqw n ALA 123 N -2.06 0.55 -1.63 5.00 0.00 -0.92 -4.04 120.51 117.41 1yqw n ALA 123 Ca 0.03 0.22 -0.45 0.00 0.00 0.00 0.00 53.44 53.24 1yqw n ALA 123 Cb 0.52 -2.15 -0.02 0.00 0.00 0.00 0.00 19.45 17.80 1yqw n ALA 123 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1yqw n LYS 124 N -0.03 1.62 -0.61 0.00 5.02 -1.26 -0.01 118.16 122.88 1yqw n LYS 124 Ca 0.09 0.57 -0.02 0.00 -2.02 0.00 0.00 58.31 56.93 1yqw n LYS 124 Cb 0.40 -2.05 0.20 0.00 -0.02 0.00 0.00 35.03 33.56 1yqw n LYS 124 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1yqw n PRO 125 N 1.04 2.82 -3.80 1.97 -0.04 -1.26 -5.00 135.00 130.73 1yqw n PRO 125 Ca 0.10 -1.88 -0.35 0.00 -0.04 0.00 0.00 63.50 61.33 1yqw n PRO 125 Cb 0.32 -1.88 0.03 0.00 -0.04 0.00 0.00 33.50 31.93 1yqw n PRO 125 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1yqw n ASN 126 N 0.08 -5.01 -0.14 3.54 2.85 0.98 -4.87 115.26 112.70 1yqw n ASN 126 Ca 0.23 -1.07 0.12 0.00 -0.11 0.00 0.00 54.58 53.76 1yqw n ASN 126 Cb 0.96 -2.71 0.46 0.00 1.24 0.00 0.00 39.78 39.73 1yqw n ASN 126 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1yqw h PRO 127 N -1.87 0.48 -0.11 1.20 0.13 -1.83 -1.45 132.00 128.56 1yqw h PRO 127 Ca -0.65 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.45 1yqw h PRO 127 Cb 1.36 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1yqw h PRO 127 CO 0.47 0.32 0.00 -1.13 -0.23 0.00 0.00 178.00 177.43 1yqw n SER 128 N -4.48 1.71 -3.72 1.44 3.41 -1.26 -4.93 113.62 105.78 1yqw n SER 128 Ca 0.12 -1.65 -0.26 0.00 -0.26 0.00 0.00 58.87 56.82 1yqw n SER 128 Cb 0.39 -0.07 0.03 0.00 -0.26 0.00 0.00 64.21 64.30 1yqw n SER 128 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1yqw n GLN 129 N 0.34 -2.92 -2.63 4.33 6.02 -0.55 -1.94 117.38 120.02 1yqw n GLN 129 Ca 0.17 0.52 -0.39 0.00 -0.01 0.00 0.00 57.00 57.30 1yqw n GLN 129 Cb 0.36 -4.66 -0.05 0.00 1.02 0.00 0.00 30.24 26.90 1yqw n GLN 129 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1yqw s ALA 130 N -3.64 3.29 0.08 -1.58 0.00 -1.26 -1.57 121.76 117.08 1yqw s ALA 130 Ca 0.21 0.70 0.03 0.00 0.00 0.00 0.00 51.96 52.91 1yqw s ALA 130 Cb -0.07 -3.25 -0.03 0.00 0.00 0.00 0.00 23.12 19.76 1yqw s ALA 130 CO 0.84 0.01 -0.10 0.15 0.00 0.00 0.00 175.76 176.66 1yqw s LYS 131 N -1.68 0.78 0.90 0.00 1.02 -0.25 -4.65 119.74 115.86 1yqw s LYS 131 Ca 0.47 -1.07 -0.10 0.00 0.02 0.00 0.00 55.97 55.29 1yqw s LYS 131 Cb -0.26 -0.51 0.14 0.00 -0.52 0.00 0.00 37.83 36.68 1yqw s LYS 131 CO 0.32 0.08 1.13 0.20 -0.92 0.00 0.00 175.35 176.16 1yqw s GLY 132 N -2.23 1.68 0.10 -3.33 0.00 -1.25 -1.04 107.32 101.25 1yqw s GLY 132 Ca 0.02 0.47 -0.24 0.00 0.00 0.00 0.00 44.72 44.97 1yqw s GLY 132 CO 0.00 0.89 1.71 -2.08 0.00 0.00 0.00 173.10 173.63 1yqw h VAL 133 N -1.77 0.84 -0.34 1.40 2.07 -1.11 -1.03 116.25 116.31 1yqw h VAL 133 Ca -0.45 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 66.95 1yqw h VAL 133 Cb 1.27 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.86 1yqw h VAL 133 CO 0.44 0.00 -0.31 0.77 0.02 0.00 0.00 177.57 178.49 1yqw h SER 134 N -0.14 0.76 -0.60 0.57 4.64 -1.79 -0.73 113.55 116.25 1yqw h SER 134 Ca 0.01 -0.31 0.06 0.00 -0.47 0.00 0.00 61.79 61.08 1yqw h SER 134 Cb 0.15 -0.21 -0.05 0.00 -0.31 0.00 0.00 62.40 61.97 1yqw h SER 134 CO -0.04 1.01 0.31 -0.08 -0.87 0.00 0.00 176.83 177.17 1yqw h GLU 135 N 0.62 0.57 0.12 4.77 4.81 -1.82 0.68 114.58 124.33 1yqw h GLU 135 Ca 0.07 -0.03 -0.29 0.00 -0.13 0.00 0.00 59.36 58.98 1yqw h GLU 135 Cb 0.83 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 30.08 1yqw h GLU 135 CO 0.07 0.38 -1.37 0.00 -0.73 0.00 0.00 179.01 177.36 1yqw h ALA 136 N 1.33 0.17 0.00 2.92 0.00 -1.00 -3.40 119.26 119.29 1yqw h ALA 136 Ca 0.27 -0.98 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1yqw h ALA 136 Cb 0.19 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1yqw h ALA 136 CO -0.19 1.04 -0.84 1.28 0.00 0.00 0.00 179.25 180.55 1yqw n LEU 137 N -3.50 0.36 -1.24 0.00 4.77 -0.30 -5.00 117.00 112.10 1yqw n LEU 137 Ca -0.12 -0.34 -0.15 0.00 -0.03 0.00 0.00 56.01 55.37 1yqw n LEU 137 Cb 1.03 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 42.07 1yqw n LEU 137 CO 0.52 0.09 -0.15 0.61 -1.33 0.00 0.00 177.39 177.14 1yqw n GLY 138 N 1.44 1.18 3.91 -0.72 0.00 0.23 -5.01 105.19 106.22 1yqw n GLY 138 Ca 0.01 -0.32 -0.30 0.00 0.00 0.00 0.00 46.02 45.41 1yqw n GLY 138 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1yqw s VAL 139 N -2.58 5.15 0.06 1.61 -7.23 -1.26 -5.07 120.40 111.08 1yqw s VAL 139 Ca 0.00 -0.06 -0.21 0.00 -1.81 0.00 0.00 61.98 59.90 1yqw s VAL 139 Cb 0.00 -3.66 -0.06 0.00 0.56 0.00 0.00 36.38 33.21 1yqw s VAL 139 CO 0.00 -0.06 0.62 -0.54 -0.31 0.00 0.00 175.10 174.81 1yqw s LYS 140 N -2.94 4.31 0.08 4.82 1.02 -1.26 -4.36 119.74 121.41 1yqw s LYS 140 Ca 0.41 0.82 0.06 0.00 0.02 0.00 0.00 55.97 57.28 1yqw s LYS 140 Cb -0.12 -3.28 -0.03 0.00 -0.52 0.00 0.00 37.83 33.88 1yqw s LYS 140 CO 0.26 0.52 -0.15 0.95 -0.92 0.00 0.00 175.35 176.01 1yqw s THR 141 N -0.75 1.21 -0.34 2.17 -4.23 -1.26 -4.65 115.64 107.79 1yqw s THR 141 Ca 0.31 -1.36 -0.24 0.00 -1.18 0.00 0.00 61.69 59.22 1yqw s THR 141 Cb -0.20 -1.16 0.01 0.00 1.34 0.00 0.00 72.50 72.49 1yqw s THR 141 CO 0.20 -0.21 0.82 -0.63 -0.54 0.00 0.00 174.62 174.26 1yqw s ILE 142 N -1.29 4.73 -0.18 2.99 1.01 0.47 -4.84 121.20 124.09 1yqw s ILE 142 Ca -0.00 1.11 -0.12 0.00 0.00 0.00 0.00 60.65 61.63 1yqw s ILE 142 Cb -0.10 -4.21 -0.05 0.00 0.01 0.00 0.00 42.46 38.11 1yqw s ILE 142 CO 0.03 -0.37 0.24 0.20 0.00 0.00 0.00 174.94 175.03 1yqw s ASN 143 N 1.74 6.34 -0.65 3.58 0.01 0.94 -0.37 114.94 126.54 1yqw s ASN 143 Ca 0.33 0.39 0.05 0.00 -0.71 0.00 0.00 52.86 52.93 1yqw s ASN 143 Cb -0.13 -2.15 0.19 0.00 0.41 0.00 0.00 41.25 39.57 1yqw s ASN 143 CO 0.15 0.11 0.54 -0.38 -1.51 0.00 0.00 177.10 176.02 1yqw n ILE 144 N 3.64 1.39 -2.02 0.60 2.08 -0.14 -4.07 119.36 120.85 1yqw n ILE 144 Ca -0.13 -4.76 -0.27 0.00 0.56 0.00 0.00 62.75 58.15 1yqw n ILE 144 Cb 0.52 -2.10 0.18 0.00 -0.75 0.00 0.00 39.64 37.49 1yqw n ILE 144 CO 0.00 0.00 0.00 -0.81 0.56 0.00 0.00 176.55 176.30 1yqw n PRO 145 N 1.76 -1.01 0.00 0.38 -0.04 -1.26 -0.28 135.00 134.55 1yqw n PRO 145 Ca 0.24 -2.09 0.00 0.00 -0.04 0.00 0.00 63.50 61.60 1yqw n PRO 145 Cb 0.39 -1.17 0.00 0.00 -0.04 0.00 0.00 33.50 32.67 1yqw n PRO 145 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1yqw n GLY 146 N -3.10 3.28 2.32 0.55 0.00 -1.20 -4.07 105.19 102.97 1yqw n GLY 146 Ca 0.16 -1.91 -0.25 0.00 0.00 0.00 0.00 46.02 44.02 1yqw n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yqw s PRO 148 N -1.90 2.26 0.75 0.00 0.04 -1.26 -5.07 135.00 129.82 1yqw s PRO 148 Ca 0.38 -0.85 -0.11 0.00 0.04 0.00 0.00 61.00 60.46 1yqw s PRO 148 Cb 0.17 -2.42 0.04 0.00 0.04 0.00 0.00 34.50 32.34 1yqw s PRO 148 CO -0.07 -0.97 1.08 -1.25 0.04 0.00 0.00 177.00 175.83 1yqw s PRO 149 N -4.91 2.44 0.32 0.56 0.04 -1.14 -5.01 135.00 127.30 1yqw s PRO 149 Ca 0.60 1.07 -0.29 0.00 0.04 0.00 0.00 61.00 62.42 1yqw s PRO 149 Cb -0.09 -1.92 -0.10 0.00 0.04 0.00 0.00 34.50 32.42 1yqw s PRO 149 CO 0.41 -1.49 1.36 1.21 0.04 0.00 0.00 177.00 178.53 1yqw s ASN 150 N -3.54 6.69 0.52 6.66 3.84 -1.26 -4.81 114.94 123.03 1yqw s ASN 150 Ca 0.60 2.73 0.23 0.00 0.21 0.00 0.00 52.86 56.63 1yqw s ASN 150 Cb -0.16 -2.64 1.35 0.00 -0.55 0.00 0.00 41.25 39.24 1yqw s ASN 150 CO 0.56 -0.62 2.03 1.55 -2.79 0.00 0.00 177.10 177.82 1yqw h PRO 151 N 3.76 0.02 -0.90 0.43 0.13 -1.91 -0.96 132.00 132.58 1yqw h PRO 151 Ca -0.48 -0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.68 1yqw h PRO 151 Cb 1.23 -0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.30 1yqw h PRO 151 CO 0.68 0.02 0.59 0.82 -0.23 0.00 0.00 178.00 179.88 1yqw h ILE 152 N 0.02 1.16 -0.17 -3.56 2.04 -1.92 0.11 117.51 115.19 1yqw h ILE 152 Ca 0.20 -0.39 -0.09 0.00 1.00 0.00 0.00 64.86 65.58 1yqw h ILE 152 Cb 0.77 -0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1yqw h ILE 152 CO -0.01 0.21 -0.25 0.78 0.00 0.00 0.00 178.15 178.89 1yqw h ASN 153 N 1.15 0.51 0.17 1.72 2.35 -1.57 -0.86 115.58 119.05 1yqw h ASN 153 Ca 0.36 -0.52 -0.01 0.00 -0.55 0.00 0.00 56.30 55.58 1yqw h ASN 153 Cb -0.01 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.21 1yqw h ASN 153 CO -0.11 0.93 -0.08 0.15 -1.65 0.00 0.00 177.43 176.66 1yqw h PHE 154 N 0.11 -0.22 -0.65 1.19 3.57 -1.27 -1.71 116.94 117.96 1yqw h PHE 154 Ca 0.02 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.46 1yqw h PHE 154 Cb 0.82 0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.60 1yqw h PHE 154 CO 0.09 0.15 0.19 0.28 -2.23 0.00 0.00 178.31 176.79 1yqw h VAL 155 N -0.63 1.25 -0.13 1.41 2.07 -1.09 0.31 116.25 119.44 1yqw h VAL 155 Ca -0.02 -0.87 0.02 0.00 0.82 0.00 0.00 66.70 66.65 1yqw h VAL 155 Cb 0.47 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 1yqw h VAL 155 CO 0.04 0.33 -0.02 1.23 0.02 0.00 0.00 177.57 179.17 1yqw h GLY 156 N 1.05 0.10 0.76 2.17 0.00 -1.18 0.17 103.07 106.14 1yqw h GLY 156 Ca 0.21 0.03 0.01 0.00 0.00 0.00 0.00 47.33 47.58 1yqw h GLY 156 CO -0.01 -0.04 -0.17 0.00 0.00 0.00 0.00 176.54 176.33 1yqw h ALA 157 N 1.12 -0.31 -0.16 3.60 0.00 -0.90 0.57 119.26 123.18 1yqw h ALA 157 Ca 0.06 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.98 1yqw h ALA 157 Cb 0.09 0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 1yqw h ALA 157 