#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yqj s MET -2 N 0.00 4.07 0.13 -0.41 -2.45 -1.26 -5.06 119.30 114.32 1yqj s MET -2 Ca 0.00 0.44 0.10 0.00 -1.25 0.00 0.00 55.69 54.97 1yqj s MET -2 Cb 0.00 -3.66 -0.04 0.00 1.25 0.00 0.00 34.83 32.38 1yqj s MET -2 CO 0.00 -0.41 -0.23 -0.51 1.05 0.00 0.00 175.02 174.92 1yqj s LEU -1 N 2.45 2.33 -0.09 4.11 1.43 -1.26 -5.12 118.68 122.53 1yqj s LEU -1 Ca 0.24 -0.74 -0.21 0.00 -1.03 0.00 0.00 54.13 52.39 1yqj s LEU -1 Cb -0.15 -1.03 -0.04 0.00 0.03 0.00 0.00 46.19 45.00 1yqj s LEU -1 CO 0.09 0.10 0.61 -1.61 0.23 0.00 0.00 176.35 175.77 1yqj s GLU 0 N -2.11 4.40 0.00 1.70 0.41 -1.26 -4.95 118.70 116.89 1yqj s GLU 0 Ca 0.11 0.71 0.16 0.00 -0.41 0.00 0.00 54.97 55.54 1yqj s GLU 0 Cb -0.09 -3.44 0.07 0.00 -1.78 0.00 0.00 34.13 28.89 1yqj s GLU 0 CO 0.06 0.10 0.94 -1.33 -0.49 0.00 0.00 175.26 174.54 1yqj n MET 1 N 3.73 1.47 -3.87 1.61 2.81 -1.26 -5.01 117.12 116.60 1yqj n MET 1 Ca -0.04 -1.18 -0.09 0.00 -1.81 0.00 0.00 57.70 54.58 1yqj n MET 1 Cb 0.51 -1.29 -0.05 0.00 -0.71 0.00 0.00 33.22 31.69 1yqj n MET 1 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1yqj s SER 2 N -1.57 -0.16 -0.08 7.83 0.15 -1.26 -5.16 113.70 113.44 1yqj s SER 2 Ca 0.16 -0.70 0.03 0.00 0.70 0.00 0.00 55.95 56.15 1yqj s SER 2 Cb 0.13 0.57 0.01 0.00 -1.71 0.00 0.00 66.02 65.02 1yqj s SER 2 CO 0.28 -1.08 -0.16 -1.10 1.20 0.00 0.00 173.24 172.38 1yqj s GLN 3 N -3.94 2.19 -0.28 5.44 -0.21 -1.26 -5.11 119.66 116.49 1yqj s GLN 3 Ca 0.15 -0.58 -0.29 0.00 0.02 0.00 0.00 55.36 54.66 1yqj s GLN 3 Cb -0.01 -1.75 0.01 0.00 1.00 0.00 0.00 33.01 32.27 1yqj s GLN 3 CO 0.02 0.06 1.11 -2.00 -2.12 0.00 0.00 175.29 172.36 1yqj s GLU 4 N 0.61 4.11 -0.02 2.91 2.56 -1.26 -5.00 118.70 122.61 1yqj s GLU 4 Ca -0.15 1.21 -0.30 0.00 0.00 0.00 0.00 54.97 55.73 1yqj s GLU 4 Cb -0.16 -3.73 -0.04 0.00 2.00 0.00 0.00 34.13 32.19 1yqj s GLU 4 CO 0.05 -0.85 1.23 0.50 -0.56 0.00 0.00 175.26 175.63 1yqj s ARG 5 N 3.60 4.36 0.78 4.30 3.52 -1.26 -5.01 118.95 129.23 1yqj s ARG 5 Ca 0.47 1.75 -0.12 0.00 -0.13 0.00 0.00 55.73 57.69 1yqj s ARG 5 Cb -0.14 -3.51 0.07 0.00 -1.56 0.00 0.00 34.95 29.80 1yqj s ARG 5 CO 0.14 -0.43 1.14 -2.14 -0.81 0.00 0.00 175.30 173.20 1yqj s PRO 6 N 1.98 2.00 -0.07 5.12 0.02 -1.26 -4.98 135.00 137.81 1yqj s PRO 6 Ca 0.58 1.45 -0.25 0.00 0.02 0.00 0.00 61.00 62.80 1yqj s PRO 6 Cb -0.27 -1.85 -0.03 0.00 0.02 0.00 0.00 34.50 32.37 1yqj s PRO 6 CO 0.24 -1.88 0.75 0.99 -0.33 0.00 0.00 177.00 176.78 1yqj s THR 7 N -2.52 5.00 0.06 0.99 2.01 -1.26 -4.97 115.64 114.95 1yqj s THR 7 Ca 0.67 1.55 0.02 0.00 0.31 0.00 0.00 61.69 64.23 1yqj s THR 7 Cb -0.22 -4.09 -0.04 0.00 0.01 0.00 0.00 72.50 68.16 1yqj s THR 7 CO 0.51 0.21 0.12 -0.36 -0.69 0.00 0.00 174.62 174.41 1yqj s PHE 8 N 1.01 3.30 0.05 4.92 0.40 -1.26 -0.97 117.98 125.43 1yqj s PHE 8 Ca 0.40 0.15 0.06 0.00 -0.60 0.00 0.00 56.93 56.93 1yqj s PHE 8 Cb -0.18 -1.68 -0.03 0.00 0.51 0.00 0.00 43.02 41.64 1yqj s PHE 8 CO 0.19 0.55 -0.17 1.52 0.70 0.00 0.00 175.22 178.01 1yqj s TYR 9 N -1.39 1.44 -0.02 0.36 1.13 0.04 -4.89 117.35 114.02 1yqj s TYR 9 Ca 0.30 -0.38 0.08 0.00 -1.41 0.00 0.00 57.07 55.65 1yqj s TYR 9 Cb -0.12 -0.84 -0.02 0.00 -1.10 0.00 0.00 41.96 39.88 1yqj s TYR 9 CO 0.22 0.07 -0.26 0.50 -2.51 0.00 0.00 175.55 173.58 1yqj s ARG 10 N -1.33 2.15 0.15 -3.49 3.52 -1.26 -1.72 118.95 116.98 1yqj s ARG 10 Ca 0.03 -0.92 -0.05 0.00 -0.13 0.00 0.00 55.73 54.66 1yqj s ARG 10 Cb -0.09 -2.06 -0.02 0.00 -1.56 0.00 0.00 34.95 31.22 1yqj s ARG 10 CO 0.02 0.55 0.18 1.14 -0.81 0.00 0.00 175.30 176.38 1yqj s GLN 11 N -0.58 1.06 -0.43 5.12 -2.07 0.52 -4.95 119.66 118.33 1yqj s GLN 11 Ca 0.09 -1.31 -0.15 0.00 -1.82 0.00 0.00 55.36 52.17 1yqj s GLN 11 Cb -0.10 0.31 0.03 0.00 -1.09 0.00 0.00 33.01 32.16 1yqj s GLN 11 CO -0.01 -0.35 0.34 -2.00 -1.32 0.00 0.00 175.29 171.95 1yqj s GLU 12 N -4.01 2.98 0.03 9.60 2.12 -1.26 0.18 118.70 128.34 1yqj s GLU 12 Ca 0.21 -1.08 0.03 0.00 0.36 0.00 0.00 54.97 54.49 1yqj s GLU 12 Cb 0.05 -4.02 -0.02 0.00 0.26 0.00 0.00 34.13 30.41 1yqj s GLU 12 CO 0.01 -0.83 -0.09 -0.51 -0.54 0.00 0.00 175.26 173.30 1yqj s LEU 13 N 1.72 2.16 -1.23 2.70 1.43 0.29 -4.80 118.68 120.96 1yqj s LEU 13 Ca 0.05 -0.40 -0.00 0.00 -1.03 0.00 0.00 54.13 52.76 1yqj s LEU 13 Cb -0.20 -0.30 0.00 0.00 0.03 0.00 0.00 46.19 45.71 1yqj s LEU 13 CO 0.09 -0.07 0.94 0.59 0.23 0.00 0.00 