#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 4.23 0.23 0.00 2.20 -1.26 -4.98 119.74 120.17 1yqw s LYS 4 Ca 0.00 2.31 -0.30 0.00 -0.36 0.00 0.00 55.97 57.62 1yqw s LYS 4 Cb 0.00 -3.17 -0.09 0.00 -1.51 0.00 0.00 37.83 33.06 1yqw s LYS 4 CO 0.00 -0.57 1.35 -1.58 -0.36 0.00 0.00 175.35 174.19 1yqw s HIS 5 N 1.07 3.16 -0.16 4.03 5.65 -1.26 -5.03 115.29 122.74 1yqw s HIS 5 Ca 0.68 1.19 -0.07 0.00 0.25 0.00 0.00 55.06 57.11 1yqw s HIS 5 Cb -0.43 -3.68 -0.04 0.00 -1.18 0.00 0.00 32.58 27.26 1yqw s HIS 5 CO 0.32 -2.12 0.08 1.03 -0.65 0.00 0.00 174.74 173.40 1yqw s ARG 6 N -0.43 3.82 0.14 2.88 0.52 -1.26 -5.06 118.95 119.57 1yqw s ARG 6 Ca 0.56 -0.30 -0.35 0.00 -0.52 0.00 0.00 55.73 55.13 1yqw s ARG 6 Cb -0.39 -3.20 -0.15 0.00 0.52 0.00 0.00 34.95 31.74 1yqw s ARG 6 CO 0.42 0.41 1.44 -2.30 0.02 0.00 0.00 175.30 175.28 1yqw n PRO 7 N 3.13 1.68 -2.49 3.54 -0.02 -1.26 -4.05 135.00 135.53 1yqw n PRO 7 Ca -0.17 0.61 -0.42 0.00 -2.02 0.00 0.00 63.50 61.50 1yqw n PRO 7 Cb 0.53 -2.29 -0.03 0.00 -0.02 0.00 0.00 33.50 31.68 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 7.17 -0.11 2.55 0.15 -1.26 -0.71 113.70 122.09 1yqw s SER 8 Ca 0.79 1.97 0.03 0.00 0.70 0.00 0.00 55.95 59.45 1yqw s SER 8 Cb -0.79 -2.58 0.01 0.00 -1.71 0.00 0.00 66.02 60.94 1yqw s SER 8 CO 0.44 -0.38 -0.21 -0.69 1.20 0.00 0.00 173.24 173.60 1yqw s VAL 9 N 0.75 1.89 -0.17 4.45 1.01 0.03 -0.32 120.40 128.03 1yqw s VAL 9 Ca 0.55 -0.89 -0.04 0.00 0.00 0.00 0.00 61.98 61.59 1yqw s VAL 9 Cb -0.28 -1.66 -0.03 0.00 0.00 0.00 0.00 36.38 34.41 1yqw s VAL 9 CO 0.30 0.52 -0.02 -0.69 0.00 0.00 0.00 175.10 175.22 1yqw s VAL 10 N 0.66 4.00 -0.21 2.92 1.01 0.12 -0.89 120.40 128.01 1yqw s VAL 10 Ca -0.12 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 61.56 1yqw s VAL 10 Cb -0.16 -2.77 0.03 0.00 0.00 0.00 0.00 36.38 33.47 1yqw s VAL 10 CO 0.03 0.47 -0.16 0.86 0.00 0.00 0.00 175.10 176.30 1yqw s TRP 11 N 0.55 2.95 -0.04 5.22 -0.11 -0.68 -0.34 118.94 126.49 1yqw s TRP 11 Ca -0.02 -1.80 -0.01 0.00 1.22 0.00 0.00 56.10 55.49 1yqw s TRP 11 Cb -0.14 -1.94 -0.04 0.00 -1.50 0.00 0.00 33.47 29.85 1yqw s TRP 11 CO 0.02 -0.81 0.06 -0.51 -4.62 0.00 0.00 176.95 171.09 1yqw s LEU 12 N 1.25 3.82 -0.26 5.86 1.43 0.20 -4.26 118.68 126.72 1yqw s LEU 12 Ca 0.01 0.16 -0.03 0.00 -1.03 0.00 0.00 54.13 53.24 1yqw s LEU 12 Cb -0.15 -2.09 0.02 0.00 0.03 0.00 0.00 46.19 44.00 1yqw s LEU 12 CO -0.10 0.32 -0.02 -1.00 0.23 0.00 0.00 176.35 175.79 1yqw s HIS 13 N -1.07 3.10 0.00 0.29 3.76 -1.26 -0.76 115.29 119.35 1yqw s HIS 13 Ca 0.19 -1.41 0.00 0.00 -0.15 0.00 0.00 55.06 53.68 1yqw s HIS 13 Cb -0.12 -2.11 0.00 0.00 1.11 0.00 0.00 32.58 31.46 1yqw s HIS 13 CO 0.09 -0.69 0.00 0.09 -0.85 0.00 0.00 174.74 173.38 1yqw n ASN 14 N 4.72 0.00 -4.47 1.40 5.03 -0.14 -4.96 115.26 116.84 1yqw n ASN 14 Ca -0.16 0.00 -0.43 0.00 0.87 0.00 0.00 54.58 54.86 1yqw n ASN 14 Cb 0.47 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 39.20 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 -2.71 3.14 0.20 5.41 0.00 -0.18 -4.90 121.76 122.72 1yqw s ALA 15 Ca 0.00 -2.28 -0.06 0.00 0.00 0.00 0.00 51.96 49.62 1yqw s ALA 15 Cb 0.00 -4.06 -0.02 0.00 0.00 0.00 0.00 23.12 19.03 1yqw s ALA 15 CO 0.00 -3.02 0.24 -1.83 0.00 0.00 0.00 175.76 171.16 1yqw s GLU 16 N 3.69 1.25 0.00 0.00 4.04 -1.26 -1.43 118.70 124.99 1yqw s GLU 16 Ca 0.31 -1.42 0.11 0.00 0.04 0.00 0.00 54.97 54.01 1yqw s GLU 16 Cb -0.09 0.34 0.02 0.00 0.02 0.00 0.00 34.13 34.42 1yqw s GLU 16 CO -0.01 -0.45 0.71 0.00 -1.84 0.00 0.00 175.26 173.67 1yqw n THR 18 N -0.03 0.00 0.25 0.00 -1.04 -1.26 -4.89 114.28 107.31 1yqw n THR 18 Ca 0.05 0.00 0.11 0.00 -2.04 0.00 0.00 64.05 62.17 1yqw n THR 18 Cb 0.24 -0.11 0.66 0.00 -1.82 0.00 0.00 70.33 69.30 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 0.00 1.07 3.41 0.00 -1.98 -0.80 103.07 104.76 1yqw h GLY 19 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.09 1yqw h GLY 19 CO 0.00 0.00 -0.94 0.00 0.00 0.00 0.00 176.54 175.60 1yqw h THR 21 N 0.20 0.90 -0.41 0.00 2.02 -1.91 -0.43 112.91 113.28 1yqw h THR 21 Ca -0.12 -0.04 0.03 0.00 0.77 0.00 0.00 66.41 67.05 1yqw h THR 21 Cb 1.62 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 68.76 1yqw h THR 21 CO 0.18 0.02 0.19 -0.33 0.37 0.00 0.00 175.52 175.96 1yqw h GLU 22 N 0.12 0.38 -0.48 6.66 4.39 -1.11 -2.29 114.58 122.26 1yqw h GLU 22 Ca 0.10 -0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.81 1yqw h GLU 22 Cb 0.09 -0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 28.62 1yqw h GLU 22 CO -0.13 0.25 0.24 0.00 -1.16 0.00 0.00 179.01 178.22 1yqw h ALA 23 N 1.22 0.61 -0.88 3.43 0.00 -0.63 -2.65 119.26 120.37 1yqw h ALA 23 Ca 0.18 0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.19 1yqw h ALA 23 Cb 0.10 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.75 1yqw h ALA 23 CO -0.13 -0.11 0.53 0.00 0.00 0.00 0.00 179.25 179.54 1yqw h ALA 24 N 1.26 1.24 0.00 0.00 0.00 -0.53 -1.50 119.26 119.73 1yqw h ALA 24 Ca 0.21 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1yqw h ALA 24 Cb 0.11 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1yqw h ALA 24 CO -0.15 0.21 0.00 0.44 0.00 0.00 0.00 179.25 179.76 1yqw n ILE 25 N -4.66 0.00 1.45 0.00 -5.35 -0.98 -1.92 119.36 107.90 1yqw n ILE 25 Ca 0.14 0.00 0.10 0.00 -0.27 0.00 0.00 62.75 62.72 1yqw n ILE 25 Cb 0.24 -0.50 0.42 0.00 -1.74 0.00 0.00 39.64 38.06 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 -0.92 1.52 -1.81 6.28 5.12 -0.57 -4.70 116.66 121.58 1yqw n ARG 26 Ca 0.17 -0.78 -0.39 0.00 -1.93 0.00 0.00 57.85 54.92 1yqw n ARG 26 Cb 0.08 -1.36 0.03 0.00 -1.16 0.00 0.00 32.46 30.05 1yqw n ARG 26 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 1yqw s THR 27 N -1.85 2.13 0.00 0.55 -1.32 -0.81 -4.94 115.64 109.40 1yqw s THR 27 Ca 0.31 0.10 0.00 0.00 -1.21 0.00 0.00 61.69 60.89 1yqw s THR 27 Cb 0.16 -3.05 0.00 0.00 -1.51 0.00 0.00 72.50 68.10 1yqw s THR 27 CO 0.25 0.00 0.31 2.30 -2.21 0.00 0.00 174.62 175.27 1yqw n ILE 28 N -0.78 0.00 -3.32 5.08 -5.35 -1.26 -4.12 119.36 109.61 1yqw n ILE 28 Ca 0.09 -0.32 -0.25 0.00 -0.27 0.00 0.00 62.75 62.00 1yqw n ILE 28 Cb 0.44 1.35 -0.09 0.00 -1.74 0.00 0.00 39.64 39.61 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 -0.02 0.29 -2.52 6.28 4.81 -1.26 -3.64 118.16 122.11 1yqw n LYS 29 Ca 0.00 -3.11 -0.23 0.00 -0.87 0.00 0.00 58.31 54.10 1yqw n LYS 29 Cb 0.09 -1.58 0.08 0.00 0.02 0.00 0.00 35.03 33.63 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 -0.10 2.06 0.83 1.64 0.04 -1.26 -4.94 135.00 133.26 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 0.06 -2.35 0.09 0.00 0.04 0.00 0.00 34.50 32.35 1yqw s PRO 30 CO -0.18 -1.17 1.13 0.71 0.04 0.00 0.00 177.00 177.54 1yqw s TYR 31 N -3.04 2.05 0.39 0.56 1.51 -1.24 -4.72 117.35 112.86 1yqw s TYR 31 Ca 0.62 1.68 0.07 0.00 -1.01 0.00 0.00 57.07 58.43 1yqw s TYR 31 Cb -0.08 -3.25 0.78 0.00 -0.11 0.00 0.00 41.96 39.31 1yqw s TYR 31 CO 0.42 -2.38 1.97 0.97 -1.11 0.00 0.00 175.55 175.42 1yqw h ILE 32 N -1.32 1.15 0.03 2.71 6.09 -1.84 -1.65 117.51 122.68 1yqw h ILE 32 Ca -0.44 -0.53 -0.00 0.00 -1.37 0.00 0.00 64.86 62.52 1yqw h ILE 32 Cb 1.26 0.87 0.00 0.00 0.47 0.00 0.00 36.82 39.42 1yqw h ILE 32 CO 0.47 0.19 -0.02 -2.24 -3.07 0.00 0.00 178.15 173.48 1yqw h ASP 33 N 0.41 -0.04 -0.96 2.19 -0.00 -1.96 -1.78 116.42 114.28 1yqw h ASP 33 Ca 0.10 -0.21 0.10 0.00 -0.00 0.00 0.00 57.03 57.02 1yqw h ASP 33 Cb 0.19 0.01 -0.07 0.00 -0.00 0.00 0.00 39.33 39.45 1yqw h ASP 33 CO -0.00 0.19 0.61 0.00 -0.00 0.00 0.00 179.24 180.04 1yqw h ALA 34 N 0.69 1.56 -0.07 4.15 0.00 -1.85 0.29 119.26 124.03 1yqw h ALA 34 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1yqw h ALA 34 Cb 0.25 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1yqw h ALA 34 CO 0.01 0.24 0.03 1.25 0.00 0.00 0.00 179.25 180.78 1yqw h LEU 35 N 0.98 0.09 0.00 0.00 5.85 -0.92 -0.54 115.31 120.77 1yqw h LEU 35 Ca 0.45 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 59.06 1yqw h LEU 35 Cb 0.41 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.42 1yqw h LEU 35 CO -0.21 0.17 -0.22 2.30 -0.34 0.00 0.00 178.44 180.14 1yqw n ILE 36 N -4.98 0.48 -0.05 4.05 -5.35 -0.71 -0.84 119.36 111.97 1yqw n ILE 36 Ca -0.06 -0.27 -0.09 0.00 -0.27 0.00 0.00 62.75 