CO -0.12 -0.70 -0.16 0.28 0.00 0.00 0.00 179.25 178.55 1yqw h VAL 158 N -0.35 0.58 -0.77 0.00 2.07 -0.59 -0.05 116.25 117.13 1yqw h VAL 158 Ca 0.01 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 1yqw h VAL 158 Cb 0.34 0.58 -0.04 0.00 -1.52 0.00 0.00 31.29 30.65 1yqw h VAL 158 CO -0.07 0.00 0.35 0.58 0.02 0.00 0.00 177.57 178.45 1yqw h VAL 159 N -0.18 1.25 -0.19 2.57 2.07 -0.60 -2.24 116.25 118.93 1yqw h VAL 159 Ca 0.11 -0.73 -0.01 0.00 0.82 0.00 0.00 66.70 66.89 1yqw h VAL 159 Cb 0.33 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1yqw h VAL 159 CO -0.27 0.30 0.08 -0.74 0.02 0.00 0.00 177.57 176.96 1yqw h HIS 160 N 1.10 0.29 -0.85 1.57 6.17 -0.24 -1.91 115.15 121.29 1yqw h HIS 160 Ca 0.26 -0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.33 1yqw h HIS 160 Cb 0.15 -0.09 -0.04 0.00 2.52 0.00 0.00 27.41 29.95 1yqw h HIS 160 CO 0.02 0.34 0.55 0.28 0.71 0.00 0.00 177.93 179.82 1yqw h VAL 161 N 0.16 1.22 0.00 5.26 2.07 -0.80 0.26 116.25 124.43 1yqw h VAL 161 Ca 0.06 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 1yqw h VAL 161 Cb 0.17 -0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 29.92 1yqw h VAL 161 CO -0.01 0.22 -0.10 -0.07 0.02 0.00 0.00 177.57 177.63 1yqw h LEU 162 N 1.15 0.00 0.00 2.57 3.38 -1.19 -3.31 115.31 117.92 1yqw h LEU 162 Ca 0.31 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.18 1yqw h LEU 162 Cb -0.11 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1yqw h LEU 162 CO -0.06 0.10 -1.39 0.35 0.09 0.00 0.00 178.44 177.53 1yqw n THR 163 N -3.13 0.39 -0.07 0.22 -2.24 -0.74 -4.89 114.28 103.82 1yqw n THR 163 Ca 0.03 -0.16 -0.09 0.00 -2.27 0.00 0.00 64.05 61.56 1yqw n THR 163 Cb 0.55 -0.75 -0.06 0.00 -2.10 0.00 0.00 70.33 67.97 1yqw n THR 163 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1yqw n LYS 164 N -2.65 0.33 0.00 -0.78 5.02 0.78 -5.09 118.16 115.77 1yqw n LYS 164 Ca -0.12 0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.25 1yqw n LYS 164 Cb 0.63 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 34.39 1yqw n LYS 164 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1yqw n GLY 165 N 2.85 0.92 3.67 0.72 0.00 -0.46 -5.02 105.19 107.88 1yqw n GLY 165 Ca -0.23 -1.94 -0.43 0.00 0.00 0.00 0.00 46.02 43.42 1yqw n GLY 165 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yqw s ILE 166 N -2.41 4.26 0.68 -0.61 1.01 -1.26 -3.12 121.20 119.75 1yqw s ILE 166 Ca 0.00 1.54 -0.15 0.00 0.00 0.00 0.00 60.65 62.04 1yqw s ILE 166 Cb 0.00 -3.99 0.01 0.00 0.01 0.00 0.00 42.46 38.49 1yqw s ILE 166 CO 0.00 -0.10 1.15 -2.16 0.00 0.00 0.00 174.94 173.83 1yqw s PRO 167 N 3.14 2.57 0.14 2.79 0.04 -1.26 -4.94 135.00 137.47 1yqw s PRO 167 Ca 0.55 1.55 -0.33 0.00 0.04 0.00 0.00 61.00 62.81 1yqw s PRO 167 Cb -0.23 -1.91 -0.13 0.00 0.04 0.00 0.00 34.50 32.28 1yqw s PRO 167 CO 0.17 -1.46 1.70 -0.25 0.04 0.00 0.00 177.00 177.19 1yqw n ASP 168 N -2.47 3.54 -4.59 6.66 10.43 -1.26 -4.92 116.55 123.94 1yqw n ASP 168 Ca 0.12 1.05 -0.32 0.00 2.57 0.00 0.00 54.79 58.20 1yqw n ASP 168 Cb 0.51 -1.48 -0.10 0.00 1.84 0.00 0.00 41.12 41.89 1yqw n ASP 168 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1yqw s LEU 169 N 1.65 3.14 0.00 0.64 1.43 -1.26 -1.72 118.68 122.56 1yqw s LEU 169 Ca 0.80 -0.17 -0.04 0.00 -1.03 0.00 0.00 54.13 53.70 1yqw s LEU 169 Cb -0.60 -1.81 0.05 0.00 0.03 0.00 0.00 46.19 43.86 1yqw s LEU 169 CO 0.38 0.28 0.29 -0.90 0.23 0.00 0.00 176.35 176.62 1yqw n ASP 170 N 1.51 0.00 0.23 2.29 5.68 0.18 -4.87 116.55 121.58 1yqw n ASP 170 Ca -0.15 -1.10 0.06 0.00 -0.50 0.00 0.00 54.79 53.10 1yqw n ASP 170 Cb 0.52 -0.22 0.53 0.00 -1.14 0.00 0.00 41.12 40.82 1yqw n ASP 170 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 1yqw h GLU 171 N 0.00 0.00 -0.59 0.11 4.57 -2.00 -1.59 114.58 115.08 1yqw h GLU 171 Ca -0.09 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1yqw h GLU 171 Cb 0.25 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.84 1yqw h GLU 171 CO 0.07 0.18 0.00 0.09 -1.18 0.00 0.00 179.01 178.17 1yqw n ASN 172 N -4.19 3.30 -0.30 1.04 5.03 -1.26 -4.92 115.26 113.97 1yqw n ASN 172 Ca -0.02 -2.24 -0.04 0.00 0.87 0.00 0.00 54.58 53.15 1yqw n ASN 172 Cb 0.25 -0.45 -0.02 0.00 -1.02 0.00 0.00 39.78 38.55 1yqw n ASN 172 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1yqw n GLY 173 N 0.97 0.68 3.82 7.41 0.00 -0.60 -4.73 105.19 112.74 1yqw n GLY 173 Ca 0.18 -0.72 -0.38 0.00 0.00 0.00 0.00 46.02 45.10 1yqw n GLY 173 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yqw s ARG 174 N -2.07 3.89 0.11 1.61 0.52 -1.26 -0.04 118.95 121.72 1yqw s ARG 174 Ca 0.00 0.25 -0.31 0.00 -0.52 0.00 0.00 55.73 55.15 1yqw s ARG 174 Cb 0.00 -3.26 -0.10 0.00 0.52 0.00 0.00 34.95 32.11 1yqw s ARG 174 CO 0.00 0.61 1.79 -2.14 0.02 0.00 0.00 175.30 175.58 1yqw s PRO 175 N -0.74 4.15 0.52 3.54 0.02 -1.26 -0.65 135.00 140.59 1yqw s PRO 175 Ca 0.21 2.54 0.25 0.00 0.02 0.00 0.00 61.00 64.01 1yqw s PRO 175 Cb -0.15 -3.57 1.43 0.00 0.02 0.00 0.00 34.50 32.23 1yqw s PRO 175 CO 0.10 -0.81 2.10 0.87 -0.33 0.00 0.00 177.00 178.93 1yqw h LYS 176 N 8.47 0.00 -1.09 5.54 1.57 -1.67 -0.32 116.57 129.07 1yqw h LYS 176 Ca -0.45 0.00 0.32 0.00 -1.87 0.00 0.00 60.65 58.64 1yqw h LYS 176 Cb 1.21 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 33.41 1yqw h LYS 176 CO 0.94 0.10 0.68 -0.07 -0.57 0.00 0.00 179.45 180.53 1yqw h LEU 177 N 0.00 0.44 0.00 2.94 3.38 -1.89 -1.09 115.31 119.09 1yqw h LEU 177 Ca -0.00 0.13 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 1yqw h LEU 177 Cb 0.24 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1yqw h LEU 177 CO 0.01 -0.03 -1.21 0.49 0.09 0.00 0.00 178.44 177.80 1yqw n PHE 178 N -4.77 0.00 -0.53 1.13 3.01 -0.81 -4.77 117.46 110.73 1yqw n PHE 178 Ca 0.30 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.81 1yqw n PHE 178 Cb 1.01 -0.14 0.12 0.00 -0.01 0.00 0.00 39.48 40.46 1yqw n PHE 178 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1yqw n TYR 179 N -1.98 0.27 0.63 1.38 4.02 -0.20 -3.33 117.16 117.96 1yqw n TYR 179 Ca -0.04 -0.71 0.12 0.00 -0.01 0.00 0.00 57.90 57.25 1yqw n TYR 179 Cb 0.46 -0.12 0.46 0.00 -0.02 0.00 0.00 39.34 40.12 1yqw n TYR 179 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1yqw n GLY 180 N -0.56 -1.39 3.23 2.72 0.00 -0.42 -4.54 105.19 104.23 1yqw n GLY 180 Ca 0.11 -0.02 -0.21 0.00 0.00 0.00 0.00 46.02 45.90 1yqw n GLY 180 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1yqw s GLU 181 N -3.11 0.97 0.24 1.61 2.02 -1.26 -5.06 118.70 114.10 1yqw s GLU 181 Ca 0.09 -1.05 -0.30 0.00 0.02 0.00 0.00 54.97 53.73 1yqw s GLU 181 Cb 0.12 -1.11 -0.09 0.00 0.10 0.00 0.00 34.13 33.15 1yqw s GLU 181 CO 0.46 0.25 1.36 -0.51 0.02 0.00 0.00 175.26 176.84 1yqw s LEU 182 N -1.81 4.41 0.25 1.80 1.43 -1.26 -2.35 118.68 121.14 1yqw s LEU 182 Ca 0.02 2.54 -0.13 0.00 -1.03 0.00 0.00 54.13 55.54 1yqw s LEU 182 Cb -0.10 -3.62 0.34 0.00 0.03 0.00 0.00 46.19 42.84 1yqw s LEU 182 CO 0.03 -0.59 1.56 0.58 0.23 0.00 0.00 176.35 178.16 1yqw h VAL 183 N 3.56 0.04 -0.96 -1.59 2.07 -0.70 -1.67 116.25 117.00 1yqw h VAL 183 Ca -0.46 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.22 1yqw h VAL 183 Cb 1.22 0.04 -0.10 0.00 -1.52 0.00 0.00 31.29 30.93 1yqw h VAL 183 CO 0.76 0.00 0.58 -0.74 0.02 0.00 0.00 177.57 178.19 1yqw h HIS 184 N -0.01 1.03 0.00 1.57 6.17 -1.69 -2.02 115.15 120.19 1yqw h HIS 184 Ca 0.40 0.03 0.00 0.00 0.71 0.00 0.00 60.37 61.51 1yqw h HIS 184 Cb 0.65 -0.31 0.00 0.00 2.52 0.00 0.00 27.41 30.27 1yqw h HIS 184 CO -0.78 0.31 0.00 -0.25 0.71 0.00 0.00 177.93 177.91 1yqw n ASP 185 N -4.74 0.47 -0.07 3.26 10.43 -0.63 -2.05 116.55 123.22 1yqw n ASP 185 Ca 0.20 0.63 0.01 0.00 2.57 0.00 0.00 54.79 58.19 1yqw n ASP 185 Cb 0.46 -0.72 0.02 0.00 1.84 0.00 0.00 41.12 42.71 1yqw n ASP 185 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 1yqw n ASN 186 N -2.03 2.04 -4.72 -2.24 3.02 -0.78 -5.04 115.26 105.52 1yqw n ASN 186 Ca 0.02 -1.94 -0.41 0.00 -0.03 0.00 0.00 54.58 52.21 1yqw n ASN 186 Cb 0.19 -0.03 -0.04 0.00 -0.61 0.00 0.00 39.78 39.29 1yqw n ASN 186 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1yqw h PRO 188 N 6.07 0.00 -0.21 0.00 0.11 -1.93 -2.05 132.00 134.00 1yqw h PRO 188 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1yqw h PRO 188 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1yqw h PRO 188 CO 0.73 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 179.06 1yqw n ARG 189 N -2.42 1.80 -0.34 1.05 1.74 -1.26 -4.43 116.66 112.81 1yqw n ARG 189 Ca 0.00 -1.21 0.05 0.00 -0.77 0.00 0.00 57.85 55.92 1yqw n ARG 189 Cb 0.15 -1.39 0.23 0.00 -1.02 0.00 0.00 32.46 30.43 1yqw n ARG 189 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1yqw h LEU 190 N 2.36 0.94 -1.27 0.55 5.85 -1.68 -0.91 115.31 121.16 1yqw h LEU 190 Ca 0.00 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.78 1yqw h LEU 190 Cb 0.52 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 1yqw h LEU 190 CO 0.00 0.58 0.51 -0.65 -0.34 0.00 0.00 178.44 178.54 1yqw h PRO 191 N 1.06 0.91 -0.40 5.25 0.11 -1.83 -0.22 132.00 136.88 1yqw h PRO 191 Ca 0.43 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 66.44 1yqw h PRO 191 Cb 0.28 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.17 1yqw h PRO 191 CO -0.18 0.61 0.07 0.45 -0.21 0.00 0.00 178.00 178.73 1yqw h HIS 192 N 0.94 0.69 -0.14 0.65 3.86 -1.51 -0.26 115.15 119.39 1yqw h HIS 192 Ca 0.31 -0.10 0.04 0.00 -1.16 0.00 0.00 60.37 59.47 1yqw h HIS 192 Cb 0.07 -0.19 -0.05 0.00 1.06 0.00 0.00 27.41 28.30 1yqw h HIS 192 CO -0.00 0.69 -0.14 0.35 0.86 0.00 0.00 177.93 179.69 1yqw h PHE 193 N 0.50 -0.35 0.00 2.45 3.57 -0.69 0.36 116.94 122.79 1yqw h PHE 193 Ca 0.12 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.60 1yqw h PHE 193 Cb 0.36 0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.27 1yqw h PHE 193 CO 0.02 -0.21 -0.21 0.93 -2.23 0.00 0.00 178.31 176.62 1yqw h GLU 194 N -0.17 0.00 -0.45 1.11 5.08 -0.97 -1.83 114.58 117.35 1yqw h GLU 194 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1yqw h GLU 194 Cb 0.