176.35 178.13 1yqj n ASN 14 N 2.00 -1.94 0.00 2.29 3.02 -1.26 -1.04 115.26 118.32 1yqj n ASN 14 Ca -0.19 -0.66 0.00 0.00 -0.03 0.00 0.00 54.58 53.70 1yqj n ASN 14 Cb 0.56 -4.89 0.00 0.00 -0.61 0.00 0.00 39.78 34.84 1yqj n ASN 14 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1yqj n LYS 15 N -4.18 -1.67 -4.25 3.52 5.02 -1.26 -4.85 118.16 110.50 1yqj n LYS 15 Ca -0.29 0.20 -0.17 0.00 -2.02 0.00 0.00 58.31 56.04 1yqj n LYS 15 Cb 0.67 -3.53 -0.11 0.00 -0.02 0.00 0.00 35.03 32.05 1yqj n LYS 15 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1yqj s THR 16 N -0.48 1.29 -0.17 -0.18 -1.32 -0.21 -5.11 115.64 109.46 1yqj s THR 16 Ca 0.00 -1.82 -0.29 0.00 -1.21 0.00 0.00 61.69 58.36 1yqj s THR 16 Cb 0.00 -1.62 -0.00 0.00 -1.51 0.00 0.00 72.50 69.36 1yqj s THR 16 CO 0.00 -0.52 1.09 -0.63 -2.21 0.00 0.00 174.62 172.35 1yqj s ILE 17 N -2.49 4.59 -0.18 5.08 1.09 -1.26 0.11 121.20 128.14 1yqj s ILE 17 Ca 0.11 1.90 -0.07 0.00 -1.10 0.00 0.00 60.65 61.49 1yqj s ILE 17 Cb -0.03 -4.23 -0.04 0.00 -1.06 0.00 0.00 42.46 37.11 1yqj s ILE 17 CO 0.03 -0.10 0.06 0.26 -0.10 0.00 0.00 174.94 175.08 1yqj s TRP 18 N 2.83 3.25 -0.28 3.97 0.52 0.48 -4.90 118.94 124.81 1yqj s TRP 18 Ca 0.48 0.07 0.02 0.00 0.02 0.00 0.00 56.10 56.69 1yqj s TRP 18 Cb -0.18 -2.08 0.08 0.00 -1.15 0.00 0.00 33.47 30.13 1yqj s TRP 18 CO 0.12 0.15 -0.01 -2.00 0.02 0.00 0.00 176.95 175.23 1yqj s GLU 19 N 0.39 1.52 0.13 4.98 2.12 -1.26 -0.35 118.70 126.22 1yqj s GLU 19 Ca 0.03 -1.27 0.04 0.00 0.36 0.00 0.00 54.97 54.13 1yqj s GLU 19 Cb -0.12 -2.69 -0.04 0.00 0.26 0.00 0.00 34.13 31.54 1yqj s GLU 19 CO 0.00 -0.74 -0.09 0.14 -0.54 0.00 0.00 175.26 174.03 1yqj s VAL 20 N 1.27 1.00 0.60 3.70 -7.23 -0.70 -4.69 120.40 114.36 1yqj s VAL 20 Ca 0.00 -1.96 -0.19 0.00 -1.81 0.00 0.00 61.98 58.02 1yqj s VAL 20 Cb -0.19 -1.72 -0.03 0.00 0.56 0.00 0.00 36.38 34.99 1yqj s VAL 20 CO -0.09 -0.75 1.20 -2.65 -0.31 0.00 0.00 175.10 172.49 1yqj n PRO 21 N -0.03 1.19 0.27 4.82 -0.02 -1.26 -0.78 135.00 139.19 1yqj n PRO 21 Ca -0.12 0.45 0.18 0.00 -2.02 0.00 0.00 63.50 62.00 1yqj n PRO 21 Cb 0.60 -2.42 0.98 0.00 -0.02 0.00 0.00 33.50 32.65 1yqj n PRO 21 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1yqj h GLU 22 N 0.75 0.00 0.00 -0.52 5.08 -1.39 -2.08 114.58 116.42 1yqj h GLU 22 Ca -0.50 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1yqj h GLU 22 Cb 1.34 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.59 1yqj h GLU 22 CO 0.53 0.00 -0.01 0.07 -1.00 0.00 0.00 179.01 178.61 1yqj h ARG 23 N 0.00 0.00 -5.16 2.33 0.11 -1.89 -3.39 114.38 106.38 1yqj h ARG 23 Ca 0.00 0.00 -0.66 0.00 0.10 0.00 0.00 59.98 59.42 1yqj h ARG 23 Cb 0.01 0.00 -0.16 0.00 1.11 0.00 0.00 29.97 30.93 1yqj h ARG 23 CO 0.00 0.01 -0.09 0.71 0.10 0.00 0.00 179.97 180.70 1yqj s TYR 24 N -4.51 3.17 0.27 4.08 2.02 -0.78 -1.15 117.35 120.45 1yqj s TYR 24 Ca -0.05 0.04 0.11 0.00 -0.37 0.00 0.00 57.07 56.81 1yqj s TYR 24 Cb 0.15 -2.93 -0.05 0.00 -0.40 0.00 0.00 41.96 38.73 1yqj s TYR 24 CO 0.52 -0.58 -0.14 -0.65 -1.57 0.00 0.00 175.55 173.13 1yqj s GLN 25 N 2.35 1.86 -1.02 -0.62 -1.52 -0.70 -4.83 119.66 115.18 1yqj s GLN 25 Ca 0.17 -1.65 -0.14 0.00 -1.95 0.00 0.00 55.36 51.80 1yqj s GLN 25 Cb -0.16 -1.89 -0.01 0.00 -0.22 0.00 0.00 33.01 30.73 1yqj s GLN 25 CO 0.14 0.35 0.76 0.09 -0.25 0.00 0.00 175.29 176.37 1yqj n ASN 26 N -0.64 -5.75 -4.70 5.90 3.02 -1.26 -1.05 115.26 110.77 1yqj n ASN 26 Ca -0.06 -0.84 -0.42 0.00 -0.03 0.00 0.00 54.58 53.23 1yqj n ASN 26 Cb 0.59 -3.52 -0.03 0.00 -0.61 0.00 0.00 39.78 36.21 1yqj n ASN 26 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1yqj s LEU 27 N -5.77 4.34 -0.04 3.41 1.02 -1.26 -4.32 118.68 116.06 1yqj s LEU 27 Ca 0.32 1.73 -0.01 0.00 0.02 0.00 0.00 54.13 56.20 1yqj s LEU 27 Cb -0.11 -3.57 0.03 0.00 0.02 0.00 0.00 46.19 42.56 1yqj s LEU 27 CO 0.84 -0.38 0.02 -0.94 0.02 0.00 0.00 176.35 175.92 1yqj s SER 28 N 1.10 0.88 0.39 2.29 1.04 -0.10 -4.92 113.70 114.37 1yqj s SER 28 Ca 0.53 0.00 -0.27 0.00 0.48 0.00 0.00 55.95 56.70 1yqj s SER 28 Cb -0.23 -0.22 -0.11 0.00 0.10 0.00 0.00 66.02 65.56 1yqj s SER 28 CO 0.26 -0.17 1.30 -2.65 0.98 0.00 0.00 173.24 172.95 1yqj n PRO 29 N 4.76 2.08 -4.12 4.02 -0.02 -1.26 0.20 135.00 140.65 1yqj n PRO 29 Ca -0.14 0.73 -0.08 0.00 -2.02 0.00 0.00 63.50 61.98 1yqj n PRO 29 Cb 0.50 -2.39 -0.10 0.00 -0.02 0.00 0.00 33.50 31.49 1yqj n PRO 29 