62.06 1yqw n ILE 36 Cb 0.08 -0.41 -0.15 0.00 -1.74 0.00 0.00 39.64 37.43 1yqw n ILE 36 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1yqw n LEU 37 N -2.17 0.62 -0.01 7.28 4.77 0.06 -4.61 117.00 122.94 1yqw n LEU 37 Ca 0.05 0.28 -0.01 0.00 -0.03 0.00 0.00 56.01 56.30 1yqw n LEU 37 Cb 0.43 0.26 -0.03 0.00 -2.33 0.00 0.00 43.42 41.75 1yqw n LEU 37 CO 0.32 0.43 -0.59 0.47 -1.33 0.00 0.00 177.39 176.69 1yqw n ASP 38 N -2.96 4.14 -0.05 -1.43 10.43 -0.22 -4.91 116.55 121.56 1yqw n ASP 38 Ca -0.22 0.00 -0.11 0.00 2.57 0.00 0.00 54.79 57.02 1yqw n ASP 38 Cb 1.09 0.75 -0.04 0.00 1.84 0.00 0.00 41.12 44.76 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 -1.99 0.60 -4.56 -3.53 -1.04 -0.48 -4.99 114.28 98.28 1yqw n THR 39 Ca -0.04 -0.14 -0.27 0.00 -2.04 0.00 0.00 64.05 61.56 1yqw n THR 39 Cb 0.47 -1.65 -0.11 0.00 -1.82 0.00 0.00 70.33 67.22 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 2.11 -0.40 12.58 -4.36 -0.02 -4.18 121.20 124.74 1yqw s ILE 40 Ca -0.15 -2.04 -0.05 0.00 -0.26 0.00 0.00 60.65 58.15 1yqw s ILE 40 Cb 0.06 -2.89 0.09 0.00 1.25 0.00 0.00 42.46 40.97 1yqw s ILE 40 CO 0.19 -0.07 0.19 -0.55 0.24 0.00 0.00 174.94 174.94 1yqw s SER 41 N -3.69 5.32 -0.63 4.36 0.15 0.12 -4.42 113.70 114.91 1yqw s SER 41 Ca 0.35 -1.74 -0.26 0.00 0.70 0.00 0.00 55.95 54.99 1yqw s SER 41 Cb 0.07 -1.86 0.04 0.00 -1.71 0.00 0.00 66.02 62.56 1yqw s SER 41 CO 0.18 -0.50 1.11 -0.22 1.20 0.00 0.00 173.24 175.01 1yqw s LEU 42 N 1.25 3.70 0.00 3.45 2.96 -1.26 -0.79 118.68 127.99 1yqw s LEU 42 Ca 0.04 -0.36 0.20 0.00 -0.22 0.00 0.00 54.13 53.79 1yqw s LEU 42 Cb -0.22 -2.78 -0.20 0.00 0.50 0.00 0.00 46.19 43.49 1yqw s LEU 42 CO -0.02 -1.51 0.86 0.47 -1.32 0.00 0.00 176.35 174.83 1yqw n ASP 43 N 8.32 1.00 -3.65 3.68 10.43 -0.07 -4.83 116.55 131.44 1yqw n ASP 43 Ca 0.03 -1.00 -0.06 0.00 2.57 0.00 0.00 54.79 56.33 1yqw n ASP 43 Cb 0.48 0.97 -0.07 0.00 1.84 0.00 0.00 41.12 44.34 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 -2.84 -1.09 -0.29 1.24 5.04 -1.25 -4.67 117.35 113.49 1yqw s TYR 44 Ca 0.08 2.11 0.01 0.00 -2.44 0.00 0.00 57.07 56.83 1yqw s TYR 44 Cb 0.15 0.64 0.20 0.00 0.35 0.00 0.00 41.96 43.30 1yqw s TYR 44 CO 0.80 -0.54 0.72 -1.14 -1.34 0.00 0.00 175.55 174.04 1yqw s GLN 45 N 1.90 0.45 0.41 4.97 -0.44 -1.26 -1.69 119.66 123.99 1yqw s GLN 45 Ca -0.09 0.46 0.11 0.00 -2.50 0.00 0.00 55.36 53.34 1yqw s GLN 45 Cb -0.07 0.21 0.93 0.00 -1.64 0.00 0.00 33.01 32.45 1yqw s GLN 45 CO -0.19 -0.82 1.96 0.93 0.50 0.00 0.00 175.29 177.67 1yqw h GLU 46 N 7.81 0.51 -0.41 1.67 5.08 -1.95 -0.55 114.58 126.74 1yqw h GLU 46 Ca -0.04 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 1yqw h GLU 46 Cb 1.18 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.30 1yqw h GLU 46 CO 0.09 0.34 0.08 1.15 -1.00 0.00 0.00 179.01 179.67 1yqw h THR 47 N 0.53 1.19 0.00 1.13 2.02 -1.97 -3.34 112.91 112.47 1yqw h THR 47 Ca 0.31 -0.69 0.00 0.00 0.77 0.00 0.00 66.41 66.80 1yqw h THR 47 Cb 0.52 0.79 0.00 0.00 -1.74 0.00 0.00 68.15 67.72 1yqw h THR 47 CO -0.10 0.25 0.00 2.30 0.37 0.00 0.00 175.52 178.34 1yqw n ILE 48 N -4.31 0.00 -2.20 3.11 -5.35 -0.86 -5.07 119.36 104.67 1yqw n ILE 48 Ca 0.02 -0.31 -0.37 0.00 -0.27 0.00 0.00 62.75 61.83 1yqw n ILE 48 Cb 0.21 1.15 -0.01 0.00 -1.74 0.00 0.00 39.64 39.26 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 -0.37 3.74 0.01 6.28 0.23 -0.27 -4.97 119.30 123.95 1yqw s MET 49 Ca 0.00 1.85 -0.22 0.00 -1.03 0.00 0.00 55.69 56.29 1yqw s MET 49 Cb 0.00 -2.44 -0.18 0.00 -1.53 0.00 0.00 34.83 30.68 1yqw s MET 49 CO 0.00 -0.59 1.24 0.00 -2.03 0.00 0.00 175.02 173.64 1yqw h ALA 50 N 2.08 0.14 -2.85 3.16 0.00 -1.94 -3.45 119.26 116.40 1yqw h ALA 50 Ca -0.49 -0.38 -0.53 0.00 0.00 0.00 0.00 54.91 53.51 1yqw h ALA 50 Cb 1.25 -0.02 0.10 0.00 0.00 0.00 0.00 17.79 19.13 1yqw h ALA 50 CO 0.60 0.09 0.52 0.00 0.00 0.00 0.00 179.25 180.46 1yqw s ALA 51 N -3.90 2.78 0.31 0.00 0.00 -1.26 -5.05 121.76 114.63 1yqw s ALA 51 Ca -0.15 1.09 0.04 0.00 0.00 0.00 0.00 51.96 52.94 1yqw s ALA 51 Cb 0.04 -3.47 -0.06 0.00 0.00 0.00 0.00 23.12 19.63 1yqw s ALA 51 CO 0.75 -1.06 0.05 0.00 0.00 0.00 0.00 175.76 175.50 1yqw s ALA 52 N -1.48 2.25 0.00 0.00 0.00 -1.26 -4.52 121.76 116.75 1yqw s ALA 52 Ca 0.71 -2.01 0.00 0.00 0.00 0.00 0.00 51.96 50.66 1yqw s ALA 52 Cb -0.33 0.65 0.00 0.00 0.00 0.00 0.00 23.12 23.44 1yqw s ALA 52 CO 0.38 -0.30 0.00 0.41 0.00 0.00 0.00 175.76 176.25 1yqw n GLY 53 N -0.63 2.99 0.26 0.00 0.00 -1.26 -2.05 105.19 104.49 1yqw n GLY 53 Ca -0.02 -0.18 0.03 0.00 0.00 0.00 0.00 46.02 45.84 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 0.31 -0.43 1.61 5.08 -1.98 -0.47 114.58 118.69 1yqw h GLU 54 Ca 0.00 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.23 1yqw h GLU 54 Cb 0.00 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 1yqw h GLU 54 CO 0.00 0.35 -0.07 0.00 -1.00 0.00 0.00 179.01 178.28 1yqw h ALA 55 N 1.69 1.06 -0.18 3.43 0.00 -1.81 0.15 119.26 123.61 1yqw h ALA 55 Ca 0.07 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 1yqw h ALA 55 Cb 0.23 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1yqw h ALA 55 CO 0.01 0.58 -0.20 0.00 0.00 0.00 0.00 179.25 179.64 1yqw h ALA 56 N 1.23 0.27 -0.79 0.00 0.00 -0.77 -2.02 119.26 117.19 1yqw h ALA 56 Ca 0.12 -0.35 0.03 0.00 0.00 0.00 0.00 54.91 54.71 1yqw h ALA 56 Cb 0.53 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.21 1yqw h ALA 56 CO 0.03 0.20 0.50 1.49 0.00 0.00 0.00 179.25 181.47 1yqw h GLU 57 N 0.12 0.95 -0.80 0.00 4.81 -0.85 -1.16 114.58 117.64 1yqw h GLU 57 Ca 0.03 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 1yqw h GLU 57 Cb 0.74 -0.21 -0.04 0.00 0.63 0.00 0.00 28.75 29.87 1yqw h GLU 57 CO 0.05 0.63 0.36 0.00 -0.73 0.00 0.00 179.01 179.32 1yqw h ALA 58 N 1.33 1.12 -0.67 2.92 0.00 -0.67 -1.82 119.26 121.48 1yqw h ALA 58 Ca 0.31 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1yqw h ALA 58 Cb 0.01 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 1yqw h ALA 58 CO -0.11 0.65 0.23 0.00 0.00 0.00 0.00 179.25 180.02 1yqw h ALA 59 N 1.24 1.16 -0.22 0.00 0.00 -0.56 -0.33 119.26 120.55 1yqw h ALA 59 Ca 0.27 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1yqw h ALA 59 Cb 0.15 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1yqw h ALA 59 CO -0.03 0.59 0.12 1.25 0.00 0.00 0.00 179.25 181.18 1yqw h LEU 60 N 0.97 0.28 -1.02 0.00 5.85 -0.69 -2.04 115.31 118.65 1yqw h LEU 60 Ca 0.22 -0.09 -0.08 0.00 0.84 0.00 0.00 57.88 58.77 1yqw h LEU 60 Cb 0.24 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 1yqw h LEU 60 CO -0.01 0.29 -0.19 0.45 -0.34 0.00 0.00 178.44 178.63 1yqw h HIS 61 N 0.24 0.52 -0.44 1.25 3.86 -0.97 0.04 115.15 119.65 1yqw h HIS 61 Ca 0.08 -0.09 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1yqw h HIS 61 Cb 0.08 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.39 1yqw h HIS 61 CO -0.03 0.64 0.28 1.96 0.86 0.00 0.00 177.93 181.64 1yqw h GLN 62 N 0.43 0.59 -0.15 2.45 4.20 -0.92 -1.07 115.11 120.63 1yqw h GLN 62 Ca 0.07 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 1yqw h GLN 62 Cb 0.58 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.23 1yqw h GLN 62 CO 0.04 0.41 0.06 0.00 -0.67 0.00 0.00 178.83 178.67 1yqw h ALA 63 N 1.15 0.20 0.00 3.87 0.00 -0.84 -2.05 119.26 121.59 1yqw h ALA 63 Ca 0.16 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1yqw h ALA 63 Cb -0.04 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1yqw h ALA 63 CO -0.03 -0.21 -0.03 -0.07 0.00 0.00 0.00 179.25 178.91 1yqw h LEU 64 N 0.08 0.00 -2.21 0.00 3.38 -0.80 -1.31 115.31 114.46 1yqw h LEU 64 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1yqw h LEU 64 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1yqw h LEU 64 CO -0.00 0.03 0.00 -0.62 0.09 0.00 0.00 178.44 177.94 1yqw n GLU 65 N -3.96 2.44 -1.69 1.13 1.02 -0.42 -4.99 120.64 114.17 1yqw n GLU 65 Ca -0.03 -2.18 -0.44 0.00 -0.02 0.00 0.00 57.16 54.50 1yqw n GLU 65 Cb 0.12 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.01 1yqw n GLU 65 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1yqw n GLY 66 N 1.48 0.87 0.35 0.62 0.00 -0.50 -4.87 105.19 103.14 1yqw n GLY 66 Ca 0.19 0.47 0.10 0.00 0.00 0.00 0.00 46.02 46.78 1yqw n GLY 66 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1yqw