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1yqw h GLU 194 CO -0.24 0.21 0.00 0.00 -1.00 0.00 0.00 179.01 177.98 1yqw n ALA 195 N -2.28 2.49 -3.88 3.43 0.00 -0.12 -4.93 120.51 115.22 1yqw n ALA 195 Ca -0.01 -0.78 -0.29 0.00 0.00 0.00 0.00 53.44 52.36 1yqw n ALA 195 Cb 0.35 -0.97 0.03 0.00 0.00 0.00 0.00 19.45 18.86 1yqw n ALA 195 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1yqw n SER 196 N 0.74 -4.39 -4.18 0.00 7.64 -0.53 -4.96 113.62 107.94 1yqw n SER 196 Ca 0.15 -0.78 -0.40 0.00 1.01 0.00 0.00 58.87 58.85 1yqw n SER 196 Cb 0.39 -3.95 -0.09 0.00 -1.01 0.00 0.00 64.21 59.56 1yqw n SER 196 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1yqw s GLU 197 N -6.53 2.44 0.11 1.43 2.02 0.12 -5.02 118.70 113.27 1yqw s GLU 197 Ca 0.57 -1.90 0.09 0.00 0.02 0.00 0.00 54.97 53.75 1yqw s GLU 197 Cb -0.29 -3.85 -0.04 0.00 0.10 0.00 0.00 34.13 30.05 1yqw s GLU 197 CO 0.82 -1.17 -0.19 -0.06 0.02 0.00 0.00 175.26 174.69 1yqw s PHE 198 N 1.09 2.52 -0.18 1.61 0.08 -1.26 -1.15 117.98 120.69 1yqw s PHE 198 Ca 0.08 -0.27 -0.22 0.00 0.12 0.00 0.00 56.93 56.64 1yqw s PHE 198 Cb -0.24 -1.35 -0.02 0.00 -0.57 0.00 0.00 43.02 40.84 1yqw s PHE 198 CO -0.02 0.37 0.69 0.00 -0.10 0.00 0.00 175.22 176.17 1yqw s ALA 199 N -1.12 3.53 -0.48 5.36 0.00 -0.58 -4.84 121.76 123.62 1yqw s ALA 199 Ca 0.17 -0.16 0.24 0.00 0.00 0.00 0.00 51.96 52.21 1yqw s ALA 199 Cb -0.11 -3.05 0.38 0.00 0.00 0.00 0.00 23.12 20.35 1yqw s ALA 199 CO 0.09 -0.57 1.54 -1.00 0.00 0.00 0.00 175.76 175.83 1yqw h PRO 200 N 7.40 0.00 -3.00 0.00 0.13 -1.96 -3.39 132.00 131.19 1yqw h PRO 200 Ca -0.31 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.83 1yqw h PRO 200 Cb 1.14 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.18 1yqw h PRO 200 CO 0.79 0.00 0.22 -1.54 -0.23 0.00 0.00 178.00 177.24 1yqw s SER 201 N -5.61 -0.46 0.49 1.44 1.04 -1.26 -4.92 113.70 104.42 1yqw s SER 201 Ca 0.07 -0.21 0.28 0.00 0.48 0.00 0.00 55.95 56.57 1yqw s SER 201 Cb 0.08 0.64 1.00 0.00 0.10 0.00 0.00 66.02 67.84 1yqw s SER 201 CO 0.68 -1.10 1.85 -0.26 0.98 0.00 0.00 173.24 175.39 1yqw h PHE 202 N 2.00 0.00 -0.00 5.02 0.04 -1.98 -2.94 116.94 119.08 1yqw h PHE 202 Ca -0.29 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.48 1yqw h PHE 202 Cb 1.29 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.44 1yqw h PHE 202 CO 0.30 0.08 -0.25 -0.40 -0.60 0.00 0.00 178.31 177.44 1yqw n ASP 203 N -3.18 0.59 -4.79 2.17 5.75 -1.26 -4.74 116.55 111.08 1yqw n ASP 203 Ca 0.01 -0.45 -0.33 0.00 -0.01 0.00 0.00 54.79 54.02 1yqw n ASP 203 Cb 0.40 0.03 0.03 0.00 -1.03 0.00 0.00 41.12 40.55 1yqw n ASP 203 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1yqw s SER 204 N -2.70 5.51 0.28 -1.12 1.04 -1.11 -4.90 113.70 110.70 1yqw s SER 204 Ca 0.21 1.89 0.01 0.00 0.48 0.00 0.00 55.95 58.53 1yqw s SER 204 Cb 0.19 -2.54 0.52 0.00 0.10 0.00 0.00 66.02 64.29 1yqw s SER 204 CO 0.56 -1.36 1.84 -0.33 0.98 0.00 0.00 173.24 174.94 1yqw h GLU 205 N 0.27 0.99 -0.62 4.02 4.39 -1.93 -2.00 114.58 119.70 1yqw h GLU 205 Ca -0.47 -0.06 0.07 0.00 0.34 0.00 0.00 59.36 59.24 1yqw h GLU 205 Cb 1.23 -0.22 -0.06 0.00 -0.10 0.00 0.00 28.75 29.60 1yqw h GLU 205 CO 0.56 0.66 0.31 0.93 -1.16 0.00 0.00 179.01 180.31 1yqw h GLU 206 N 1.02 0.55 -0.30 2.33 3.07 -1.91 0.11 114.58 119.46 1yqw h GLU 206 Ca 0.49 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 59.30 1yqw h GLU 206 Cb 0.43 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.20 1yqw h GLU 206 CO -0.25 0.37 0.15 0.00 -1.40 0.00 0.00 179.01 177.88 1yqw h ALA 207 N 1.35 0.38 -0.88 3.43 0.00 -1.61 -0.49 119.26 121.45 1yqw h ALA 207 Ca 0.29 -0.09 0.08 0.00 0.00 0.00 0.00 54.91 55.19 1yqw h ALA 207 Cb 0.24 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.85 1yqw h ALA 207 CO -0.21 -0.06 0.57 0.87 0.00 0.00 0.00 179.25 180.41 1yqw h LYS 208 N 0.35 0.90 -0.00 0.00 1.57 -0.66 0.14 116.57 118.86 1yqw h LYS 208 Ca 0.10 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1yqw