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1yqj s VAL 30 N -1.15 0.26 0.00 -1.45 -7.23 -0.54 -4.78 120.40 105.51 1yqj s VAL 30 Ca 0.58 -1.86 0.00 0.00 -1.81 0.00 0.00 61.98 58.89 1yqj s VAL 30 Cb -0.53 -1.71 0.00 0.00 0.56 0.00 0.00 36.38 34.70 1yqj s VAL 30 CO 0.60 -0.82 0.00 0.61 -0.31 0.00 0.00 175.10 175.19 1yqj n GLY 31 N 0.02 1.52 3.59 2.32 0.00 -1.26 -4.27 105.19 107.11 1yqj n GLY 31 Ca -0.11 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.69 1yqj n GLY 31 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1yqj n SER 32 N 0.00 -5.70 0.00 1.61 7.64 -1.26 -0.23 113.62 115.68 1yqj n SER 32 Ca 0.00 -0.78 0.00 0.00 1.01 0.00 0.00 58.87 59.10 1yqj n SER 32 Cb 0.00 -3.09 0.00 0.00 -1.01 0.00 0.00 64.21 60.11 1yqj n SER 32 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1yqj n GLY 33 N -1.72 0.00 0.15 0.23 0.00 -1.26 -4.75 105.19 97.84 1yqj n GLY 33 Ca -0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.65 1yqj n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yqj h ALA 34 N 0.00 -0.02 -0.00 4.61 0.00 -0.88 -3.16 119.26 119.82 1yqj h ALA 34 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 54.91 54.09 1yqj h ALA 34 Cb 0.11 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1yqj h ALA 34 CO 0.00 0.76 -0.10 0.66 0.00 0.00 0.00 179.25 180.57 1yqj n TYR 35 N -3.71 0.00 0.00 0.00 4.01 -1.26 -5.02 117.16 111.19 1yqj n TYR 35 Ca -0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.61 1yqj n TYR 35 Cb 1.03 -0.25 0.00 0.00 -0.31 0.00 0.00 39.34 39.81 1yqj n TYR 35 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1yqj n GLY 36 N 1.32 0.33 3.47 2.72 0.00 -1.19 -4.70 105.19 107.14 1yqj n GLY 36 Ca 0.13 -1.81 -0.44 0.00 0.00 0.00 0.00 46.02 43.90 1yqj n GLY 36 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yqj s SER 37 N -4.00 6.78 -0.06 1.61 0.01 -1.26 -4.29 113.70 112.50 1yqj s SER 37 Ca 0.00 -2.35 0.05 0.00 1.31 0.00 0.00 55.95 54.96 1yqj s SER 37 Cb 0.00 -2.42 -0.00 0.00 0.21 0.00 0.00 66.02 63.81 1yqj s SER 37 CO 0.00 -0.99 -0.21 -0.69 0.41 0.00 0.00 173.24 171.77 1yqj s VAL 38 N 2.52 1.72 -0.04 3.43 1.01 -1.26 -0.84 120.40 126.94 1yqj s VAL 38 Ca 0.38 -0.87 0.06 0.00 0.00 0.00 0.00 61.98 61.55 1yqj s VAL 38 Cb -0.03 -1.47 -0.01 0.00 0.00 0.00 0.00 36.38 34.87 1yqj s VAL 38 CO -0.05 0.48 -0.20 0.00 0.00 0.00 0.00 175.10 175.33 1yqj s ALA 40 N -0.21 3.42 0.28 0.00 0.00 0.13 -1.18 121.76 124.20 1yqj s ALA 40 Ca 0.01 0.12 -0.15 0.00 0.00 0.00 0.00 51.96 51.94 1yqj s ALA 40 Cb -0.11 -2.78 0.01 0.00 0.00 0.00 0.00 23.12 20.24 1yqj s ALA 40 CO 0.01 0.34 0.59 0.00 0.00 0.00 0.00 175.76 176.71 1yqj s ALA 41 N -1.57 -0.52 -0.21 0.00 0.00 -0.26 -0.93 121.76 118.27 1yqj s ALA 41 Ca 0.44 -0.74 -0.03 0.00 0.00 0.00 0.00 51.96 51.63 1yqj s ALA 41 Cb -0.16 0.96 -0.01 0.00 0.00 0.00 0.00 23.12 23.92 1yqj s ALA 41 CO 0.20 -0.92 -0.07 0.12 0.00 0.00 0.00 175.76 175.09 1yqj s PHE 42 N -3.70 2.93 -0.62 0.00 5.36 -0.22 -0.27 117.98 121.46 1yqj s PHE 42 Ca 0.19 -0.98 -0.25 0.00 -0.96 0.00 0.00 56.93 54.93 1yqj s PHE 42 Cb -0.03 -2.06 0.04 0.00 -0.34 0.00 0.00 43.02 40.63 1yqj s PHE 42 CO 0.10 -0.54 1.05 0.34 -1.46 0.00 0.00 175.22 174.71 1yqj s ASP 43 N 1.36 6.28 0.47 6.13 2.15 0.11 -1.71 116.67 131.45 1yqj s ASP 43 Ca 0.04 -0.46 0.21 0.00 0.43 0.00 0.00 52.55 52.77 1yqj s ASP 43 Cb -0.14 -2.47 1.17 0.00 -0.30 0.00 0.00 42.92 41.18 1yqj s ASP 43 CO -0.04 -1.44 2.00 0.71 -0.17 0.00 0.00 175.17 176.23 1yqj h THR 44 N 6.03 0.85 -0.28 1.71 1.35 -1.42 0.59 112.91 121.73 1yqj h THR 44 Ca -0.27 -0.71 -0.17 0.00 -0.55 0.00 0.00 66.41 64.70 1yqj h THR 44 Cb 1.07 1.42 -0.00 0.00 -1.73 0.00 0.00 68.15 68.90 1yqj h THR 44 CO 1.17 0.18 -0.50 0.50 -0.25 0.00 0.00 175.52 176.62 1yqj h LYS 45 N 0.00 0.80 -0.00 4.72 3.64 -1.90 -3.28 116.57 120.55 1yqj h LYS 45 Ca -0.00 -0.48 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 1yqj h LYS 45 Cb 0.40 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 1yqj h LYS 45 CO 0.02 1.11 -0.78 0.25 -2.27 0.00 0.00 179.45 177.78 1yqj n THR 46 N -4.01 0.00 -2.73 1.00 -2.24 -1.12 -4.97 114.28 100.22 1yqj n THR 46 Ca -0.03 -0.11 -0.17 0.00 -2.27 0.00 0.00 64.05 61.47 1yqj n THR 46 Cb 0.60 1.02 0.02 0.00 -2.10 0.00 0.00 70.33 69.86 1yqj n THR 46 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yqj n GLY 47 N 1.40 -0.27 3.45 3.38 0.00 0.20 -5.00 105.19 108.35 1yqj n GLY 47 Ca 0.04 -0.10 