h LYS 67 N 4.13 0.45 -0.01 1.61 1.63 -1.90 -2.15 116.57 120.33 1yqw h LYS 67 Ca -0.46 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.32 1yqw h LYS 67 Cb 1.27 -0.10 0.00 0.00 -0.60 0.00 0.00 32.23 32.79 1yqw h LYS 67 CO 0.75 0.30 -0.11 -0.25 -3.45 0.00 0.00 179.45 176.68 1yqw n ASP 68 N -4.47 1.09 -0.45 4.20 8.00 -1.26 -5.05 116.55 118.61 1yqw n ASP 68 Ca 0.09 -1.10 0.05 0.00 0.71 0.00 0.00 54.79 54.53 1yqw n ASP 68 Cb 0.32 0.04 -0.01 0.00 -0.02 0.00 0.00 41.12 41.45 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 1.24 -2.02 3.43 0.44 0.00 -0.81 -4.95 105.19 102.53 1yqw n GLY 69 Ca 0.16 -1.37 -0.13 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 -1.01 -0.55 0.06 1.61 -0.85 -1.26 -4.20 117.35 111.15 1yqw s TYR 70 Ca 0.00 0.42 0.01 0.00 -0.52 0.00 0.00 57.07 56.98 1yqw s TYR 70 Cb 0.00 0.54 -0.04 0.00 0.38 0.00 0.00 41.96 42.84 1yqw s TYR 70 CO 0.00 -0.82 0.13 0.71 -1.52 0.00 0.00 175.55 174.05 1yqw s TYR 71 N -3.46 3.34 -0.16 -3.49 1.51 0.56 -0.56 117.35 115.10 1yqw s TYR 71 Ca -0.00 0.17 -0.03 0.00 -1.01 0.00 0.00 57.07 56.20 1yqw s TYR 71 Cb -0.01 -1.70 -0.02 0.00 -0.11 0.00 0.00 41.96 40.13 1yqw s TYR 71 CO -0.10 0.56 -0.06 -1.17 -1.11 0.00 0.00 175.55 173.66 1yqw s LEU 72 N -2.33 3.04 -0.14 -1.29 2.96 -0.51 -0.71 118.68 119.70 1yqw s LEU 72 Ca 0.30 -0.23 -0.03 0.00 -0.22 0.00 0.00 54.13 53.96 1yqw s LEU 72 Cb -0.12 -1.73 -0.02 0.00 0.50 0.00 0.00 46.19 44.81 1yqw s LEU 72 CO 0.23 0.14 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.65 1yqw s VAL 73 N 0.54 3.69 -0.15 1.68 1.01 0.54 -0.68 120.40 127.03 1yqw s VAL 73 Ca -0.05 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.52 1yqw s VAL 73 Cb -0.15 -2.59 0.01 0.00 0.00 0.00 0.00 36.38 33.65 1yqw s VAL 73 CO 0.03 0.51 -0.21 -0.69 0.00 0.00 0.00 175.10 174.74 1yqw s VAL 74 N 0.26 2.03 -0.19 2.92 1.01 -0.35 -0.63 120.40 125.46 1yqw s VAL 74 Ca -0.05 -0.95 -0.04 0.00 0.00 0.00 0.00 61.98 60.94 1yqw s VAL 74 Cb -0.14 -1.81 -0.02 0.00 0.00 0.00 0.00 36.38 34.41 1yqw s VAL 74 CO 0.03 0.54 -0.04 -0.70 0.00 0.00 0.00 175.10 174.94 1yqw s GLU 75 N 0.94 3.54 0.00 2.72 2.12 0.06 -1.67 118.70 126.42 1yqw s GLU 75 Ca -0.04 -0.57 0.00 0.00 0.36 0.00 0.00 54.97 54.72 1yqw s GLU 75 Cb -0.15 -2.97 0.00 0.00 0.26 0.00 0.00 34.13 31.27 1yqw s GLU 75 CO -0.05 0.04 0.00 0.41 -0.54 0.00 0.00 175.26 175.12 1yqw n GLY 76 N 4.14 2.48 3.93 -1.50 0.00 -1.26 -0.97 105.19 112.00 1yqw n GLY 76 Ca -0.18 -1.75 -0.29 0.00 0.00 0.00 0.00 46.02 43.80 1yqw n GLY 76 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1yqw s GLY 77 N 0.00 1.74 -0.23 -0.02 0.00 -0.52 -3.41 107.32 104.89 1yqw s GLY 77 Ca 0.00 -1.11 -0.03 0.00 0.00 0.00 0.00 44.72 43.59 1yqw s GLY 77 CO 0.00 -0.40 -0.06 1.08 0.00 0.00 0.00 173.10 173.72 1yqw s LEU 78 N -5.80 2.92 -0.21 0.66 1.43 0.18 -1.01 118.68 116.85 1yqw s LEU 78 Ca 0.71 -0.54 -0.25 0.00 -1.03 0.00 0.00 54.13 53.01 1yqw s LEU 78 Cb -0.05 -1.70 -0.01 0.00 0.03 0.00 0.00 46.19 44.46 1yqw s LEU 78 CO 0.52 -0.05 0.86 -2.16 0.23 0.00 0.00 176.35 175.74 1yqw s PRO 79 N 1.42 4.24 0.00 1.29 0.04 -1.26 -0.68 135.00 140.05 1yqw s PRO 79 Ca 0.04 1.03 0.12 0.00 0.04 0.00 0.00 61.00 62.23 1yqw s PRO 79 Cb -0.15 -3.61 -0.11 0.00 0.04 0.00 0.00 34.50 30.67 1yqw s PRO 79 CO -0.04 -0.45 0.53 0.25 0.04 0.00 0.00 177.00 177.33 1yqw n THR 80 N 5.04 0.00 -1.45 1.26 -2.24 -0.75 -4.35 114.28 111.79 1yqw n THR 80 Ca 0.06 -0.24 -0.35 0.00 -2.27 0.00 0.00 64.05 61.25 1yqw n THR 80 Cb 0.48 1.02 0.10 0.00 -2.10 0.00 0.00 70.33 69.82 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 -2.05 2.05 -1.34 2.28 2.07 -0.83 -2.70 121.20 120.69 1yqw s ILE 81 Ca 0.05 0.03 -0.03 0.00 -1.41 0.00 0.00 60.65 59.29 1yqw s ILE 81 Cb 0.09 -2.73 0.02 0.00 0.13 0.00 0.00 42.46 39.96 1yqw s ILE 81 CO 0.46 -0.01 0.79 0.47 -1.91 0.00 0.00 174.94 174.74 1yqw n ASP 82 N -2.57 -2.05 -1.38 4.50 10.43 -1.26 -1.24 116.55 122.98 1yqw n ASP 82 Ca 0.15 -0.79 -0.17 0.00 2.57 0.00 0.00 54.79 56.55 1yqw n ASP 82 Cb 0.49 -4.15 -0.06 0.00 1.84 0.00 0.00 41.12 39.24 1yqw n ASP 82 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1yqw n GLY 83 N -1.58 1.39 2.05 0.44 0.00 -1.23 -2.18 105.19 104.08 1yqw n GLY 83 Ca -0.23 -0.21 -0.00 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.93 0.48 0.00 -0.02 0.00 -0.37 -4.86 105.19 99.49 1yqw n GLY 84 Ca -0.17 -0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.81 0.30 0.00 1.61 6.02 -0.93 -2.91 117.38 118.66 1yqw n GLN 85 Ca -0.00 0.08 0.14 0.00 -0.01 0.00 0.00 57.00 57.21 1yqw n GLN 85 Cb 0.02 -1.50 0.62 0.00 1.02 0.00 0.00 30.24 30.40 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 -1.30 0.00 -3.64 1.08 7.02 -1.26 -4.54 117.44 114.80 1yqw n TRP 86 Ca 0.10 0.00 -0.23 0.00 -1.02 0.00 0.00 57.50 56.35 1yqw n TRP 86 Cb 0.19 -0.15 -0.17 0.00 -2.42 0.00 0.00 31.31 28.75 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 -2.40 0.29 0.02 6.99 0.00 -1.15 -5.04 107.32 106.04 1yqw s GLY 87 Ca 0.31 -0.09 -0.00 0.00 0.00 0.00 0.00 44.72 44.94 1yqw s GLY 87 CO 0.46 1.57 -0.02 1.06 0.00 0.00 0.00 173.10 176.17 1yqw s MET 88 N 2.15 0.32 -0.03 2.90 -1.94 -1.26 -0.78 119.30 120.66 1yqw s MET 88 Ca 0.03 -0.59 0.00 0.00 -1.71 0.00 0.00 55.69 53.42 1yqw s MET 88 Cb -0.14 0.11 0.03 0.00 2.01 0.00 0.00 34.83 36.84 1yqw s MET 88 CO -0.06 -0.05 0.01 0.08 -0.01 0.00 0.00 175.02 174.98 1yqw s VAL 89 N -1.45 0.12 -1.78 -6.03 1.01 -0.48 -4.82 120.40 106.97 1yqw s VAL 89 Ca -0.16 0.12 0.00 0.00 0.00 0.00 0.00 61.98 61.94 1yqw s VAL 89 Cb -0.10 -0.23 0.00 0.00 0.00 0.00 0.00 36.38 36.05 1yqw s VAL 89 CO -0.01 0.13 0.00 0.00 0.00 0.00 0.00 175.10 175.22 1yqw n ALA 90 N 4.18 -0.48 -0.95 5.51 0.00 -1.26 -1.67 120.51 125.84 1yqw n ALA 90 Ca -0.26 0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1yqw n ALA 90 Cb 0.50 -2.03 0.00 0.00 0.00 0.00 0.00 19.45 17.92 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 -0.88 0.52 3.35 0.00 0.00 -1.26 -5.04 105.19 101.88 1yqw n GLY 91 Ca -0.22 -0.10 -0.32 0.00 0.00 0.00 0.00 46.02 45.39 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 2.53 0.27 1.61 0.09 -0.67 -5.11 115.29 112.01 1yqw s HIS 92 Ca 0.00 -0.47 -0.30 0.00 -0.00 0.00 0.00 55.06 54.29 1yqw s HIS 92 Cb 0.00 -1.61 -0.13 0.00 -0.00 0.00 0.00 32.58 30.84 1yqw s HIS 92 CO 0.00 -0.04 1.37 -2.30 -0.00 0.00 0.00 174.74 173.77 1yqw n PRO 93 N 2.67 2.06 -0.25 8.40 -0.02 -1.26 -1.38 135.00 145.21 1yqw n PRO 93 Ca -0.17 0.73 0.07 0.00 -2.02 0.00 0.00 63.50 62.11 1yqw n PRO 93 Cb 0.52 -2.36 0.32 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 3.77 0.81 -0.72 -0.52 2.86 -1.13 -1.14 114.93 118.87 1yqw h MET 94 Ca -0.45 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.12 1yqw h MET 94 Cb 1.28 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 32.72 1yqw h MET 94 CO 0.72 0.54 0.36 0.97 1.06 0.00 0.00 176.91 180.57 1yqw h ILE 95 N 0.84 1.22 -0.06 -1.22 2.10 -1.85 -1.00 117.51 117.54 1yqw h ILE 95 Ca 0.38 -0.59 -0.00 0.00 1.08 0.00 0.00 64.86 65.72 1yqw h ILE 95 Cb 0.37 0.28 -0.00 0.00 -1.09 0.00 0.00 36.82 36.38 1yqw h ILE 95 CO -0.15 0.26 0.02 -0.08 -1.08 0.00 0.00 178.15 177.11 1yqw h GLU 96 N 1.01 0.09 -0.63 2.19 4.81 -1.59 -1.21 114.58 119.25 1yqw h GLU 96 Ca 0.25 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.38 1yqw h GLU 96 Cb 0.07 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 1yqw h GLU 96 CO -0.04 0.26 0.08 1.15 -0.73 0.00 0.00 179.01 179.73 1yqw h THR 97 N -0.09 1.26 -0.54 0.32 2.02 -1.22 -1.64 112.91 113.03 1yqw h THR 97 Ca 0.02 -1.06 -0.07 0.00 0.77 0.00 0.00 66.41 66.07 1yqw h THR 97 Cb 0.21 0.71 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 1yqw h THR 97 CO -0.00 0.39 0.07 0.74 0.37 0.00 0.00 175.52 177.09 1yqw h THR 98 N 0.97 1.26 -0.56 3.16 2.02 -1.16 -0.46 112.91 118.14 1yqw h THR 98 Ca 0.19 -0.99 0.02 0.00 0.77 0.00 0.00 66.41 66.39 1yqw h THR 98 Cb 0.47 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.70 1yqw h THR 98 CO 0.02 0.36 0.35 0.50 0.37 0.00 0.00 175.52 177.12 1yqw h LYS 99 N 0.79 0.69 0.02 6.66 3.64 -1.06 0.14 116.57 127.45 1yqw h LYS 99 Ca 0.16 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1yqw h LYS 99 Cb 0.44 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 1yqw h LYS 99 CO 0.01 