h LYS 208 Cb 0.10 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.21 1yqw h LYS 208 CO -0.01 0.59 -0.00 1.63 -0.57 0.00 0.00 179.45 181.09 1yqw n LYS 209 N -4.51 1.00 -2.25 3.15 5.02 0.32 -4.91 118.16 115.99 1yqw n LYS 209 Ca 0.14 -0.03 -0.04 0.00 -2.02 0.00 0.00 58.31 56.35 1yqw n LYS 209 Cb 0.26 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 1yqw n LYS 209 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1yqw n GLY 210 N 1.02 0.31 3.61 0.72 0.00 0.04 -5.04 105.19 105.85 1yqw n GLY 210 Ca 0.23 -0.65 -0.29 0.00 0.00 0.00 0.00 46.02 45.31 1yqw n GLY 210 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1yqw s PHE 211 N -2.43 1.81 0.59 1.61 2.99 -0.25 -4.92 117.98 117.38 1yqw s PHE 211 Ca 0.03 1.21 -0.20 0.00 0.00 0.00 0.00 56.93 57.98 1yqw s PHE 211 Cb -0.01 -3.18 -0.03 0.00 0.00 0.00 0.00 43.02 39.79 1yqw s PHE 211 CO 0.04 -3.16 1.27 0.00 -0.00 0.00 0.00 175.22 173.37 1yqw n LEU 213 N -1.48 4.23 -0.25 0.00 4.77 -1.26 -1.53 117.00 121.48 1yqw n LEU 213 Ca 0.13 -2.30 -0.01 0.00 -0.03 0.00 0.00 56.01 53.79 1yqw n LEU 213 Cb 0.48 -0.50 0.10 0.00 -2.33 0.00 0.00 43.42 41.17 1yqw n LEU 213 CO 0.47 0.84 1.11 0.22 -1.33 0.00 0.00 177.39 178.71 1yqw h TYR 214 N 3.68 0.75 0.00 -1.77 5.03 -1.90 -0.69 116.97 122.06 1yqw h TYR 214 Ca 0.00 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.33 1yqw h TYR 214 Cb 1.23 -0.24 -0.00 0.00 1.55 0.00 0.00 36.73 39.27 1yqw h TYR 214 CO 0.60 0.38 -0.03 0.93 -1.32 0.00 0.00 178.16 178.71 1yqw h GLU 215 N 0.76 0.00 -0.57 1.82 5.08 -1.82 -1.95 114.58 117.90 1yqw h GLU 215 Ca 0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 1yqw h GLU 215 Cb 0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1yqw h GLU 215 CO -0.17 0.03 0.00 1.28 -1.00 0.00 0.00 179.01 179.15 1yqw n LEU 216 N -3.18 3.20 0.00 1.33 4.77 -0.29 -4.80 117.00 118.02 1yqw n LEU 216 Ca -0.01 -1.61 0.00 0.00 -0.03 0.00 0.00 56.01 54.37 1yqw n LEU 216 Cb 0.24 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 1yqw n LEU 216 CO 0.26 0.68 0.00 0.61 -1.33 0.00 0.00 177.39 177.60 1yqw n GLY 217 N 1.16 0.96 3.66 -0.72 0.00 -0.73 -4.23 105.19 105.29 1yqw n GLY 217 Ca 0.18 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.71 1yqw n GLY 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yqw n LYS 219 N 4.07 3.00 -0.27 0.00 4.76 -0.55 -4.54 118.16 124.62 1yqw n LYS 219 Ca 0.19 -2.68 0.07 0.00 -2.87 0.00 0.00 58.31 53.02 1yqw n LYS 219 Cb 0.25 -1.63 0.18 0.00 -1.84 0.00 0.00 35.03 31.99 1yqw n LYS 219 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 1yqw h GLY 220 N 4.03 0.90 2.00 0.72 0.00 -1.89 -0.77 103.07 108.06 1yqw h GLY 220 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.45 1yqw h GLY 220 CO 0.06 -0.32 0.00 -1.05 0.00 0.00 0.00 176.54 175.23 1yqw n PRO 221 N -5.38 0.05 -0.15 4.80 -0.02 -1.26 -2.28 135.00 130.77 1yqw n PRO 221 Ca 0.15 0.49 0.03 0.00 -2.02 0.00 0.00 63.50 62.15 1yqw n PRO 221 Cb 0.52 -1.66 0.05 0.00 -0.02 0.00 0.00 33.50 32.39 1yqw n PRO 221 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1yqw n VAL 222 N -1.77 0.86 -5.18 -1.45 0.24 -0.34 -4.92 118.33 105.78 1yqw n VAL 222 Ca 0.00 -0.99 -0.32 0.00 -2.04 0.00 0.00 64.34 61.00 1yqw n VAL 222 Cb 0.06 0.35 -0.17 0.00 -1.47 0.00 0.00 33.84 32.61 1yqw n VAL 222 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1yqw s THR 223 N -1.18 2.14 -0.34 3.34 2.01 -0.96 -5.00 115.64 115.64 1yqw s THR 223 Ca 0.10 -0.99 -0.15 0.00 0.31 0.00 0.00 61.69 60.96 1yqw s THR 223 Cb 0.09 -1.82 -0.01 0.00 0.01 0.00 0.00 72.50 70.77 1yqw s THR 223 CO 0.01 0.56 0.37 -0.31 -0.69 0.00 0.00 174.62 174.55 1yqw s TYR 224 N 0.35 3.21 0.01 4.92 2.02 -1.26 -0.25 117.35 126.35 1yqw s TYR 224 Ca -0.18 -0.01 -0.29 0.00 -0.37 0.00 0.00 57.07 56.21 1yqw s TYR 224 Cb -0.18 -2.67 0.11 0.00 -0.40 0.00 0.00 41.96 38.81 1yqw s TYR 224 CO 0.09 -0.43 1.17 1.21 -1.57 0.00 0.00 175.55 176.02 1yqw s ASN 225 N 1.73 -0.11 -0.07 2.29 3.84 -0.99 -4.81 114.94 116.82 1yqw s ASN 225 Ca 0.12 -0.19 0.12 0.00 0.21 0.00 0.00 52.86 53.12 1yqw s ASN 225 Cb -0.16 0.26 0.33 0.00 -0.55 0.00 0.00 41.25 41.13 1yqw s ASN 225 CO 0.12 -0.47 1.27 -0.46 -2.79 0.00 0.00 177.10 174.76 1yqw n ASN 226 N -0.43 3.06 -0.31 -4.21 6.94 -1.21 -3.73 115.26 115.37 1yqw n ASN 226 Ca -0.07 -2.40 -0.06 0.00 -0.02 0.00 0.00 54.58 52.03 1yqw n ASN 226 Cb 0.62 -0.31 -0.01 0.00 -2.36 0.00 0.00 39.78 37.71 1yqw n ASN 226 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1yqw h PRO 228 N -0.09 0.00 0.11 0.00 0.13 -1.88 0.15 132.00 130.41 1yqw h PRO 228 Ca 0.25 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 65.18 1yqw h PRO 228 Cb 0.55 