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 1yqj n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yqj s LEU 48 N -5.19 2.61 -0.20 0.99 1.43 -0.98 -4.95 118.68 112.40 1yqj s LEU 48 Ca 0.18 -0.34 -0.26 0.00 -1.03 0.00 0.00 54.13 52.69 1yqj s LEU 48 Cb -0.08 -1.52 -0.01 0.00 0.03 0.00 0.00 46.19 44.61 1yqj s LEU 48 CO 0.23 0.30 0.87 -0.13 0.23 0.00 0.00 176.35 177.84 1yqj s ARG 49 N -1.10 4.26 0.31 1.70 1.81 -1.26 0.05 118.95 124.72 1yqj s ARG 49 Ca 0.13 1.05 0.08 0.00 -1.72 0.00 0.00 55.73 55.27 1yqj s ARG 49 Cb -0.10 -3.60 -0.06 0.00 -0.45 0.00 0.00 34.95 30.73 1yqj s ARG 49 CO 0.03 -0.43 -0.07 0.14 -0.68 0.00 0.00 175.30 174.29 1yqj s VAL 50 N 2.51 1.88 -0.24 3.52 -7.23 0.63 -1.61 120.40 119.86 1yqj s VAL 50 Ca 0.38 -2.15 -0.04 0.00 -1.81 0.00 0.00 61.98 58.36 1yqj s VAL 50 Cb -0.16 -2.55 0.00 0.00 0.56 0.00 0.00 36.38 34.23 1yqj s VAL 50 CO 0.10 -0.25 -0.02 0.00 -0.31 0.00 0.00 175.10 174.62 1yqj s ALA 51 N -2.85 2.85 -0.25 1.32 0.00 0.23 -1.10 121.76 121.96 1yqj s ALA 51 Ca 0.31 -1.27 -0.06 0.00 0.00 0.00 0.00 51.96 50.94 1yqj s ALA 51 Cb 0.03 -1.79 -0.02 0.00 0.00 0.00 0.00 23.12 21.35 1yqj s ALA 51 CO 0.14 -0.59 0.04 0.08 0.00 0.00 0.00 175.76 175.44 1yqj s VAL 52 N 1.46 4.04 -0.12 0.00 1.01 -0.33 -1.47 120.40 124.99 1yqj s VAL 52 Ca 0.04 -0.31 -0.02 0.00 0.00 0.00 0.00 61.98 61.69 1yqj s VAL 52 Cb -0.15 -2.90 -0.03 0.00 0.00 0.00 0.00 36.38 33.30 1yqj s VAL 52 CO -0.02 0.33 -0.05 -0.75 0.00 0.00 0.00 175.10 174.61 1yqj s LYS 53 N 1.57 3.32 -0.35 2.72 2.20 0.17 -1.08 119.74 128.29 1yqj s LYS 53 Ca 0.06 -0.52 -0.10 0.00 -0.36 0.00 0.00 55.97 55.05 1yqj s LYS 53 Cb -0.15 -2.80 0.02 0.00 -1.51 0.00 0.00 37.83 33.40 1yqj s LYS 53 CO 0.02 0.42 0.17 0.21 -0.36 0.00 0.00 175.35 175.80 1yqj s LYS 54 N -0.12 2.90 0.13 4.03 2.20 -0.02 -0.40 119.74 128.46 1yqj s LYS 54 Ca 0.02 -1.02 -0.31 0.00 -0.36 0.00 0.00 55.97 54.30 1yqj s LYS 54 Cb -0.13 -3.62 -0.10 0.00 -1.51 0.00 0.00 37.83 32.47 1yqj s LYS 54 CO 0.03 -0.62 1.68 -0.51 -0.36 0.00 0.00 175.35 175.56 1yqj s LEU 55 N 1.53 4.38 -0.21 5.43 1.43 -0.40 -4.50 118.68 126.35 1yqj s LEU 55 Ca 0.02 2.65 -0.15 0.00 -1.03 0.00 0.00 54.13 55.62 1yqj s LEU 55 Cb -0.19 -3.58 -0.04 0.00 0.03 0.00 0.00 46.19 42.41 1yqj s LEU 55 CO 0.06 -0.91 0.38 -0.94 0.23 0.00 0.00 176.35 175.16 1yqj s SER 56 N 1.88 6.41 -0.91 2.29 1.04 -1.26 -4.45 113.70 118.69 1yqj s SER 56 Ca 0.74 0.48 -0.08 0.00 0.48 0.00 0.00 55.95 57.57 1yqj s SER 56 Cb -0.44 -2.22 0.01 0.00 0.10 0.00 0.00 66.02 63.47 1yqj s SER 56 CO 0.33 -0.06 0.64 0.54 0.98 0.00 0.00 173.24 175.67 1yqj n ARG 57 N 4.46 -1.26 0.23 4.02 1.74 -1.26 -4.87 116.66 119.73 1yqj n ARG 57 Ca -0.09 0.69 0.12 0.00 -0.77 0.00 0.00 57.85 57.80 1yqj n ARG 57 Cb 0.51 -2.86 0.38 0.00 -1.02 0.00 0.00 32.46 29.48 1yqj n ARG 57 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1yqj h PRO 58 N -0.76 0.00 -1.24 5.56 0.13 -1.85 -3.33 132.00 130.52 1yqj h PRO 58 Ca -0.58 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.05 1yqj h PRO 58 Cb 1.35 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 32.07 1yqj h PRO 58 CO 0.40 0.11 -0.90 1.19 -0.23 0.00 0.00 178.00 178.57 1yqj n PHE 59 N -3.18 2.54 1.02 1.56 3.72 -1.26 -2.25 117.46 119.61 1yqj n PHE 59 Ca 0.02 -2.89 0.12 0.00 -0.05 0.00 0.00 57.45 54.65 1yqj n PHE 59 Cb 0.46 -0.20 0.30 0.00 -0.94 0.00 0.00 39.48 39.10 1yqj n PHE 59 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1yqj n GLN 60 N -0.37 0.06 -3.65 -1.08 10.64 -1.25 -4.85 117.38 116.87 1yqj n GLN 60 Ca 0.28 -0.03 -0.10 0.00 -1.83 0.00 0.00 57.00 55.33 1yqj n GLN 60 Cb 0.74 -1.50 -0.02 0.00 -0.86 0.00 0.00 30.24 28.60 1yqj n GLN 60 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.06 173.69 1yqj s SER 61 N -2.96 -0.39 0.24 2.61 1.04 -1.26 -5.01 113.70 107.97 1yqj s SER 61 Ca 0.12 -0.33 -0.05 0.00 0.48 0.00 0.00 55.95 56.17 1yqj s SER 61 Cb 0.18 0.65 0.26 0.00 0.10 0.00 0.00 66.02 67.21 1yqj s SER 61 CO 0.67 -1.14 1.84 0.40 0.98 0.00 0.00 173.24 175.98 1yqj h ILE 62 N 2.03 1.25 -0.25 -1.02 2.04 -1.95 0.97 117.51 120.57 1yqj h ILE 62 Ca -0.27 -0.71 -0.00 0.00 1.00 0.00 0.00 64.86 64.88 1yqj h ILE 62 Cb 1.28 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1yqj h ILE 62 CO 0.32 0.30 0.14 0.40 0.00 0.00 0.00 178.15 179.31 1yqj h ILE 63 N 1.12 1.12 -0.15 -0.67 1.08 -1.97 -2.16 117.51 115.87 1yqj h ILE 63 Ca 0.27 -0.31 -0.21 0.00 -0.39 0.00 0.00 