0.46 -0.01 -0.22 -2.27 0.00 0.00 179.45 177.42 1yqw h LYS 100 N 0.71 -0.02 -0.65 1.90 3.64 -1.03 -2.24 116.57 118.87 1yqw h LYS 100 Ca 0.22 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 1yqw h LYS 100 Cb -0.02 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 1yqw h LYS 100 CO -0.08 0.10 0.37 0.00 -2.27 0.00 0.00 179.45 177.57 1yqw h ALA 101 N 0.84 1.42 0.00 5.00 0.00 -0.95 -3.00 119.26 122.57 1yqw h ALA 101 Ca -0.00 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 1yqw h ALA 101 Cb 0.13 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1yqw h ALA 101 CO 0.00 0.49 -0.56 0.00 0.00 0.00 0.00 179.25 179.18 1yqw h ALA 102 N 1.50 0.92 -0.72 0.00 0.00 -0.79 -3.22 119.26 116.95 1yqw h ALA 102 Ca 0.23 -0.51 0.08 0.00 0.00 0.00 0.00 54.91 54.72 1yqw h ALA 102 Cb 0.00 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.64 1yqw h ALA 102 CO -0.04 0.70 0.38 0.00 0.00 0.00 0.00 179.25 180.29 1yqw h ALA 103 N 1.44 0.99 -0.31 0.00 0.00 -1.25 -2.79 119.26 117.33 1yqw h ALA 103 Ca -0.01 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1yqw h ALA 103 Cb 1.09 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1yqw h ALA 103 CO 0.07 0.01 0.00 1.63 0.00 0.00 0.00 179.25 180.97 1yqw n LYS 104 N -4.81 2.20 -1.86 0.00 5.02 -1.25 -5.01 118.16 112.44 1yqw n LYS 104 Ca 0.11 -1.97 -0.41 0.00 -2.02 0.00 0.00 58.31 54.01 1yqw n LYS 104 Cb 0.24 -1.36 -0.01 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 -1.14 3.59 0.36 7.82 0.00 -1.05 -4.71 121.76 126.63 1yqw s ALA 105 Ca 0.28 1.51 0.08 0.00 0.00 0.00 0.00 51.96 53.83 1yqw s ALA 105 Cb 0.16 -3.59 0.71 0.00 0.00 0.00 0.00 23.12 20.39 1yqw s ALA 105 CO 0.22 -0.97 1.89 0.87 0.00 0.00 0.00 175.76 177.77 1yqw h LYS 106 N 3.41 0.34 -2.72 0.00 1.57 -1.18 -3.46 116.57 114.53 1yqw h LYS 106 Ca -0.50 -0.08 0.03 0.00 -1.87 0.00 0.00 60.65 58.23 1yqw h LYS 106 Cb 1.23 -0.05 -0.13 0.00 0.08 0.00 0.00 32.23 33.36 1yqw h LYS 106 CO 0.67 0.45 0.32 0.20 -0.57 0.00 0.00 179.45 180.52 1yqw s GLY 107 N -3.99 -0.56 -0.14 3.86 0.00 -1.26 -5.04 107.32 100.19 1yqw s GLY 107 Ca -0.06 0.70 0.01 0.00 0.00 0.00 0.00 44.72 45.37 1yqw s GLY 107 CO 0.75 0.24 -0.15 -0.42 0.00 0.00 0.00 173.10 173.51 1yqw s ILE 108 N -3.48 1.61 -0.21 0.90 1.01 -1.26 -1.43 121.20 118.34 1yqw s ILE 108 Ca 0.02 -0.67 -0.04 0.00 0.00 0.00 0.00 60.65 59.96 1yqw s ILE 108 Cb -0.01 -1.49 -0.01 0.00 0.01 0.00 0.00 42.46 40.96 1yqw s ILE 108 CO -0.11 0.47 -0.04 -0.63 0.00 0.00 0.00 174.94 174.62 1yqw s ILE 109 N 1.31 3.46 -0.45 2.92 1.01 0.14 -1.17 121.20 128.42 1yqw s ILE 109 Ca 0.01 -0.47 -0.20 0.00 0.00 0.00 0.00 60.65 60.00 1yqw s ILE 109 Cb -0.13 -2.57 0.03 0.00 0.01 0.00 0.00 42.46 39.80 1yqw s ILE 109 CO -0.08 0.43 0.60 0.00 0.00 0.00 0.00 174.94 175.89 1yqw s ILE 111 N 2.66 4.93 0.00 0.00 2.07 -0.67 -0.52 121.20 129.67 1yqw s ILE 111 Ca 0.19 1.27 0.00 0.00 -1.41 0.00 0.00 60.65 60.70 1yqw s ILE 111 Cb -0.16 -4.00 0.00 0.00 0.13 0.00 0.00 42.46 38.43 1yqw s ILE 111 CO 0.16 -0.02 0.00 0.61 -1.91 0.00 0.00 174.94 173.78 1yqw n GLY 112 N 4.03 1.79 0.33 1.50 0.00 -0.02 -4.34 105.19 108.48 1yqw n GLY 112 Ca 0.02 -1.78 0.07 0.00 0.00 0.00 0.00 46.02 44.32 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 1.03 0.43 2.61 2.02 -1.48 -2.51 112.91 115.01 1yqw h THR 113 Ca 0.00 -0.19 -0.02 0.00 0.77 0.00 0.00 66.41 66.96 1yqw h THR 113 Cb 0.00 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 66.83 1yqw h THR 113 CO 0.00 0.10 -0.21 0.00 0.37 0.00 0.00 175.52 175.79 1yqw h SER 115 N -0.61 0.79 0.07 0.00 4.64 -1.57 0.12 113.55 117.00 1yqw h SER 115 Ca -0.06 -0.35 0.01 0.00 -0.47 0.00 0.00 61.79 60.92 1yqw h SER 115 Cb 0.46 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.32 1yqw h SER 115 CO 0.10 0.95 -0.12 0.00 -0.87 0.00 0.00 176.83 176.89 1yqw h ALA 116 N 0.87 -0.19 0.00 5.18 0.00 -1.41 0.13 119.26 123.84 1yqw h ALA 116 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1yqw h ALA 116 Cb 0.59 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1yqw h ALA 116 CO 0.04 -0.63 0.00 0.66 0.00 0.00 0.00 179.25 179.31 1yqw n TYR 117 N -5.24 0.00 0.00 0.00 4.01 0.27 -4.40 117.16 111.79 1yqw n TYR 117 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.67 1yqw n TYR 117 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.19 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 0.48 3.18 7.00 2.72 0.00 0.41 -4.08 105.19 114.90 1yqw n GLY 118 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.98 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 -0.06 0.37 -0.02 0.00 -1.23 -3.83 105.19 100.42 1yqw n GLY 119 Ca 0.00 -1.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.01 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 1.22 0.00 1.61 3.04 -1.93 -0.57 116.25 119.62 1yqw h VAL 120 Ca 0.00 -0.44 0.00 0.00 -1.01 0.00 0.00 66.70 65.25 1yqw h VAL 120 Cb 0.00 -0.18 0.00 0.00 -2.01 0.00 0.00 31.29 29.10 1yqw h VAL 120 CO 0.00 0.23 0.00 0.06 -1.01 0.00 0.00 177.57 176.85 1yqw h GLN 121 N 1.29 0.00 0.00 4.17 -0.00 -1.93 -2.24 115.11 116.40 1yqw h GLN 121 Ca 0.37 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.02 1yqw h GLN 121 Cb -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.39 1yqw h GLN 121 CO -0.10 0.00 -0.00 -0.22 -0.00 0.00 0.00 178.83 178.51 1yqw h LYS 122 N 0.00 0.00 -6.70 0.06 3.64 -1.20 -3.41 116.57 108.97 1yqw h LYS 122 Ca 0.00 0.00 -0.58 0.00 -1.27 0.00 0.00 60.65 58.80 1yqw h LYS 122 Cb 0.55 0.00 0.14 0.00 -0.41 0.00 0.00 32.23 32.51 1yqw h LYS 122 CO 0.00 0.00 0.15 0.00 -2.27 0.00 0.00 179.45 177.33 1yqw n ALA 123 N -1.87 0.20 -1.61 5.00 0.00 -0.84 -4.20 120.51 117.20 1yqw n ALA 123 Ca 0.05 0.17 -0.46 0.00 0.00 0.00 0.00 53.44 53.20 1yqw n ALA 123 Cb 0.46 -2.09 -0.02 0.00 0.00 0.00 0.00 19.45 17.79 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 -0.14 1.46 -0.61 0.00 5.02 -1.26 0.01 118.16 122.63 1yqw n LYS 124 Ca 0.10 0.51 -0.02 0.00 -2.02 0.00 0.00 58.31 56.89 1yqw n LYS 124 Cb 0.42 -1.99 0.20 0.00 -0.02 0.00 0.00 35.03 33.64 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 1.26 2.88 -3.69 1.97 -0.04 -1.26 -5.00 135.00 131.11 1yqw n PRO 125 Ca 0.11 -1.89 -0.30 0.00 -0.04 0.00 0.00 63.50 61.38 1yqw n PRO 125 Cb 0.30 -1.89 0.03 0.00 -0.04 0.00 0.00 33.50 31.90 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 0.10 -5.34 0.24 3.54 2.85 0.10 -4.87 115.26 111.89 1yqw n ASN 126 Ca 0.23 -0.97 0.07 0.00 -0.11 0.00 0.00 54.58 53.80 1yqw n ASN 126 Cb 0.95 -3.10 0.59 0.00 1.24 0.00 0.00 39.78 39.46 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 -1.60 0.00 -0.01 1.20 0.13 -1.83 -1.52 132.00 128.37 1yqw h PRO 127 Ca -0.61 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 1yqw h PRO 127 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 1yqw h PRO 127 CO 0.46 0.10 -0.02 -1.13 -0.23 0.00 0.00 178.00 177.18 1yqw n SER 128 N -4.34 1.34 -3.74 1.44 3.41 -1.26 -4.93 113.62 105.53 1yqw n SER 128 Ca -0.03 -1.41 -0.23 0.00 -0.26 0.00 0.00 58.87 56.94 1yqw n SER 128 Cb 0.18 0.01 0.02 0.00 -0.26 0.00 0.00 64.21 64.16 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 0.01 -4.04 -2.58 4.33 6.02 -0.57 -1.96 117.38 118.59 1yqw n GLN 129 Ca 0.19 0.56 -0.39 0.00 -0.01 0.00 0.00 57.00 57.35 1yqw n GLN 129 Cb 0.33 -4.94 -0.05 0.00 1.02 0.00 0.00 30.24 26.61 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 -3.71 3.28 0.14 -1.58 0.00 -1.26 -1.82 121.76 116.82 1yqw s ALA 130 Ca 0.07 0.75 0.05 0.00 0.00 0.00 0.00 51.96 52.82 1yqw s ALA 130 Cb -0.02 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.78 1yqw s ALA 130 CO 0.83 -0.07 -0.11 0.15 0.00 0.00 0.00 175.76 176.56 1yqw s LYS 131 N -1.77 1.04 0.83 0.00 1.02 0.14 -4.70 119.74 116.30 1yqw s LYS 131 Ca 0.48 -1.37 -0.11 0.00 0.02 0.00 0.00 55.97 54.99 1yqw s LYS 131 Cb -0.26 -0.69 0.09 0.00 -0.52 0.00 0.00 37.83 36.44 1yqw s LYS 131 CO 0.34 0.10 1.09 0.20 -0.92 0.00 0.00 175.35 176.16 1yqw s GLY 132 N -2.93 1.66 0.14 -3.33 0.00 -1.26 -0.64 107.32 100.95 1yqw s GLY 132 Ca 0.14 0.18 -0.17 0.00 0.00 0.00 0.00 44.72 44.87 1yqw s GLY 132 CO 0.01 0.59 1.76 -2.08 0.00 0.00 0.00 173.10 173.38 1yqw h VAL 133 N -1.36 1.12 -0.74 1.40 2.07 -0.94 -1.20 116.25 116.61 1yqw h VAL 133 Ca -0.46 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 66.81 