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.70 1yqw h PRO 228 CO -0.85 0.10 -0.82 -0.22 -0.23 0.00 0.00 178.00 175.99 1yqw h LYS 229 N 0.00 0.37 0.00 0.86 3.64 -0.90 -3.38 116.57 117.15 1yqw h LYS 229 Ca -0.00 -0.54 0.00 0.00 -1.27 0.00 0.00 60.65 58.84 1yqw h LYS 229 Cb 0.49 0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 1yqw h LYS 229 CO 0.01 1.22 -1.60 1.33 -2.27 0.00 0.00 179.45 178.15 1yqw n VAL 230 N -4.11 0.00 -1.33 2.00 0.24 -0.54 -5.12 118.33 109.47 1yqw n VAL 230 Ca -0.13 -0.31 0.18 0.00 -2.04 0.00 0.00 64.34 62.03 1yqw n VAL 230 Cb 0.81 0.22 -0.05 0.00 -1.47 0.00 0.00 33.84 33.34 1yqw n VAL 230 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1yqw n LEU 231 N -1.96 -0.72 -4.48 1.34 4.77 0.51 -4.74 117.00 111.73 1yqw n LEU 231 Ca -0.02 1.61 -0.32 0.00 -0.03 0.00 0.00 56.01 57.24 1yqw n LEU 231 Cb 0.36 -4.13 -0.13 0.00 -2.33 0.00 0.00 43.42 37.19 1yqw n LEU 231 CO 0.29 -3.25 -0.46 -0.36 -1.33 0.00 0.00 177.39 172.28 1yqw s PHE 232 N -2.56 2.66 -1.17 -1.77 0.40 0.66 -4.65 117.98 111.55 1yqw s PHE 232 Ca 0.00 -0.19 0.00 0.00 -0.60 0.00 0.00 56.93 56.14 1yqw s PHE 232 Cb 0.00 -1.57 0.00 0.00 0.51 0.00 0.00 43.02 41.96 1yqw s PHE 232 CO 0.00 0.22 0.00 0.09 0.70 0.00 0.00 175.22 176.23 1yqw n ASN 233 N 1.99 -3.65 -0.50 1.36 4.13 -1.26 -1.35 115.26 115.98 1yqw n ASN 233 Ca -0.17 0.24 -0.06 0.00 1.68 0.00 0.00 54.58 56.27 1yqw n ASN 233 Cb 0.52 -3.23 -0.03 0.00 -1.54 0.00 0.00 39.78 35.50 1yqw n ASN 233 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1yqw n GLN 234 N -2.39 -1.33 0.00 3.52 3.00 -1.26 -4.77 117.38 114.14 1yqw n GLN 234 Ca -0.14 0.65 0.00 0.00 -0.01 0.00 0.00 57.00 57.51 1yqw n GLN 234 Cb 0.53 -4.79 0.00 0.00 0.00 0.00 0.00 30.24 25.97 1yqw n GLN 234 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.06 178.39 1yqw n VAL 235 N -2.37 0.00 -3.70 5.09 0.24 -0.46 -5.09 118.33 112.05 1yqw n VAL 235 Ca -0.06 0.00 -0.07 0.00 -2.04 0.00 0.00 64.34 62.17 1yqw n VAL 235 Cb 0.43 -0.01 -0.02 0.00 -1.47 0.00 0.00 33.84 32.78 1yqw n VAL 235 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1yqw s ASN 236 N -0.53 -0.30 0.19 -1.34 3.84 -1.04 -4.98 114.94 110.79 1yqw s ASN 236 Ca 0.00 -0.35 -0.10 0.00 0.21 0.00 0.00 52.86 52.62 1yqw s ASN 236 Cb 0.00 0.57 -0.01 0.00 -0.55 0.00 0.00 41.25 41.27 1yqw s ASN 236 CO 0.00 -1.02 0.34 -1.66 -2.79 0.00 0.00 177.10 171.97 1yqw s TRP 237 N -3.55 0.39 0.20 0.43 1.48 -1.26 -0.24 118.94 116.38 1yqw s TRP 237 Ca 0.09 -0.74 -0.14 0.00 -1.06 0.00 0.00 56.10 54.24 1yqw s TRP 237 Cb -0.03 0.01 0.20 0.00 -1.16 0.00 0.00 33.47 32.49 1yqw s TRP 237 CO -0.00 -0.80 1.64 -1.35 -4.06 0.00 0.00 176.95 172.39 1yqw h PRO 238 N 2.45 0.01 -0.26 3.25 0.11 -1.96 -1.94 132.00 133.67 1yqw h PRO 238 Ca -0.30 -0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.71 1yqw h PRO 238 Cb 1.24 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1yqw h PRO 238 CO 0.45 0.01 -0.22 0.28 -0.21 0.00 0.00 178.00 178.30 1yqw h VAL 239 N 0.01 1.26 -0.19 3.15 2.07 -1.84 -0.93 116.25 119.78 1yqw h VAL 239 Ca 0.27 -1.21 -0.02 0.00 0.82 0.00 0.00 66.70 66.56 1yqw h VAL 239 Cb 0.41 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 1yqw h VAL 239 CO -0.56 0.39 0.03 -0.61 0.02 0.00 0.00 177.57 176.84 1yqw h GLN 240 N 0.44 0.27 -0.52 1.57 4.15 -1.71 0.48 115.11 119.79 1yqw h GLN 240 Ca 0.07 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.46 1yqw h GLN 240 Cb 0.63 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.27 1yqw h GLN 240 CO 0.04 0.27 0.00 0.00 -1.93 0.00 0.00 178.83 177.21 1yqw n ALA 241 N -2.50 2.70 -0.91 3.38 0.00 -0.63 -4.91 120.51 117.65 1yqw n ALA 241 Ca -0.00 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.83 1yqw n ALA 241 Cb 0.15 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.60 1yqw n ALA 241 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yqw n GLY 242 N 0.67 0.53 3.35 0.00 0.00 0.16 -5.03 105.19 104.86 1yqw n GLY 242 Ca 0.10 -0.20 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 1yqw n GLY 242 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1yqw s HIS 243 N -2.00 2.51 0.64 1.61 5.04 -0.45 -4.98 115.29 117.66 1yqw s HIS 243 Ca 0.00 -0.48 -0.18 0.00 -1.54 0.00 0.00 55.06 52.87 1yqw s HIS 243 Cb 0.00 -1.60 -0.03 0.00 0.04 0.00 0.00 32.58 31.00 1yqw s HIS 243 CO 0.00 -0.05 1.10 -0.35 -2.34 0.00 0.00 174.74 173.10 1yqw n PRO 244 N 2.67 0.93 -2.16 2.88 -0.04 -1.26 -2.67 135.00 135.35 1yqw n PRO 244 Ca -0.17 0.37 -0.41 0.00 -0.04 0.00 0.00 63.50 63.25 1yqw n PRO 244 Cb 0.52 -2.33 -0.02 0.00 -0.04 0.00 0.00 33.50 31.63 1yqw n PRO 244 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1yqw n LEU 246 N 1.06 0.60 -0.58 0.00 4.77 -1.26 -1.49 117.00 120.10 1yqw n LEU 246 Ca 0.01 0.17 -0.03 0.00 -0.03 0.00 0.00 56.01 56.13 1yqw n LEU 246 Cb 0.42 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1yqw n LEU 246 CO 0.58 0.00 -0.01 0.61 -1.33 0.00 0.00 177.39 177.25 1yqw n GLY 247 N 1.40 0.43 0.00 -0.72 0.00 -1.26 -4.81 105.19 100.22 1yqw n GLY 247 Ca 0.04 -0.68 0.09 0.00 0.00 0.00 0.00 46.02 45.47 1yqw n GLY 247 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yqw n SER 249 N -1.38 3.47 -4.85 0.00 3.41 -1.26 -3.22 113.62 109.80 1yqw n SER 249 Ca 0.07 -1.99 -0.37 0.00 -0.26 0.00 0.00 58.87 56.32 1yqw n SER 249 Cb 0.17 -0.28 -0.06 0.00 -0.26 0.00 0.00 64.21 63.79 1yqw n SER 249 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1yqw s GLU 250 N -1.44 3.81 0.25 4.33 0.41 -0.52 -4.55 118.70 120.99 1yqw s GLU 250 Ca 0.40 0.28 -0.31 0.00 -0.41 0.00 0.00 54.97 54.93 1yqw s GLU 250 Cb 0.23 -3.18 -0.13 0.00 -1.78 0.00 0.00 34.13 29.27 1yqw s GLU 250 CO 0.32 0.69 1.51 -2.30 -0.49 0.00 0.00 175.26 174.99 1yqw n PRO 251 N 1.71 2.34 -2.25 0.39 -0.02 -1.26 -2.39 135.00 133.52 1yqw n PRO 251 Ca -0.14 0.83 -0.20 0.00 -2.02 0.00 0.00 63.50 61.97 1yqw n PRO 251 Cb 0.53 -2.56 -0.02 0.00 -0.02 0.00 0.00 33.50 31.42 1yqw n PRO 251 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1yqw n ASP 252 N 2.39 -5.75 0.23 2.55 8.00 -1.26 -4.84 116.55 117.87 1yqw n ASP 252 Ca 0.11 0.09 0.07 0.00 0.71 0.00 0.00 54.79 55.78 1yqw n ASP 252 Cb 0.33 -4.84 0.60 0.00 -0.02 0.00 0.00 41.12 37.19 1yqw n ASP 252 CO 0.00 0.00 0.00 2.19 -0.39 0.00 0.00 177.20 179.00 1yqw h PHE 253 N 0.00 0.05 -0.96 1.24 -5.15 -1.76 -0.18 116.94 110.18 1yqw h PHE 253 Ca -0.47 0.00 0.27 0.00 -0.20 0.00 0.00 57.97 57.57 1yqw h PHE 253 Cb 1.36 -0.02 -0.04 0.00 0.22 0.00 0.00 35.95 37.46 1yqw h PHE 253 CO 0.57 0.06 0.68 -1.49 -2.00 0.00 0.00 178.31 176.13 1yqw h TRP 254 N 0.05 0.09 0.00 6.09 4.06 -1.89 0.23 115.95 124.58 1yqw h TRP 254 Ca 0.01 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 60.86 1yqw h TRP 254 Cb 0.04 -0.03 -0.02 0.00 -1.00 0.00 0.00 29.16 28.15 1yqw h TRP 254 CO 0.00 0.02 -1.70 -0.25 -3.56 0.00 0.00 178.44 172.94 1yqw n ASP 255 N -4.30 2.05 0.07 -3.49 10.43 -0.20 -4.32 116.55 116.79 1yqw n ASP 255 Ca 0.20 0.00 0.03 0.00 2.57 0.00 0.00 54.79 57.59 1yqw n ASP 255 Cb 0.99 1.20 -0.04 0.00 1.84 0.00 0.00 41.12 45.10 1yqw n ASP 255 CO 0.00 0.00 0.00 0.71 -1.07 0.00 0.00 177.20 176.84 1yqw h THR 256 N 0.00 0.46 -0.01 -3.53 1.35 -0.88 -3.38 112.91 106.92 1yqw h THR 256 Ca -0.16 -1.83 0.00 0.00 -0.55 0.00 0.00 66.41 63.87 1yqw h THR 256 Cb 1.16 2.01 0.00 0.00 -1.73 0.00 0.00 68.15 69.59 1yqw h THR 256 CO 0.01 0.26 -0.22 0.23 -0.25 0.00 0.00 175.52 175.55 1yqw n MET 257 N -2.92 1.57 -3.61 4.72 2.81 0.78 -4.95 117.12 115.52 1yqw n MET 257 Ca -0.05 -1.02 -0.30 0.00 -1.81 0.00 0.00 57.70 54.51 1yqw n MET 257 Cb 0.76 -1.28 -0.04 0.00 -0.71 0.00 0.00 33.22 31.95 1yqw n MET 257 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1yqw s THR 258 N -1.70 5.14 0.37 2.03 -4.23 -1.25 -3.71 115.64 112.29 1yqw s THR 258 Ca 0.15 -0.00 -0.28 0.00 -1.18 0.00 0.00 61.69 60.38 1yqw s THR 258 Cb 0.13 -3.66 -0.11 0.00 1.34 0.00 0.00 72.50 70.20 1yqw s THR 258 CO 0.33 -0.06 1.48 -2.84 -0.54 0.00 0.00 174.62 173.00 1yqw s PRO 259 N -2.91 4.12 0.43 3.99 0.02 -1.26 -4.97 135.00 134.41 1yqw s PRO 259 Ca 0.41 2.56 0.20 0.00 0.02 0.00 0.00 61.00 64.19 1yqw s PRO 259 Cb -0.12 -2.97 0.98 0.00 0.02 0.00 0.00 34.50 32.41 1yqw s PRO 259 CO 0.26 -0.52 1.90 0.74 -0.33 0.00 0.00 177.00 179.04 1yqw h PHE 260 N 3.07 0.00 -0.61 6.54 0.04 -1.93 -2.87 116.94 121.18 1yqw h PHE 260 Ca -0.51 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.26 1yqw h PHE 260 Cb 1.24 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.39 1yqw h PHE 260 CO 0.53 0.27 0.00 0.66 -0.60 0.00 0.00 178.31 179.17 1yqw n TYR 261 N -3.79 1.67 -4.29 -0.55 4.01 -1.26 -4.36 117.16 108.58 1yqw n TYR 261 Ca -0.01 -0.63 -0.16 0.00 -0.16 0.00 0.00 57.90 56.94 1yqw n TYR 261 Cb 0.37 -0.34 -0.10 0.00 -0.31 0.00 0.00 39.34 38.96 1yqw n TYR 261 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1yqw s GLU 262 N -2.15 1.18 0.28 -0.72 0.41 -1.09 -3.82 118.70 112.79 1yqw s GLU 262 Ca 0.51 -1.52 0.00 0.00 -0.41 0.00 0.00 54.97 53.56 1yqw s GLU 262 Cb 0.35 -0.82 -0.04 0.00 -1.78 0.00 0.00 34.13 31.84 1yqw s GLU 262 CO 0.21 0.11 0.47 -0.65 -0.49 0.00 0.00 175.26 174.91 1yqw s GLN 263 N -3.71 3.50 0.00 1.61 -1.52 -1.26 -4.53 119.66 113.75 1yqw s GLN 263 Ca 0.19 -0.38 0.22 0.00 -1.95 0.00 0.00 55.36 53.45 1yqw s GLN 263 Cb 0.01 -2.75 1.33 0.00 -0.22 0.00 0.00 33.01 31.38 1yqw s GLN 263 CO 0.03 0.28 1.70 0.41 -0.25 0.00 0.00 175.29 177.46