64.86 64.21 1yqj h ILE 63 Cb 0.13 0.87 0.01 0.00 -3.07 0.00 0.00 36.82 34.75 1yqj h ILE 63 CO -0.03 0.12 -0.74 0.45 -0.69 0.00 0.00 178.15 177.25 1yqj h HIS 64 N 0.30 0.97 -0.76 1.37 3.86 -1.79 -2.17 115.15 116.93 1yqj h HIS 64 Ca 0.09 -0.42 -0.01 0.00 -1.16 0.00 0.00 60.37 58.88 1yqj h HIS 64 Cb 0.06 -0.15 -0.04 0.00 1.06 0.00 0.00 27.41 28.34 1yqj h HIS 64 CO -0.03 1.24 0.45 0.00 0.86 0.00 0.00 177.93 180.45 1yqj h ALA 65 N 0.65 1.37 -0.12 2.45 0.00 -0.35 0.94 119.26 124.20 1yqj h ALA 65 Ca -0.04 -0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.61 1yqj h ALA 65 Cb 1.36 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 1yqj h ALA 65 CO 0.15 0.54 -0.66 -0.22 0.00 0.00 0.00 179.25 179.06 1yqj h LYS 66 N 1.05 0.47 -0.32 0.00 3.64 -1.35 -1.83 116.57 118.23 1yqj h LYS 66 Ca 0.27 -0.34 -0.04 0.00 -1.27 0.00 0.00 60.65 59.27 1yqj h LYS 66 Cb -0.04 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1yqj h LYS 66 CO -0.05 0.97 0.04 0.00 -2.27 0.00 0.00 179.45 178.14 1yqj h ARG 67 N 0.34 0.53 -0.56 1.90 3.08 -0.71 0.24 114.38 119.19 1yqj h ARG 67 Ca -0.02 -0.14 0.03 0.00 0.07 0.00 0.00 59.98 59.92 1yqj h ARG 67 Cb 1.22 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 31.17 1yqj h ARG 67 CO 0.12 0.62 0.33 1.15 -1.07 0.00 0.00 179.97 181.12 1yqj h THR 68 N 0.35 1.03 -0.60 2.04 2.02 -0.79 0.24 112.91 117.20 1yqj h THR 68 Ca 0.09 -0.22 -0.09 0.00 0.77 0.00 0.00 66.41 66.97 1yqj h THR 68 Cb 0.36 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1yqj h THR 68 CO 0.01 0.12 0.03 0.22 0.37 0.00 0.00 175.52 176.26 1yqj h TYR 69 N 0.64 1.11 -0.57 3.16 3.20 -1.05 -1.89 116.97 121.57 1yqj h TYR 69 Ca 0.23 -0.17 -0.06 0.00 3.14 0.00 0.00 58.73 61.87 1yqj h TYR 69 Cb 0.06 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 38.01 1yqj h TYR 69 CO -0.07 0.97 0.13 -0.09 -1.64 0.00 0.00 178.16 177.46 1yqj h ARG 70 N 0.95 0.91 -0.12 1.82 2.43 0.48 -1.31 114.38 119.55 1yqj h ARG 70 Ca 0.18 -0.22 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1yqj h ARG 70 Cb 0.51 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1yqj h ARG 70 CO 0.02 0.85 0.03 1.49 -1.51 0.00 0.00 179.97 180.86 1yqj h GLU 71 N 0.81 0.18 -0.43 0.20 4.81 -0.40 -1.58 114.58 118.17 1yqj h GLU 71 Ca 0.18 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.40 1yqj h GLU 71 Cb 0.36 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.67 1yqj h GLU 71 CO 0.00 0.33 0.22 1.25 -0.73 0.00 0.00 179.01 180.08 1yqj h LEU 72 N -0.00 0.32 -0.77 1.64 6.46 -1.23 0.12 115.31 121.84 1yqj h LEU 72 Ca 0.04 0.02 -0.00 0.00 -0.12 0.00 0.00 57.88 57.82 1yqj h LEU 72 Cb 0.23 -0.04 -0.04 0.00 -0.73 0.00 0.00 40.66 40.08 1yqj h LEU 72 CO -0.00 0.23 0.47 0.03 -0.62 0.00 0.00 178.44 178.55 1yqj h ARG 73 N 0.44 1.04 0.25 1.25 2.47 -1.15 -0.35 114.38 118.32 1yqj h ARG 73 Ca 0.19 -0.09 -0.01 0.00 -1.26 0.00 0.00 59.98 58.81 1yqj h ARG 73 Cb 0.09 -0.22 0.00 0.00 -1.65 0.00 0.00 29.97 28.19 1yqj h ARG 73 CO -0.13 0.72 -0.12 1.25 0.56 0.00 0.00 179.97 182.26 1yqj h LEU 74 N 1.05 -0.28 -1.74 3.04 6.46 -0.68 -2.54 115.31 120.62 1yqj h LEU 74 Ca 0.28 -0.14 -0.01 0.00 -0.12 0.00 0.00 57.88 57.89 1yqj h LEU 74 Cb -0.05 0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 39.94 1yqj h LEU 74 CO -0.05 -0.02 0.09 -0.07 -0.62 0.00 0.00 178.44 177.77 1yqj h LEU 75 N -0.54 0.22 -0.71 2.25 3.38 -0.63 -1.59 115.31 117.70 1yqj h LEU 75 Ca -0.03 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.83 1yqj h LEU 75 Cb 0.40 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1yqj h LEU 75 CO 0.06 0.20 -0.46 0.11 0.09 0.00 0.00 178.44 178.43 1yqj h LYS 76 N 0.26 0.00 0.17 1.13 1.57 -0.97 -3.28 116.57 115.45 1yqj h LYS 76 Ca 0.07 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.55 1yqj h LYS 76 Cb 0.03 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.36 1yqj h LYS 76 CO -0.01 0.46 -1.32 1.25 -0.57 0.00 0.00 179.45 179.27 1yqj h HIS 77 N 0.00 0.66 -2.22 -1.35 2.76 -0.87 -3.46 115.15 110.68 1yqj h HIS 77 Ca -0.00 -0.48 -0.58 0.00 -2.20 0.00 0.00 60.37 57.11 1yqj h HIS 77 Cb 1.05 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.97 1yqj h HIS 77 CO 0.00 1.37 1.42 -1.64 -1.30 0.00 0.00 177.93 177.78 1yqj s MET 78 N -2.65 3.14 -0.49 5.26 -1.94 -0.96 -4.93 119.30 116.73 1yqj s MET 78 Ca -0.06 1.76 0.04 0.00 -1.71 0.00 0.00 55.69 55.73 1yqj s MET 78 Cb 0.06 -4.32 0.17 0.00 2.01 0.00 0.00 34.83 