1yqw h VAL 133 Cb 1.25 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 31.67 1yqw h VAL 133 CO 0.51 0.12 0.47 0.77 0.02 0.00 0.00 177.57 179.47 1yqw h SER 134 N 0.44 0.80 -0.42 0.57 4.64 -1.78 0.21 113.55 118.01 1yqw h SER 134 Ca 0.12 -0.01 -0.05 0.00 -0.47 0.00 0.00 61.79 61.39 1yqw h SER 134 Cb 0.01 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 61.90 1yqw h SER 134 CO -0.02 0.56 0.08 -0.08 -0.87 0.00 0.00 176.83 176.50 1yqw h GLU 135 N 0.94 0.69 -0.18 4.77 4.81 -1.80 0.22 114.58 124.03 1yqw h GLU 135 Ca 0.28 -0.18 -0.15 0.00 -0.13 0.00 0.00 59.36 59.19 1yqw h GLU 135 Cb -0.04 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 1yqw h GLU 135 CO -0.09 0.72 -0.51 0.00 -0.73 0.00 0.00 179.01 178.40 1yqw h ALA 136 N 0.94 0.78 0.00 2.92 0.00 -0.51 -3.26 119.26 120.13 1yqw h ALA 136 Ca 0.13 -0.49 -0.13 0.00 0.00 0.00 0.00 54.91 54.42 1yqw h ALA 136 Cb 0.35 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1yqw h ALA 136 CO 0.01 0.68 -1.77 1.28 0.00 0.00 0.00 179.25 179.44 1yqw n LEU 137 N -3.97 0.38 -1.36 0.00 4.77 0.69 -4.99 117.00 112.51 1yqw n LEU 137 Ca -0.03 0.16 -0.09 0.00 -0.03 0.00 0.00 56.01 56.02 1yqw n LEU 137 Cb 0.57 0.12 0.01 0.00 -2.33 0.00 0.00 43.42 41.80 1yqw n LEU 137 CO 0.46 0.12 -0.00 0.61 -1.33 0.00 0.00 177.39 177.25 1yqw n GLY 138 N 1.40 0.18 3.18 -0.72 0.00 0.76 -5.06 105.19 104.93 1yqw n GLY 138 Ca -0.11 -0.41 -0.12 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.78 0.78 0.24 1.61 -7.23 -1.16 -5.06 120.40 106.81 1yqw s VAL 139 Ca 0.12 -1.87 -0.30 0.00 -1.81 0.00 0.00 61.98 58.12 1yqw s VAL 139 Cb -0.05 -1.61 -0.09 0.00 0.56 0.00 0.00 36.38 35.19 1yqw s VAL 139 CO 0.15 -0.79 0.98 -0.75 -0.31 0.00 0.00 175.10 174.37 1yqw s LYS 140 N -3.57 4.80 0.10 4.82 2.20 -1.26 -4.34 119.74 122.49 1yqw s LYS 140 Ca 0.11 1.56 0.08 0.00 -0.36 0.00 0.00 55.97 57.36 1yqw s LYS 140 Cb 0.03 -3.26 -0.03 0.00 -1.51 0.00 0.00 37.83 33.05 1yqw s LYS 140 CO -0.03 0.44 -0.21 0.95 -0.36 0.00 0.00 175.35 176.14 1yqw s THR 141 N -1.13 1.71 -0.32 3.43 -4.23 -1.26 -4.78 115.64 109.05 1yqw s THR 141 Ca 0.42 -1.52 -0.25 0.00 -1.18 0.00 0.00 61.69 59.16 1yqw s THR 141 Cb -0.27 -1.55 0.01 0.00 1.34 0.00 0.00 72.50 72.02 1yqw s THR 141 CO 0.34 -0.04 0.86 -0.63 -0.54 0.00 0.00 174.62 174.61 1yqw s ILE 142 N -1.14 4.70 -0.22 2.99 1.01 -0.32 -4.83 121.20 123.39 1yqw s ILE 142 Ca 0.06 1.26 -0.10 0.00 0.00 0.00 0.00 60.65 61.88 1yqw s ILE 142 Cb -0.10 -4.23 -0.05 0.00 0.01 0.00 0.00 42.46 38.09 1yqw s ILE 142 CO 0.04 -0.35 0.15 0.20 0.00 0.00 0.00 174.94 174.98 1yqw s ASN 143 N 1.68 6.16 -0.66 3.58 0.01 -0.17 -0.26 114.94 125.28 1yqw s ASN 143 Ca 0.36 0.16 0.06 0.00 -0.71 0.00 0.00 52.86 52.72 1yqw s ASN 143 Cb -0.13 -2.10 0.24 0.00 0.41 0.00 0.00 41.25 39.67 1yqw s ASN 143 CO 0.14 0.11 0.74 -0.38 -1.51 0.00 0.00 177.10 176.20 1yqw n ILE 144 N 3.99 2.37 -2.00 0.60 2.08 0.32 -4.08 119.36 122.64 1yqw n ILE 144 Ca -0.15 -5.20 -0.27 0.00 0.56 0.00 0.00 62.75 57.69 1yqw n ILE 144 Cb 0.52 -2.11 0.18 0.00 -0.75 0.00 0.00 39.64 37.48 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 1.00 -1.01 0.00 0.38 -0.04 -1.26 -0.84 135.00 133.23 1yqw n PRO 145 Ca 0.29 -2.06 0.00 0.00 -0.04 0.00 0.00 63.50 61.69 1yqw n PRO 145 Cb 0.40 -1.17 0.00 0.00 -0.04 0.00 0.00 33.50 32.69 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 -3.02 3.14 2.28 0.55 0.00 -1.21 -4.15 105.19 102.77 1yqw n GLY 146 Ca 0.16 -1.88 -0.24 0.00 0.00 0.00 0.00 46.02 44.05 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 -1.71 2.60 0.79 0.00 0.04 -1.26 -5.08 135.00 130.37 1yqw s PRO 148 Ca 0.37 -1.03 -0.12 0.00 0.04 0.00 0.00 61.00 60.27 1yqw s PRO 148 Cb 0.18 -2.60 0.07 0.00 0.04 0.00 0.00 34.50 32.19 1yqw s PRO 148 CO -0.08 -0.58 1.12 -1.25 0.04 0.00 0.00 177.00 176.25 1yqw s PRO 149 N -4.61 2.01 0.28 0.56 0.04 -1.16 -4.98 135.00 127.12 1yqw s PRO 149 Ca 0.57 1.37 -0.30 0.00 0.04 0.00 0.00 61.00 62.69 1yqw s PRO 149 Cb -0.10 -1.85 -0.10 0.00 0.04 0.00 0.00 34.50 32.49 1yqw s PRO 149 CO 0.37 -1.86 1.40 1.21 0.04 0.00 0.00 177.00 178.16 1yqw s ASN 150 N -2.92 6.67 0.58 6.66 3.84 -1.26 -4.83 114.94 123.68 1yqw s ASN 150 Ca 0.65 2.69 0.28 0.00 0.21 0.00 0.00 52.86 56.68 1yqw s ASN 150 Cb -0.20 -2.63 1.72 0.00 -0.55 0.00 0.00 41.25 39.59 1yqw s ASN 150 CO 0.53 -0.66 2.21 1.55 -2.79 0.00 0.00 177.10 177.94 1yqw h PRO 151 N 4.50 0.00 -0.73 0.43 0.13 -1.91 -1.25 132.00 133.17 1yqw h PRO 151 Ca -0.47 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 64.74 1yqw h PRO 151 Cb 1.22 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.29 1yqw h PRO 151 CO 0.74 0.00 0.40 0.82 -0.23 0.00 0.00 178.00 179.73 1yqw h ILE 152 N 0.00 0.93 -0.26 -3.56 2.04 -1.92 0.14 117.51 114.87 1yqw h ILE 152 Ca 0.02 -0.24 -0.16 0.00 1.00 0.00 0.00 64.86 65.48 1yqw h ILE 152 Cb 0.11 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.35 1yqw h ILE 152 CO -0.00 0.13 -0.46 0.78 0.00 0.00 0.00 178.15 178.60 1yqw h ASN 153 N 0.71 0.86 0.29 1.72 2.35 -1.62 -0.83 115.58 119.05 1yqw h ASN 153 Ca 0.34 -0.53 -0.01 0.00 -0.55 0.00 0.00 56.30 55.55 1yqw h ASN 153 Cb 0.28 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.41 1yqw h ASN 153 CO -0.22 1.22 -0.14 0.15 -1.65 0.00 0.00 177.43 176.79 1yqw h PHE 154 N 0.52 -0.36 -0.54 1.19 3.57 -1.19 -2.07 116.94 118.06 1yqw h PHE 154 Ca 0.02 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.46 1yqw h PHE 154 Cb 1.07 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.90 1yqw h PHE 154 CO 0.08 -0.01 0.13 0.28 -2.23 0.00 0.00 178.31 176.57 1yqw h VAL 155 N -0.85 1.22 -0.71 1.41 2.07 -1.07 -0.58 116.25 117.73 1yqw h VAL 155 Ca -0.04 -0.79 -0.05 0.00 0.82 0.00 0.00 66.70 66.64 1yqw h VAL 155 Cb 0.52 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 1yqw h VAL 155 CO 0.07 0.30 0.26 1.23 0.02 0.00 0.00 177.57 179.44 1yqw h GLY 156 N 0.96 1.16 0.86 2.17 0.00 -1.19 0.42 103.07 107.44 1yqw h GLY 156 Ca 0.18 -0.65 -0.00 0.00 0.00 0.00 0.00 47.33 46.85 1yqw h GLY 156 CO -0.00 0.61 -0.00 0.00 0.00 0.00 0.00 176.54 177.15 1yqw h ALA 157 N 1.12 -0.00 -0.11 3.60 0.00 -0.70 0.63 119.26 123.81 1yqw h ALA 157 Ca 0.23 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.11 1yqw h ALA 157 Cb 0.25 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1yqw h ALA 157 CO -0.01 -0.43 -0.12 0.28 0.00 0.00 0.00 179.25 178.97 1yqw h VAL 158 N -0.15 0.68 -0.67 0.00 2.07 -0.88 0.52 116.25 117.81 1yqw h VAL 158 Ca -0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 1yqw h VAL 158 Cb 0.15 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 1yqw h VAL 158 CO 0.00 0.00 0.35 0.58 0.02 0.00 0.00 177.57 178.52 1yqw h VAL 159 N -0.14 1.22 -0.64 2.57 2.07 -0.87 -1.47 116.25 118.98 1yqw h VAL 159 Ca 0.08 -0.56 0.04 0.00 0.82 0.00 0.00 66.70 67.08 1yqw h VAL 159 Cb 0.26 0.36 -0.05 0.00 -1.52 0.00 0.00 31.29 30.35 1yqw h VAL 159 CO -0.20 0.24 0.37 -0.74 0.02 0.00 0.00 177.57 177.26 1yqw h HIS 160 N 0.92 0.68 -0.55 1.57 6.17 -0.42 -1.62 115.15 121.90 1yqw h HIS 160 Ca 0.23 0.02 -0.10 0.00 0.71 0.00 0.00 60.37 61.24 1yqw h HIS 160 Cb 0.07 -0.21 -0.02 0.00 2.52 0.00 0.00 27.41 29.76 1yqw h HIS 160 CO -0.00 0.36 -0.03 0.28 0.71 0.00 0.00 177.93 179.24 1yqw h VAL 161 N 0.70 1.26 0.00 5.26 2.07 -0.25 0.44 116.25 125.73 1yqw h VAL 161 Ca 0.27 -1.16 -0.06 0.00 0.82 0.00 0.00 66.70 66.58 1yqw h VAL 161 Cb 0.11 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1yqw h VAL 161 CO -0.15 0.41 -0.27 -0.07 0.02 0.00 0.00 177.57 177.52 1yqw h LEU 162 N 0.89 0.00 0.00 2.57 3.38 -1.08 -3.32 115.31 117.75 1yqw h LEU 162 Ca 0.16 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 1yqw h LEU 162 Cb 0.57 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 1yqw h LEU 162 CO 0.03 0.27 -1.24 0.35 0.09 0.00 0.00 178.44 177.94 1yqw n THR 163 N -3.19 0.10 0.00 0.22 -2.24 -0.63 -4.88 114.28 103.66 1yqw n THR 163 Ca 0.03 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 1yqw n THR 163 Cb 0.61 -0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.82 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 -1.83 0.59 0.00 -0.78 5.02 0.15 -5.06 118.16 116.25 1yqw n LYS 164 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 1yqw n LYS 164 Cb 0.29 -0.90 0.00 0.00 -0.02 0.00 0.00 35.03 34.40 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 2.99 0.85 3.70 0.72 0.00 -0.71 -5.03 105.19 107.71 1yqw n GLY 165 Ca 0.00 -1.99 -0.42 0.00 0.00 0.00 0.00 46.02 43.61 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 -2.01 4.88 0.71 -0.61 1.01 -1.26 -3.32 121.20 120.59 1yqw s ILE 166 Ca 0.00 1.85 -0.13 0.00 0.00 0.00 0.00 60.65 62.37 1yqw s ILE 166 Cb 0.00 -4.23 0.02 0.00 0.01 0.00 0.00 42.46 38.27 1yqw s ILE 166 CO 0.00 0.11 1.11 -2.16 0.00 0.00 0.00 174.94 174.00 1yqw s PRO 167 N 1.47 2.54 0.26 2.79 0.04 -1.26 -4.95 135.00 135.89 1yqw s PRO 167 Ca 0.45 1.32 -0.30 0.00 0.04 0.00 0.00 61.00 62.51 1yqw s PRO 167 Cb -0.19 -1.92 -0.11 0.00 0.04 0.00 0.00 34.50 32.32 1yqw s PRO 167 CO 0.20 -1.44 1.56 -0.51 0.04 0.00 0.00 177.00 176.85 1yqw s ASP 168 N -2.87 6.47 0.09 6.66 1.01 -1.26 -4.92 116.67 121.85 1yqw s ASP 168 Ca 0.65 2.83 0.08 0.00 0.71 0.00 0.00 52.55 56.82 1yqw s ASP 168 Cb -0.20 -2.62 -0.04 0.00 1.01 0.00 0.00 42.92 41.07 1yqw s ASP 168 CO 0.47 -0.85 -0.17 -0.76 0.21 0.00 0.00 175.17 174.08 1yqw s LEU 169 N -0.16 2.74 0.00 1.23 1.43 -1.26 -1.59 118.68 121.06 1yqw s LEU 169 Ca 0.64 -0.48 -0.10 0.00 -1.03 0.00 0.00 54.13 53.16 1yqw s LEU 169 Cb -0.46 -1.59 0.14 0.00 0.03 0.00 0.00 46.19 44.31 1yqw s LEU 169 CO 0.44 0.21 0.76 -0.90 0.23 0.00 0.00 176.35 177.08 1yqw n ASP 170 N 1.04 -0.14 0.30 2.29 5.68 0.23 -4.85 116.55 121.10 1yqw n ASP 170 Ca -0.15 -1.23 0.18 0.00 -0.50 0.00 0.00 54.79 53.08 1yqw n ASP 170 Cb 0.52 -0.59 1.02 0.00 -1.14 0.00 0.00 41.12 40.93 1yqw n ASP 170 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1yqw h GLU 171 N 0.00 0.00 -0.52 0.11 3.07 -2.01 -0.43 114.58 114.80 1yqw h GLU 171 Ca -0.25 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.61 1yqw h GLU 171 Cb 0.69 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.60 1yqw h GLU 171 CO 0.17 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.87 1yqw n ASN 172 N -3.54 4.25 0.00 1.42 5.03 -1.26 -4.95 115.26 116.20 1yqw n ASN 172 Ca -0.03 -2.45 0.00 0.00 0.87 0.00 0.00 54.58 52.97 1yqw n ASN 172 Cb 0.11 -0.50 0.00 0.00 -1.02 0.00 0.00 39.78 38.37 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 0.73 0.46 3.83 7.41 0.00 -0.17 -4.78 105.19 112.67 1yqw n GLY 173 Ca 0.22 -0.40 -0.37 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.74 3.74 0.10 1.61 0.52 -1.26 -0.99 118.95 121.93 1yqw s ARG 174 Ca 0.00 0.02 -0.31 0.00 -0.52 0.00 0.00 55.73 54.92 1yqw s ARG 174 Cb 0.00 -3.25 -0.10 0.00 0.52 0.00 0.00 34.95 32.12 1yqw s ARG 174 CO 0.00 0.64 1.87 -2.14 0.02 0.00 0.00 175.30 175.68 1yqw s PRO 175 N -0.70 4.14 0.58 3.54 0.02 -1.26 -0.60 135.00 140.72 1yqw s PRO 175 Ca 0.17 2.60 0.28 0.00 0.02 0.00 0.00 61.00 64.07 1yqw s PRO 175 Cb -0.13 -3.75 1.72 0.00 0.02 0.00 0.00 34.50 32.36 1yqw s PRO 175 CO 0.06 -0.87 2.19 0.87 -0.33 0.00 0.00 177.00 178.92 1yqw h LYS 176 N 9.14 0.00 -0.84 5.54 1.57 -1.63 -0.88 116.57 129.47 1yqw h LYS 176 Ca -0.47 0.00 0.19 0.00 -1.87 0.00 0.00 60.65 58.50 1yqw h LYS 176 Cb 1.22 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.47 1yqw h LYS 176 CO 0.95 0.00 0.56 -0.07 -0.57 0.00 0.00 179.45 180.32 1yqw h LEU 177 N 0.00 0.37 0.00 2.94 3.38 -1.89 -1.89 115.31 118.22 1yqw h LEU 177 Ca 0.03 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 1yqw h LEU 177 Cb 0.17 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1yqw h LEU 177 CO -0.00 0.17 -1.27 0.49 0.09 0.00 0.00 178.44 177.91 1yqw n PHE 178 N -4.48 0.00 -0.48 1.13 3.01 -0.87 -4.76 117.46 111.00 1yqw n PHE 178 Ca 0.17 0.00 0.05 0.00 1.01 0.00 0.00 57.45 58.69 1yqw n PHE 178 Cb 0.65 -0.17 0.11 0.00 -0.01 0.00 0.00 39.48 40.06 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 -1.90 0.26 0.41 1.38 4.02 -0.39 -3.40 117.16 117.53 1yqw n TYR 179 Ca -0.04 -0.69 0.13 0.00 -0.01 0.00 0.00 57.90 57.29 1yqw n TYR 179 Cb 0.37 -0.12 0.43 0.00 -0.02 0.00 0.00 39.34 40.00 1yqw n TYR 179 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1yqw h GLY 180 N 0.75 0.00 -4.09 2.72 0.00 -1.52 -3.41 103.07 97.51 1yqw h GLY 180 Ca 0.00 0.00 -0.68 0.00 0.00 0.00 0.00 47.33 46.65 1yqw h GLY 180 CO 0.04 0.00 -0.87 -0.54 0.00 0.00 0.00 176.54 175.17 1yqw s GLU 181 N -3.29 1.52 0.32 4.80 2.02 -1.26 -5.04 118.70 117.76 1yqw s GLU 181 Ca 0.06 -1.24 -0.29 0.00 0.02 0.00 0.00 54.97 53.53 1yqw s GLU 181 Cb 0.09 -1.87 -0.10 0.00 0.10 0.00 0.00 34.13 32.35 1yqw s GLU 181 CO 0.55 0.46 1.28 -0.51 0.02 0.00 0.00 175.26 177.06 1yqw s LEU 182 N -1.72 4.45 0.19 1.80 1.43 -1.26 -1.83 118.68 121.74 1yqw s LEU 182 Ca 0.12 2.61 -0.15 0.00 -1.03 0.00 0.00 54.13 55.68 1yqw s LEU 182 Cb -0.10 -3.64 0.18 0.00 0.03 0.00 0.00 46.19 42.65 1yqw s LEU 182 CO 0.04 -0.47 1.64 0.58 0.23 0.00 0.00 176.35 178.37 1yqw h VAL 183 N 3.09 0.46 -0.84 -1.59 2.07 -1.00 -2.73 116.25 115.71 1yqw h VAL 183 Ca -0.48 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.09 1yqw h VAL 183 Cb 1.22 0.46 -0.05 0.00 -1.52 0.00 0.00 31.29 31.40 1yqw h VAL 183 CO 0.66 0.00 0.55 -0.74 0.02 0.00 0.00 177.57 178.06 1yqw h HIS 184 N -0.01 0.97 0.00 1.57 6.17 -1.75 -2.04 115.15 120.06 1yqw h HIS 184 Ca 0.26 0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.36 1yqw h HIS 184 Cb 0.40 -0.32 0.00 0.00 2.52 0.00 0.00 27.41 30.00 1yqw h HIS 184 CO -0.45 0.54 0.00 -0.44 0.71 0.00 0.00 177.93 178.29 1yqw h ASP 185 N 0.98 0.00 -0.29 3.26 3.45 -1.79 -2.23 116.42 119.80 1yqw h ASP 185 Ca 0.35 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.81 1yqw h ASP 185 Cb 0.12 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.89 1yqw h ASP 185 CO -0.11 0.00 0.00 0.59 -1.57 0.00 0.00 179.24 178.15 1yqw n ASN 186 N -2.85 3.18 -4.71 6.45 3.02 -0.79 -5.02 115.26 114.54 1yqw n ASN 186 Ca 0.00 -2.36 -0.41 0.00 -0.03 0.00 0.00 54.58 51.79 1yqw n ASN 186 Cb 0.24 -0.33 -0.04 0.00 -0.61 0.00 0.00 39.78 39.04 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 6.68 0.00 -0.07 0.00 0.11 -1.93 -1.83 132.00 134.96 1yqw h PRO 188 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 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 0.75 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 179.08 1yqw n ARG 189 N -2.47 1.63 -0.28 1.05 1.74 -1.26 -4.38 116.66 112.69 1yqw n ARG 189 Ca -0.02 -0.93 0.05 0.00 -0.77 0.00 0.00 57.85 56.18 1yqw n ARG 189 Cb 0.05 -1.45 0.19 0.00 -1.02 0.00 0.00 32.46 30.23 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 2.11 0.52 -1.21 0.55 5.85 -1.63 0.62 115.31 122.12 1yqw h LEU 190 Ca 0.00 0.08 0.09 0.00 0.84 0.00 0.00 57.88 58.89 1yqw h LEU 190 Cb 0.45 -0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.41 1yqw h LEU 190 CO 0.00 0.26 0.57 -0.65 -0.34 0.00 0.00 178.44 178.28 1yqw h PRO 191 N 0.64 0.86 -0.34 5.25 0.11 -1.84 0.33 132.00 137.02 1yqw h PRO 191 Ca 0.42 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.43 1yqw h PRO 191 Cb 0.51 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.42 1yqw h PRO 191 CO -0.32 0.57 0.06 0.45 -0.21 0.00 0.00 178.00 178.55 1yqw h HIS 192 N 0.89 0.59 -0.21 0.65 3.86 -1.21 -2.17 115.15 117.54 1yqw h HIS 192 Ca 0.40 -0.08 0.05 0.00 -1.16 0.00 0.00 60.37 59.58 1yqw h HIS 192 Cb 0.38 -0.16 -0.05 0.00 1.06 0.00 0.00 27.41 28.63 1yqw h HIS 192 CO -0.00 0.62 -0.12 0.35 0.86 0.00 0.00 177.93 179.64 1yqw h PHE 193 N 0.39 -0.30 -0.60 2.45 3.57 -0.70 0.22 116.94 121.97 1yqw h PHE 193 Ca 0.10 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.70 1yqw h PHE 193 Cb 0.34 0.16 -0.04 0.00 2.79 0.00 0.00 35.95 39.21 1yqw h PHE 193 CO 0.02 -0.18 0.40 0.93 -2.23 0.00 0.00 178.31 177.25 1yqw h GLU 194 N -0.11 0.50 -0.23 1.11 5.08 -0.87 -1.74 114.58 118.32 1yqw h GLU 194 Ca 0.12 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1yqw h GLU 194 Cb 0.28 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1yqw h GLU 194 CO -0.28 0.33 0.00 0.00 -1.00 0.00 0.00 179.01 178.06 1yqw n ALA 195 N -2.49 2.49 -3.67 3.43 0.00 -0.78 -4.92 120.51 114.56 1yqw n ALA 195 Ca 0.09 -0.56 -0.25 0.00 0.00 0.00 0.00 53.44 52.73 1yqw n ALA 195 Cb 0.29 -1.05 0.06 0.00 0.00 0.00 0.00 19.45 18.75 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 0.39 -5.05 -4.23 0.00 7.64 -0.66 -4.96 113.62 106.76 1yqw n SER 196 Ca 0.15 -0.63 -0.42 0.00 1.01 0.00 0.00 58.87 58.97 1yqw n SER 196 Cb 0.32 -4.67 -0.05 0.00 -1.01 