32.75 1yqj s MET 78 CO 0.91 -2.09 0.39 1.63 -0.01 0.00 0.00 175.02 175.85 1yqj n LYS 79 N 8.66 0.66 -3.71 2.03 5.02 -1.26 -4.38 118.16 125.18 1yqj n LYS 79 Ca 0.27 -3.54 -0.14 0.00 -2.02 0.00 0.00 58.31 52.89 1yqj n LYS 79 Cb 0.46 -1.83 -0.09 0.00 -0.02 0.00 0.00 35.03 33.56 1yqj n LYS 79 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1yqj s HIS 80 N -0.40 -0.38 0.45 2.13 2.46 -1.26 -5.05 115.29 113.23 1yqj s HIS 80 Ca 0.31 0.80 0.11 0.00 0.47 0.00 0.00 55.06 56.75 1yqj s HIS 80 Cb 0.02 0.17 1.02 0.00 -0.13 0.00 0.00 32.58 33.66 1yqj s HIS 80 CO -0.19 -0.34 2.08 0.93 -2.47 0.00 0.00 174.74 174.75 1yqj h GLU 81 N 4.50 0.34 -0.63 2.88 5.08 -1.98 -2.47 114.58 122.31 1yqj h GLU 81 Ca -0.28 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.06 1yqj h GLU 81 Cb 1.17 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.35 1yqj h GLU 81 CO 0.32 0.23 0.00 0.09 -1.00 0.00 0.00 179.01 178.65 1yqj n ASN 82 N -4.49 5.13 -3.96 1.42 5.03 -1.26 -4.71 115.26 112.43 1yqj n ASN 82 Ca 0.02 -2.72 -0.16 0.00 0.87 0.00 0.00 54.58 52.59 1yqj n ASN 82 Cb 0.11 -0.64 -0.15 0.00 -1.02 0.00 0.00 39.78 38.08 1yqj n ASN 82 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1yqj s VAL 83 N -2.38 0.44 0.19 2.41 1.01 -0.93 -0.74 120.40 120.40 1yqj s VAL 83 Ca 0.50 -0.22 -0.32 0.00 0.00 0.00 0.00 61.98 61.94 1yqj s VAL 83 Cb 0.36 -0.38 -0.11 0.00 0.00 0.00 0.00 36.38 36.25 1yqj s VAL 83 CO 0.18 0.13 1.71 -0.51 0.00 0.00 0.00 175.10 176.61 1yqj s ILE 84 N -0.04 2.21 0.45 2.22 2.07 0.28 -4.50 121.20 123.90 1yqj s ILE 84 Ca 0.01 0.10 0.03 0.00 -1.41 0.00 0.00 60.65 59.38 1yqj s ILE 84 Cb -0.03 -3.06 -0.03 0.00 0.13 0.00 0.00 42.46 39.46 1yqj s ILE 84 CO -0.00 0.01 0.04 -0.83 -1.91 0.00 0.00 174.94 172.25 1yqj s GLY 85 N 1.43 2.74 -0.22 1.50 0.00 -1.26 -4.80 107.32 106.70 1yqj s GLY 85 Ca 0.75 -1.08 -0.09 0.00 0.00 0.00 0.00 44.72 44.30 1yqj s GLY 85 CO 0.32 -2.05 0.10 -2.27 0.00 0.00 0.00 173.10 169.21 1yqj s LEU 86 N -3.74 3.86 -0.05 0.66 2.96 -1.24 -4.60 118.68 116.54 1yqj s LEU 86 Ca 0.18 0.03 0.17 0.00 -0.22 0.00 0.00 54.13 54.29 1yqj s LEU 86 Cb 0.04 -2.01 -0.21 0.00 0.50 0.00 0.00 46.19 44.50 1yqj s LEU 86 CO 0.10 0.09 0.53 0.18 -1.32 0.00 0.00 176.35 175.93 1yqj n LEU 87 N 4.13 0.53 -3.60 -0.68 4.77 0.11 -4.73 117.00 117.53 1yqj n LEU 87 Ca -0.16 0.24 -0.07 0.00 -0.03 0.00 0.00 56.01 55.99 1yqj n LEU 87 Cb 0.52 0.21 -0.04 0.00 -2.33 0.00 0.00 43.42 41.78 1yqj n LEU 87 CO 0.34 0.29 0.91 -0.62 -1.33 0.00 0.00 177.39 176.98 1yqj s ASP 88 N -5.63 -0.25 -0.05 -1.43 2.15 -1.15 -4.60 116.67 105.71 1yqj s ASP 88 Ca -0.06 0.24 -0.03 0.00 0.43 0.00 0.00 52.55 53.14 1yqj s ASP 88 Cb 0.08 0.21 0.02 0.00 -0.30 0.00 0.00 42.92 42.93 1yqj s ASP 88 CO 0.83 -0.25 0.11 0.54 -0.17 0.00 0.00 175.17 176.23 1yqj s VAL 89 N -1.25 -0.02 0.26 1.11 0.11 -1.26 -0.04 120.40 119.30 1yqj s VAL 89 Ca 0.03 0.09 -0.19 0.00 -2.93 0.00 0.00 61.98 58.97 1yqj s VAL 89 Cb -0.01 -0.18 0.02 0.00 -1.53 0.00 0.00 36.38 34.69 1yqj s VAL 89 CO -0.02 0.04 0.65 0.72 -3.33 0.00 0.00 175.10 173.15 1yqj s PHE 90 N 0.58 -0.12 -0.04 1.54 -0.12 -0.45 -4.92 117.98 114.46 1yqj s PHE 90 Ca -0.04 -0.30 -0.09 0.00 -0.05 0.00 0.00 56.93 56.45 1yqj s PHE 90 Cb -0.06 0.58 0.01 0.00 -0.63 0.00 0.00 43.02 42.92 1yqj s PHE 90 CO -0.02 -1.14 0.20 -0.08 -0.05 0.00 0.00 175.22 174.13 1yqj s THR 91 N -3.92 0.04 -1.25 -4.49 -1.32 -1.26 -0.82 115.64 102.62 1yqj s THR 91 Ca 0.12 -0.31 0.28 0.00 -1.21 0.00 0.00 61.69 60.57 1yqj s THR 91 Cb -0.04 -0.40 0.38 0.00 -1.51 0.00 0.00 72.50 70.93 1yqj s THR 91 CO 0.05 -0.17 1.93 -0.81 -2.21 0.00 0.00 174.62 173.41 1yqj n PRO 92 N 2.18 0.24 -2.16 7.08 -0.05 -1.26 -4.86 135.00 136.17 1yqj n PRO 92 Ca -0.17 0.03 -0.41 0.00 -0.05 0.00 0.00 63.50 62.89 1yqj n PRO 92 Cb 0.57 -1.50 -0.03 0.00 -0.05 0.00 0.00 33.50 32.50 1yqj n PRO 92 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 1yqj s ALA 93 N -2.75 3.52 -0.51 0.55 0.00 -1.26 -4.93 121.76 116.38 1yqj s ALA 93 Ca 0.21 1.20 0.23 0.00 0.00 0.00 0.00 51.96 53.61 1yqj s ALA 93 Cb 0.18 -3.48 0.20 0.00 0.00 0.00 0.00 23.12 20.03 1yqj s ALA 93 CO 0.46 -0.59 1.20 0.00 0.00 0.00 0.00 175.76 176.83 1yqj h ARG 94 N 4.18 0.00 -3.78 0.00 -0.00 -1.89 -3.48 114.38 109.41 1yqj h ARG 94 Ca -0.47 0.00 -0.09 0.00 -0.50 0.00 0.00 59.98 58.92 1yqj h ARG 94 Cb 1.22 0.00 -0.13 0.00 0.00 0.00 0.00 29.97 31.06 1yqj h ARG 94 CO 0.70 0.00 -0.29 -1.54 0.00 0.00 0.00 179.97 178.84 1yqj s SER 95 N -4.55 0.02 0.32 7.04 1.04 -1.26 -5.03 113.70 111.28 1yqj s SER 95 Ca 0.04 -0.73 -0.00 0.00 0.48 0.00 0.00 55.95 55.73 1yqj s SER 95 Cb 0.12 0.42 0.51 0.00 0.10 0.00 0.00 66.02 67.17 1yqj s SER 95 CO 0.75 -0.85 1.96 0.25 0.98 0.00 0.00 173.24 176.33 1yqj h LEU 96 N 2.57 0.84 -1.13 2.42 5.85 -1.95 -1.14 115.31 122.76 1yqj h LEU 96 Ca -0.32 -0.04 0.11 0.00 0.84 0.00 0.00 57.88 58.47 1yqj h LEU 96 Cb 1.22 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.97 1yqj h LEU 96 CO 0.50 0.64 0.60 -0.33 -0.34 0.00 0.00 178.44 179.51 1yqj h GLU 97 N 0.97 0.89 -0.47 1.25 3.07 -2.01 -1.01 114.58 117.27 1yqj h GLU 97 Ca 0.25 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.06 1yqj h GLU 97 Cb -0.05 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 27.66 1yqj h GLU 97 CO -0.05 0.59 0.00 -0.85 -1.40 0.00 0.00 179.01 177.30 1yqj n GLU 98 N -4.57 2.50 -2.25 2.33 0.28 -0.71 -4.96 120.64 113.26 1yqj n GLU 98 Ca 0.17 -2.28 -0.42 0.00 -0.16 0.00 0.00 57.16 54.47 1yqj n GLU 98 Cb 0.34 -1.52 -0.03 0.00 1.43 0.00 0.00 31.44 31.67 1yqj n GLU 98 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 1yqj s PHE 99 N -1.39 3.27 0.10 -1.84 5.36 -0.39 -4.69 117.98 118.40 1yqj s PHE 99 Ca 0.41 1.05 0.00 0.00 -0.96 0.00 0.00 56.93 57.42 1yqj s PHE 99 Cb 0.23 -3.60 0.00 0.00 -0.34 0.00 0.00 43.02 39.31 1yqj s PHE 99 CO 0.31 -2.05 0.00 0.09 -1.46 0.00 0.00 175.22 172.11 1yqj n ASN 100 N 4.07 -0.58 -4.89 6.13 3.02 -1.26 -5.03 115.26 116.72 1yqj n ASN 100 Ca 0.11 0.18 -0.33 0.00 -0.03 0.00 0.00 54.58 54.51 1yqj n ASN 100 Cb 0.44 0.75 -0.05 0.00 -0.61 0.00 0.00 39.78 40.31 1yqj n ASN 100 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1yqj s ASP 101 N -3.50 6.53 -0.07 6.41 -0.00 -1.26 -4.73 116.67 120.04 1yqj s ASP 101 Ca 0.00 0.63 0.01 0.00 -0.00 0.00 0.00 52.55 53.19 1yqj s ASP 101 Cb 0.00 -2.11 0.02 0.00 -0.00 0.00 0.00 42.92 40.83 1yqj s ASP 101 CO 0.00 0.11 -0.08 -0.69 -0.00 0.00 0.00 175.17 174.50 1yqj s VAL 102 N -1.55 0.92 -0.10 -1.27 1.01 -1.26 -4.55 120.40 113.61 1yqj s VAL 102 Ca 0.37 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 62.05 1yqj s VAL 102 Cb -0.13 -0.90 -0.02 0.00 0.00 0.00 0.00 36.38 35.33 1yqj s VAL 102 CO 0.22 0.32 -0.14 -0.31 0.00 0.00 0.00 175.10 175.20 1yqj s TYR 103 N 1.08 2.77 0.10 5.22 1.51 0.00 -1.27 117.35 126.76 1yqj s TYR 103 Ca -0.07 -0.45 0.08 0.00 -1.01 0.00 0.00 57.07 55.62 1yqj s TYR 103 Cb -0.14 -1.76 -0.04 0.00 -0.11 0.00 0.00 41.96 39.91 1yqj s TYR 103 CO -0.01 -0.05 -0.17 -0.51 -1.11 0.00 0.00 175.55 173.70 1yqj s LEU 104 N -0.08 2.72 -0.03 -1.29 1.43 0.46 -1.34 118.68 120.55 1yqj s LEU 104 Ca -0.02 -0.51 0.02 0.00 -1.03 0.00 0.00 54.13 52.59 1yqj s LEU 104 Cb -0.14 -1.57 0.01 0.00 0.03 0.00 0.00 46.19 44.52 1yqj s LEU 104 CO 0.04 0.20 -0.07 -0.69 0.23 0.00 0.00 176.35 176.05 1yqj s VAL 105 N -1.10 0.64 0.29 -1.59 1.01 0.95 -0.66 120.40 119.94 1yqj s VAL 105 Ca 0.18 -0.27 -0.07 0.00 0.00 0.00 0.00 61.98 61.82 1yqj s VAL 105 Cb -0.11 -0.59 -0.00 0.00 0.00 0.00 0.00 36.38 35.68 1yqj s VAL 105 CO 0.09 0.21 0.44 0.28 0.00 0.00 0.00 175.10 176.13 1yqj s THR 106 N 0.32 0.00 0.48 3.92 -1.32 -0.54 0.04 115.64 118.54 1yqj s THR 106 Ca -0.04 -1.55 -0.23 0.00 -1.21 0.00 0.00 61.69 58.65 1yqj s THR 106 Cb -0.09 -2.46 -0.07 0.00 -1.51 0.00 0.00 72.50 68.38 1yqj s THR 106 CO 0.00 0.00 1.28 -1.00 -2.21 0.00 0.00 174.62 172.69 1yqj s HIS 107 N -3.55 2.61 -0.16 9.09 3.76 -1.26 0.78 115.29 126.56 1yqj s HIS 107 Ca 0.28 1.43 -0.29 0.00 -0.15 0.00 0.00 55.06 56.33 1yqj s HIS 107 Cb 0.00 -3.63 -0.00 0.00 1.11 0.00 0.00 32.58 30.06 1yqj s HIS 107 CO 0.14 -2.24 1.04 -1.17 -0.85 0.00 0.00 174.74 171.66 1yqj s LEU 108 N -3.11 4.19 0.00 0.89 2.96 -0.63 -4.27 118.68 118.71 1yqj s LEU 108 Ca 0.65 1.49 -0.01 0.00 -0.22 0.00 0.00 54.13 56.04 1yqj s LEU 108 Cb -0.36 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 42.74 1yqj s LEU 108 CO 0.44 -0.55 0.13 -0.04 -1.32 0.00 0.00 176.35 175.00 1yqj s MET 109 N 2.55 3.23 -0.13 1.98 -1.94 -1.26 -4.95 119.30 118.78 1yqj s MET 109 Ca 0.47 -0.43 -0.16 0.00 -1.71 0.00 0.00 55.69 53.86 1yqj s MET 109 Cb -0.17 -2.96 -0.25 0.00 2.01 0.00 0.00 34.83 33.45 1yqj s MET 109 CO 0.13 0.65 0.46 0.78 -0.01 0.00 0.00 175.02 177.03 1yqj h GLY 110 N 3.87 0.21 -2.77 -0.03 0.00 -1.96 -3.50 103.07 98.89 1yqj h GLY 110 Ca -0.49 -0.53 -0.03 0.00 0.00 0.00 