0.00 0.00 64.21 58.79 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 -6.25 3.16 -0.05 1.43 2.02 -0.01 -5.04 118.70 113.96 1yqw s GLU 197 Ca 0.49 -2.49 0.05 0.00 0.02 0.00 0.00 54.97 53.04 1yqw s GLU 197 Cb -0.23 -4.13 -0.02 0.00 0.10 0.00 0.00 34.13 29.85 1yqw s GLU 197 CO 0.76 -1.24 -0.17 -0.06 0.02 0.00 0.00 175.26 174.57 1yqw s PHE 198 N 0.07 2.61 0.07 1.61 0.08 -1.26 -1.88 117.98 119.28 1yqw s PHE 198 Ca 0.17 -0.25 -0.30 0.00 0.12 0.00 0.00 56.93 56.67 1yqw s PHE 198 Cb -0.15 -1.61 -0.06 0.00 -0.57 0.00 0.00 43.02 40.64 1yqw s PHE 198 CO -0.06 0.11 1.15 0.00 -0.10 0.00 0.00 175.22 176.32 1yqw s ALA 199 N -0.65 3.35 -0.80 5.36 0.00 -0.62 -4.90 121.76 123.51 1yqw s ALA 199 Ca 0.10 0.80 0.26 0.00 0.00 0.00 0.00 51.96 53.11 1yqw s ALA 199 Cb -0.11 -3.41 0.65 0.00 0.00 0.00 0.00 23.12 20.25 1yqw s ALA 199 CO 0.00 -0.36 1.56 -0.35 0.00 0.00 0.00 175.76 176.61 1yqw n PRO 200 N 3.64 0.18 -3.64 0.00 -0.04 -1.26 -4.32 135.00 129.56 1yqw n PRO 200 Ca 0.07 0.09 -0.06 0.00 -0.04 0.00 0.00 63.50 63.56 1yqw n PRO 200 Cb 0.47 -1.65 -0.02 0.00 -0.04 0.00 0.00 33.50 32.27 1yqw n PRO 200 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1yqw s SER 201 N -3.85 -0.29 0.47 3.54 1.04 -1.26 -4.94 113.70 108.41 1yqw s SER 201 Ca 0.10 -0.24 0.26 0.00 0.48 0.00 0.00 55.95 56.55 1yqw s SER 201 Cb 0.15 0.49 0.77 0.00 0.10 0.00 0.00 66.02 67.52 1yqw s SER 201 CO 0.65 -0.86 1.76 -0.26 0.98 0.00 0.00 173.24 175.52 1yqw h PHE 202 N 2.00 0.00 0.00 5.02 0.04 -1.98 -3.05 116.94 118.97 1yqw h PHE 202 Ca -0.24 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.53 1yqw h PHE 202 Cb 1.25 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.40 1yqw h PHE 202 CO 0.33 0.07 -0.51 -0.40 -0.60 0.00 0.00 178.31 177.19 1yqw n ASP 203 N -3.14 0.51 -4.76 2.17 5.75 -1.26 -4.71 116.55 111.10 1yqw n ASP 203 Ca 0.02 -0.21 -0.34 0.00 -0.01 0.00 0.00 54.79 54.26 1yqw n ASP 203 Cb 0.45 0.24 0.04 0.00 -1.03 0.00 0.00 41.12 40.83 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 -3.12 5.11 0.38 -1.12 1.04 -1.15 -4.88 113.70 109.96 1yqw s SER 204 Ca 0.10 2.10 0.08 0.00 0.48 0.00 0.00 55.95 58.71 1yqw s SER 204 Cb 0.17 -2.56 0.83 0.00 0.10 0.00 0.00 66.02 64.55 1yqw s SER 204 CO 0.70 -1.63 1.97 -0.33 0.98 0.00 0.00 173.24 174.94 1yqw h GLU 205 N 0.25 0.63 -0.80 4.02 4.39 -1.93 -1.55 114.58 119.59 1yqw h GLU 205 Ca -0.48 -0.04 0.09 0.00 0.34 0.00 0.00 59.36 59.27 1yqw h GLU 205 Cb 1.26 -0.14 -0.07 0.00 -0.10 0.00 0.00 28.75 29.70 1yqw h GLU 205 CO 0.54 0.42 0.45 0.93 -1.16 0.00 0.00 179.01 180.19 1yqw h GLU 206 N 0.65 0.75 -0.36 2.33 3.07 -1.91 0.43 114.58 119.53 1yqw h GLU 206 Ca 0.29 -0.04 -0.08 0.00 -0.50 0.00 0.00 59.36 59.02 1yqw h GLU 206 Cb 0.29 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.02 1yqw h GLU 206 CO -0.09 0.49 -0.08 0.00 -1.40 0.00 0.00 179.01 177.94 1yqw h ALA 207 N 1.44 0.50 -0.72 3.43 0.00 -1.52 -1.28 119.26 121.11 1yqw h ALA 207 Ca 0.38 -0.30 0.07 0.00 0.00 0.00 0.00 54.91 55.06 1yqw h ALA 207 Cb 0.33 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 1yqw h ALA 207 CO -0.24 0.34 0.48 0.87 0.00 0.00 0.00 179.25 180.70 1yqw h LYS 208 N 0.49 0.72 -0.01 0.00 1.57 -0.82 -1.56 116.57 116.96 1yqw h LYS 208 Ca 0.09 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1yqw h LYS 208 Cb 0.58 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.73 1yqw h LYS 208 CO 0.03 0.48 0.00 1.63 -0.57 0.00 0.00 179.45 181.02 1yqw n LYS 209 N -4.48 1.07 -2.02 3.15 5.02 0.09 -4.91 118.16 116.09 1yqw n LYS 209 Ca 0.11 -0.10 -0.02 0.00 -2.02 0.00 0.00 58.31 56.27 1yqw n LYS 209 Cb 0.24 -1.43 -0.00 0.00 -0.02 0.00 0.00 35.03 33.81 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 0.96 0.28 3.71 0.72 0.00 -0.59 -5.03 105.19 105.24 1yqw n GLY 210 Ca 0.21 -0.79 -0.31 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.12 2.15 0.50 1.61 2.99 -0.52 -4.89 117.98 117.69 1yqw s PHE 211 Ca 0.00 1.57 -0.23 0.00 0.00 0.00 0.00 56.93 58.27 1yqw s PHE 211 Cb 0.00 -3.17 -0.07 0.00 0.00 0.00 0.00 43.02 39.78 1yqw s PHE 211 CO 0.00 -2.35 1.25 0.00 -0.00 0.00 0.00 175.22 174.12 1yqw n LEU 213 N -0.38 4.56 -0.30 0.00 4.77 -1.26 -1.58 117.00 122.80 1yqw n LEU 213 Ca 0.09 -2.46 -0.05 0.00 -0.03 0.00 0.00 56.01 53.56 1yqw n LEU 213 Cb 0.43 -0.55 0.07 0.00 -2.33 0.00 0.00 43.42 41.04 1yqw n LEU 213 CO 0.55 0.80 1.13 0.22 -1.33 0.00 0.00 177.39 178.76 1yqw h TYR 214 N 3.72 1.14 0.00 -1.77 5.03 -1.91 -1.58 116.97 121.61 1yqw h TYR 214 Ca 0.00 -0.04 -0.00 0.00 2.58 0.00 0.00 58.73 61.27 1yqw h TYR 214 Cb 1.40 -0.36 -0.00 0.00 1.55 0.00 0.00 36.73 39.32 1yqw h TYR 214 CO 0.70 0.81 -0.02 1.49 -1.32 0.00 0.00 178.16 179.83 1yqw h GLU 215 N 1.15 0.00 -0.63 1.82 4.81 -1.81 -1.67 114.58 118.25 1yqw h GLU 215 Ca 0.29 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 1yqw h GLU 215 Cb 0.06 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1yqw h GLU 215 CO -0.04 0.02 0.00 1.28 -0.73 0.00 0.00 179.01 179.53 1yqw n LEU 216 N -3.12 3.89 0.00 1.64 4.77 -0.68 -4.77 117.00 118.73 1yqw n LEU 216 Ca 0.00 -1.96 0.00 0.00 -0.03 0.00 0.00 56.01 54.02 1yqw n LEU 216 Cb 0.29 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 40.86 1yqw n LEU 216 CO 0.27 0.62 0.00 0.61 -1.33 0.00 0.00 177.39 177.56 1yqw n GLY 217 N 0.86 0.74 3.66 -0.72 0.00 -0.63 -4.23 105.19 104.87 1yqw n GLY 217 Ca 0.20 0.00 -0.51 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 4.37 2.63 -0.30 0.00 4.76 -0.25 -4.51 118.16 124.86 1yqw n LYS 219 Ca 0.21 -2.52 0.07 0.00 -2.87 0.00 0.00 58.31 53.21 1yqw n LYS 219 Cb 0.22 -1.55 0.18 0.00 -1.84 0.00 0.00 35.03 32.04 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 4.45 0.88 1.52 0.72 0.00 -1.89 -0.48 103.07 108.27 1yqw h GLY 220 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1yqw h GLY 220 CO 0.00 -0.37 0.21 -2.55 0.00 0.00 0.00 176.54 173.83 1yqw h PRO 221 N 0.04 0.00 0.00 4.80 0.11 -1.95 -2.27 132.00 132.73 1yqw h PRO 221 Ca 0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.58 1yqw h PRO 221 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1yqw h PRO 221 CO -0.83 0.00 -0.10 1.33 -0.21 0.00 0.00 178.00 178.19 1yqw n VAL 222 N -2.59 0.98 -4.79 3.15 0.24 -0.22 -4.92 118.33 110.17 1yqw n VAL 222 Ca -0.02 -1.12 -0.33 0.00 -2.04 0.00 0.00 64.34 60.83 1yqw n VAL 222 Cb 0.25 0.30 -0.16 0.00 -1.47 0.00 0.00 33.84 32.76 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 -1.35 2.38 -0.33 3.34 2.01 -0.88 -5.00 115.64 115.81 1yqw s THR 223 Ca 0.12 -0.89 -0.17 0.00 0.31 0.00 0.00 61.69 61.06 1yqw s THR 223 Cb 0.10 -1.96 -0.01 0.00 0.01 0.00 0.00 72.50 70.64 1yqw s THR 223 CO 0.01 0.54 0.48 -0.31 -0.69 0.00 0.00 174.62 174.65 1yqw s TYR 224 N 0.62 3.20 -0.08 4.92 2.02 -1.26 -0.70 117.35 126.06 1yqw s TYR 224 Ca -0.10 0.21 -0.32 0.00 -0.37 0.00 0.00 57.07 56.49 1yqw s TYR 224 Cb -0.16 -2.84 0.13 0.00 -0.40 0.00 0.00 41.96 38.69 1yqw s TYR 224 CO 0.03 -0.47 1.22 1.21 -1.57 0.00 0.00 175.55 175.97 1yqw s ASN 225 N 1.73 -0.11 -0.13 2.29 3.84 -0.76 -4.81 114.94 116.99 1yqw s ASN 225 Ca 0.18 -0.09 0.15 0.00 0.21 0.00 0.00 52.86 53.31 1yqw s ASN 225 Cb -0.16 0.18 0.46 0.00 -0.55 0.00 0.00 41.25 41.18 1yqw s ASN 225 CO 0.12 -0.31 1.37 -0.46 -2.79 0.00 0.00 177.10 175.03 1yqw n ASN 226 N -0.31 3.59 -0.14 -4.21 6.94 -1.22 -3.76 115.26 116.16 1yqw n ASN 226 Ca -0.04 -2.73 -0.05 0.00 -0.02 0.00 0.00 54.58 51.73 1yqw n ASN 226 Cb 0.61 -0.45 0.02 0.00 -2.36 0.00 0.00 39.78 37.59 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 -0.11 0.00 0.02 0.00 0.13 -1.88 0.14 132.00 130.30 1yqw h PRO 228 Ca 0.22 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.21 1yqw h PRO 228 Cb 0.45 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.59 1yqw h PRO 228 CO -0.53 0.19 -0.56 0.87 -0.23 0.00 0.00 178.00 177.74 1yqw h LYS 229 N 0.00 0.34 0.00 0.86 1.57 -1.58 -3.39 116.57 114.38 1yqw h LYS 229 Ca -0.00 -0.40 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 1yqw h LYS 229 Cb 0.74 0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.17 1yqw h LYS 229 CO 0.02 1.09 -1.67 1.33 -0.57 0.00 0.00 179.45 179.65 1yqw n VAL 230 N -4.26 0.00 -1.33 0.50 0.24 -0.71 -5.11 118.33 107.66 1yqw n VAL 230 Ca -0.11 -0.36 0.18 0.00 -2.04 0.00 0.00 64.34 62.01 1yqw n VAL 230 Cb 0.66 0.21 -0.05 0.00 -1.47 0.00 0.00 33.84 33.19 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 -2.02 -0.72 -4.43 1.34 4.77 0.48 -4.74 117.00 111.69 1yqw n LEU 231 Ca -0.02 1.60 -0.32 0.00 -0.03 0.00 0.00 56.01 57.24 1yqw n LEU 231 Cb 0.42 -4.13 -0.14 0.00 -2.33 0.00 0.00 43.42 37.24 1yqw n LEU 231 CO 0.36 -3.26 -0.49 -0.36 -1.33 0.00 0.00 177.39 172.31 1yqw s PHE 232 N -2.56 2.59 -1.92 -1.77 0.40 0.13 -4.68 117.98 110.18 1yqw s PHE 232 Ca 0.00 -0.24 0.00 0.00 -0.60 0.00 0.00 56.93 56.09 1yqw s PHE 232 Cb 0.00 -1.59 0.00 0.00 0.51 0.00 0.00 43.02 41.94 1yqw s PHE 232 CO 0.00 0.12 0.00 0.09 0.70 0.00 0.00 175.22 176.13 1yqw n ASN 233 N 2.35 -5.37 -0.36 1.36 4.13 -1.26 -1.23 115.26 114.88 1yqw n ASN 233 Ca -0.17 0.29 -0.05 0.00 1.68 0.00 0.00 54.58 56.33 1yqw n ASN 233 Cb 0.52 -4.64 -0.02 0.00 -1.54 0.00 0.00 39.78 34.10 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 -2.59 -1.43 0.00 3.52 3.00 -1.26 -4.80 117.38 113.82 1yqw n GLN 234 Ca -0.21 0.59 0.00 0.00 -0.01 0.00 0.00 57.00 57.36 1yqw n GLN 234 Cb 0.66 -4.75 0.00 0.00 0.00 0.00 0.00 30.24 26.14 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 -2.31 0.00 -3.80 5.09 0.24 -0.37 -5.09 118.33 112.09 1yqw n VAL 235 Ca -0.05 0.00 -0.05 0.00 -2.04 0.00 0.00 64.34 62.20 1yqw n VAL 235 Cb 0.43 0.01 -0.02 0.00 -1.47 0.00 0.00 33.84 32.79 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 -0.74 -0.21 0.15 -1.34 3.84 -0.94 -4.96 114.94 110.75 1yqw s ASN 236 Ca 0.00 -0.50 -0.17 0.00 0.21 0.00 0.00 52.86 52.40 1yqw s ASN 236 Cb 0.00 0.59 0.04 0.00 -0.55 0.00 0.00 41.25 41.33 1yqw s ASN 236 CO 0.00 -1.10 0.46 -1.66 -2.79 0.00 0.00 177.10 172.01 1yqw s TRP 237 N -3.54 -0.21 0.22 0.43 1.48 -1.26 0.22 118.94 116.27 1yqw s TRP 237 Ca 0.12 -0.10 -0.13 0.00 -1.06 0.00 0.00 56.10 54.93 1yqw s TRP 237 Cb -0.03 0.33 0.26 0.00 -1.16 0.00 0.00 33.47 32.86 1yqw s TRP 237 CO 0.04 -0.78 1.62 -1.35 -4.06 0.00 0.00 176.95 172.42 1yqw h PRO 238 N 2.27 -0.00 -0.33 3.25 0.11 -1.96 -1.38 132.00 133.96 1yqw h PRO 238 Ca -0.32 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.70 1yqw h PRO 238 Cb 1.26 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.36 1yqw h PRO 238 CO 0.43 -0.00 -0.16 0.28 -0.21 0.00 0.00 178.00 178.34 1yqw h VAL 239 N -0.00 1.25 -0.16 3.15 2.07 -1.87 -1.07 116.25 119.62 1yqw h VAL 239 Ca 0.32 -1.15 -0.02 0.00 0.82 0.00 0.00 66.70 66.67 1yqw h VAL 239 Cb 0.49 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 1yqw h VAL 239 CO -0.69 0.38 0.00 -0.61 0.02 0.00 0.00 177.57 176.67 1yqw h GLN 240 N 0.53 0.22 -0.53 1.57 4.15 -1.60 -0.25 115.11 119.21 1yqw h GLN 240 Ca 0.09 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.48 1yqw h GLN 240 Cb 0.58 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.23 1yqw h GLN 240 CO 0.04 0.25 0.00 0.00 -1.93 0.00 0.00 178.83 177.18 1yqw n ALA 241 N -2.50 2.68 -0.93 3.38 0.00 -0.51 -4.91 120.51 117.72 1yqw n ALA 241 Ca -0.01 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 52.93 1yqw n ALA 241 Cb 0.16 -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 0.57 0.56 3.38 0.00 0.00 -0.10 -5.04 105.19 104.55 1yqw n GLY 242 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.09 2.57 0.68 1.61 5.04 -0.56 -4.98 115.29 117.55 1yqw s HIS 243 Ca 0.00 -0.40 -0.17 0.00 -1.54 0.00 0.00 55.06 52.95 1yqw s HIS 243 Cb 0.00 -1.62 0.01 0.00 0.04 0.00 0.00 32.58 31.01 1yqw s HIS 243 CO 0.00 -0.00 1.26 -1.25 -2.34 0.00 0.00 174.74 172.41 1yqw s PRO 244 N -0.46 2.38 0.24 2.88 0.04 -1.26 -3.02 135.00 135.80 1yqw s PRO 244 Ca 0.05 1.96 -0.30 0.00 0.04 0.00 0.00 61.00 62.75 1yqw s PRO 244 Cb -0.12 -1.84 -0.09 0.00 0.04 0.00 0.00 34.50 32.49 1yqw s PRO 244 CO 0.01 -1.70 1.22 0.00 0.04 0.00 0.00 177.00 176.58 1yqw n LEU 246 N 1.92 0.35 -0.62 0.00 4.77 -1.26 -1.09 117.00 121.08 1yqw n LEU 246 Ca 0.03 0.16 -0.03 0.00 -0.03 0.00 0.00 56.01 56.14 1yqw n LEU 246 Cb 0.44 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1yqw n LEU 246 CO 0.56 0.08 -0.01 0.61 -1.33 0.00 0.00 177.39 177.31 1yqw n GLY 247 N 1.50 0.47 0.03 -0.72 0.00 -1.26 -4.83 105.19 100.37 1yqw n GLY 247 Ca 0.06 -0.66 0.09 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.68 2.91 -4.88 0.00 3.41 -1.26 -3.36 113.62 108.76 1yqw n SER 249 Ca 0.03 -1.92 -0.36 0.00 -0.26 0.00 0.00 58.87 56.37 1yqw n SER 249 Cb 0.20 -0.24 -0.06 0.00 -0.26 0.00 0.00 64.21 63.85 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 -1.52 3.57 0.32 4.33 0.41 -0.50 -4.50 118.70 120.81 1yqw s GLU 250 Ca 0.37 -0.06 -0.29 0.00 -0.41 0.00 0.00 54.97 54.58 1yqw s GLU 250 Cb 0.21 -3.13 -0.11 0.00 -1.78 0.00 0.00 34.13 29.32 1yqw s GLU 250 CO 0.29 0.69 1.54 -2.14 -0.49 0.00 0.00 175.26 175.15 1yqw s PRO 251 N -1.48 4.13 -1.86 0.39 0.02 -1.26 -2.56 135.00 132.38 1yqw s PRO 251 Ca 0.23 2.55 0.00 0.00 0.02 0.00 0.00 61.00 63.80 1yqw s PRO 251 Cb -0.13 -3.01 0.00 0.00 0.02 0.00 0.00 34.50 31.38 1yqw s PRO 251 CO 0.12 -0.57 0.00 -0.25 -0.33 0.00 0.00 177.00 175.97 1yqw n ASP 252 N 1.53 -5.79 0.26 2.53 8.00 -1.26 -4.84 116.55 116.97 1yqw n ASP 252 Ca 0.05 0.09 0.08 0.00 0.71 0.00 0.00 54.79 55.73 1yqw n ASP 252 Cb 0.38 -4.87 0.64 0.00 -0.02 0.00 0.00 41.12 37.26 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 0.00 -0.81 1.24 -5.15 -1.79 0.50 116.94 110.93 1yqw h PHE 253 Ca -0.48 0.00 0.24 0.00 -0.20 0.00 0.00 57.97 57.53 1yqw h PHE 253 Cb 1.36 0.00 -0.03 0.00 0.22 0.00 0.00 35.95 37.50 1yqw h PHE 253 CO 0.56 0.04 0.61 -1.49 -2.00 0.00 0.00 178.31 176.03 1yqw h TRP 254 N 0.00 0.00 0.00 6.09 4.06 -1.88 0.15 115.95 124.36 1yqw h TRP 254 Ca -0.00 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 60.87 1yqw h TRP 254 Cb 0.07 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.21 1yqw h TRP 254 CO 0.00 0.00 -1.53 -0.25 -3.56 0.00 0.00 178.44 173.10 1yqw n ASP 255 N -4.19 2.78 0.09 -3.49 10.43 0.05 -4.33 116.55 117.89 1yqw n ASP 255 Ca 0.17 0.00 0.11 0.00 2.57 0.00 0.00 54.79 57.64 1yqw n ASP 255 Cb 0.91 1.09 -0.03 0.00 1.84 0.00 0.00 41.12 44.93 1yqw n ASP 255 CO 0.00 0.00 0.00 0.35 -1.07 0.00 0.00 177.20 176.48 1yqw n THR 256 N -2.08 0.54 0.10 -3.53 -2.24 -0.50 -4.25 114.28 102.33 1yqw n THR 256 Ca -0.08 -0.55 0.05 0.00 -2.27 0.00 0.00 64.05 61.20 1yqw n THR 256 Cb 0.52 -0.30 0.09 0.00 -2.10 0.00 0.00 70.33 68.54 1yqw n THR 256 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1yqw n MET 257 N -2.62 1.69 -4.00 -0.78 2.81 0.02 -4.98 117.12 109.25 1yqw n MET 257 Ca -0.01 -1.54 -0.30 0.00 -1.81 0.00 0.00 57.70 54.05 1yqw n MET 257 Cb 0.56 -1.20 -0.05 0.00 -0.71 0.00 0.00 33.22 31.81 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 -0.89 4.85 0.33 2.03 -4.23 -1.25 -3.70 115.64 112.79 1yqw s THR 258 Ca 0.15 -0.68 -0.29 0.00 -1.18 0.00 0.00 61.69 59.70 1yqw s THR 258 Cb 0.09 -3.38 -0.11 0.00 1.34 0.00 0.00 72.50 70.44 1yqw s THR 258 CO 0.12 0.09 1.48 -2.84 -0.54 0.00 0.00 174.62 172.93 1yqw s PRO 259 N -2.57 4.17 0.42 3.99 0.02 -1.26 -4.98 135.00 134.78 1yqw s PRO 259 Ca 0.32 2.49 0.15 0.00 0.02 0.00 0.00 61.00 63.98 1yqw s PRO 259 Cb -0.12 -3.01 0.92 0.00 0.02 0.00 0.00 34.50 32.30 1yqw s PRO 259 CO 0.25 -0.49 1.92 0.74 -0.33 0.00 0.00 177.00 179.08 1yqw h PHE 260 N 3.78 0.00 -0.62 6.54 0.04 -1.93 -2.97 116.94 121.78 1yqw h PHE 260 Ca -0.49 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.20 1yqw h PHE 260 Cb 1.23 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 39.33 1yqw h PHE 260 CO 0.56 0.26 0.10 0.66 -0.60 0.00 0.00 178.31 179.29 1yqw n TYR 261 N -4.14 2.16 -4.18 -0.55 4.01 -1.26 -4.36 117.16 108.84 1yqw n TYR 261 Ca -0.02 -0.87 -0.11 0.00 -0.16 0.00 0.00 57.90 56.74 1yqw n TYR 261 Cb 0.32 -0.57 -0.10 0.00 -0.31 0.00 0.00 39.34 38.68 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 -2.77 1.06 0.00 -0.72 2.02 -1.12 -3.97 118.70 113.21 1yqw s GLU 262 Ca 0.53 -1.54 0.13 0.00 0.02 0.00 0.00 54.97 54.11 1yqw s GLU 262 Cb 0.41 0.24 0.26 0.00 0.10 0.00 0.00 34.13 35.14 1yqw s GLU 262 CO 0.14 -0.32 1.15 1.04 0.02 0.00 0.00 175.26 177.29 1yqw n GLN 263 N -0.18 2.07 0.00 1.61 1.13 -1.26 -4.40 117.38 116.34 1yqw n GLN 263 Ca -0.02 -1.81 0.12 0.00 -1.94 0.00 0.00 57.00 53.35 1yqw n GLN 263 Cb 0.65 -1.29 0.69 0.00 0.11 0.00 0.00 30.24 30.40 1yqw n GLN 263 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03