0.00 47.33 46.28 1yqj h GLY 110 CO 0.66 0.47 0.02 0.00 0.00 0.00 0.00 176.54 177.69 1yqj s ALA 111 N -2.45 -1.01 0.62 3.60 0.00 -1.24 -5.07 121.76 116.22 1yqj s ALA 111 Ca -0.22 -0.10 0.02 0.00 0.00 0.00 0.00 51.96 51.65 1yqj s ALA 111 Cb 0.05 0.82 0.08 0.00 0.00 0.00 0.00 23.12 24.07 1yqj s ALA 111 CO 0.72 -0.76 0.87 0.16 0.00 0.00 0.00 175.76 176.75 1yqj s ASP 112 N -2.84 4.85 0.36 0.00 1.47 -1.26 -0.19 116.67 119.07 1yqj s ASP 112 Ca 0.07 -0.30 0.09 0.00 1.18 0.00 0.00 52.55 53.59 1yqj s ASP 112 Cb -0.00 -0.32 0.84 0.00 -0.34 0.00 0.00 42.92 43.09 1yqj s ASP 112 CO -0.06 -1.47 1.88 0.25 0.68 0.00 0.00 175.17 176.45 1yqj h LEU 113 N -0.16 0.62 0.12 2.11 5.85 -0.36 -2.28 115.31 121.22 1yqj h LEU 113 Ca -0.38 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.38 1yqj h LEU 113 Cb 1.28 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 1yqj h LEU 113 CO 0.45 0.33 -0.14 0.78 -0.34 0.00 0.00 178.44 179.52 1yqj h ASN 114 N 0.67 -0.37 -0.75 1.25 2.35 -1.86 -1.64 115.58 115.23 1yqj h ASN 114 Ca 0.42 0.04 0.05 0.00 -0.55 0.00 0.00 56.30 56.26 1yqj h ASN 114 Cb 0.68 0.13 -0.05 0.00 0.05 0.00 0.00 38.32 39.13 1yqj h ASN 114 CO -0.18 -0.21 0.45 0.78 -1.65 0.00 0.00 177.43 176.62 1yqj h ASN 115 N -0.29 0.71 0.22 5.81 -0.26 -1.80 -1.06 115.58 118.91 1yqj h ASN 115 Ca 0.01 0.01 0.01 0.00 -0.56 0.00 0.00 56.30 55.77 1yqj h ASN 115 Cb 0.29 -0.13 -0.03 0.00 -1.06 0.00 0.00 38.32 37.39 1yqj h ASN 115 CO -0.05 0.47 -0.28 0.40 -1.06 0.00 0.00 177.43 176.91 1yqj h ILE 116 N 0.85 0.40 -0.60 2.81 1.08 -1.18 -1.82 117.51 119.05 1yqj h ILE 116 Ca 0.32 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.83 1yqj h ILE 116 Cb 0.12 0.40 -0.03 0.00 -3.07 0.00 0.00 36.82 34.24 1yqj h ILE 116 CO -0.15 0.00 0.39 0.58 -0.69 0.00 0.00 178.15 178.28 1yqj h VAL 117 N -0.56 1.05 0.00 1.67 2.07 -0.88 -1.78 116.25 117.82 1yqj h VAL 117 Ca 0.00 -0.23 -0.10 0.00 0.82 0.00 0.00 66.70 67.19 1yqj h VAL 117 Cb 0.54 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 1yqj h VAL 117 CO -0.10 0.12 -0.50 0.50 0.02 0.00 0.00 177.57 177.61 1yqj h LYS 118 N 0.66 0.00 0.00 1.57 3.11 -0.79 -3.22 116.57 117.90 1yqj h LYS 118 Ca 0.24 0.00 -0.06 0.00 -2.81 0.00 0.00 60.65 58.02 1yqj h LYS 118 Cb 0.15 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.37 1yqj h LYS 118 CO -0.07 0.50 -0.58 0.00 -2.81 0.00 0.00 179.45 176.49 1yqj s GLN 120 N -3.11 1.62 -0.25 0.00 0.00 -1.05 -5.12 119.66 111.76 1yqj s GLN 120 Ca 0.03 -0.85 -0.21 0.00 -0.00 0.00 0.00 55.36 54.33 1yqj s GLN 120 Cb 0.07 0.58 -0.02 0.00 0.00 0.00 0.00 33.01 33.65 1yqj s GLN 120 CO 0.74 -0.74 0.68 0.21 0.00 0.00 0.00 175.29 176.19 1yqj s LYS 121 N -3.82 4.13 0.11 9.60 2.36 -1.26 -4.59 119.74 126.28 1yqj s LYS 121 Ca 0.09 0.65 -0.24 0.00 -2.55 0.00 0.00 55.97 53.92 1yqj s LYS 121 Cb -0.05 -3.65 -0.07 0.00 -1.05 0.00 0.00 37.83 33.02 1yqj s LYS 121 CO 0.02 -0.43 0.73 -0.51 1.55 0.00 0.00 175.35 176.71 1yqj s LEU 122 N 2.57 4.54 0.62 5.43 1.43 -1.26 -5.06 118.68 126.95 1yqj s LEU 122 Ca 0.29 1.52 -0.10 0.00 -1.03 0.00 0.00 54.13 54.80 1yqj s LEU 122 Cb -0.15 -3.20 -0.03 0.00 0.03 0.00 0.00 46.19 42.83 1yqj s LEU 122 CO 0.08 0.17 1.01 0.42 0.23 0.00 0.00 176.35 178.26 1yqj s THR 123 N -0.84 4.54 0.48 5.49 -4.23 -1.26 -4.88 115.64 114.94 1yqj s THR 123 Ca 0.35 0.73 0.14 0.00 -1.18 0.00 0.00 61.69 61.74 1yqj s THR 123 Cb -0.22 -3.81 0.29 0.00 1.34 0.00 0.00 72.50 70.11 1yqj s THR 123 CO 0.24 -1.03 2.08 -0.78 -0.54 0.00 0.00 174.62 174.59 1yqj h ASP 124 N -0.30 0.19 -0.68 3.99 3.58 -1.98 0.13 116.42 121.35 1yqj h ASP 124 Ca -0.44 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.01 1yqj h ASP 124 Cb 1.20 -0.04 -0.03 0.00 1.72 0.00 0.00 39.33 42.17 1yqj h ASP 124 CO 0.62 0.13 0.44 -0.78 -2.88 0.00 0.00 179.24 176.77 1yqj h ASP 125 N 0.22 0.78 0.10 2.28 3.58 -1.99 0.27 116.42 121.67 1yqj h ASP 125 Ca 0.12 -0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.54 1yqj h ASP 125 Cb 0.20 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 41.06 1yqj h ASP 125 CO -0.02 0.57 -0.05 0.45 -2.88 0.00 0.00 179.24 177.32 1yqj h HIS 126 N 0.92 -0.12 -0.82 0.28 3.86 -1.15 -1.00 115.15 117.12 1yqj h HIS 126 Ca 0.25 -0.00 0.05 0.00 -1.16 0.00 0.00 60.37 59.50 1yqj h HIS 126 Cb -0.09 0.04 -0.05 0.00 1.06 0.00 0.00 27.41 28.36 1yqj h HIS 126 CO -0.02 -0.02 0.51 0.28 0.86 0.00 0.00 177.93 179.54 1yqj h VAL 127 N -0.19 1.08 0.24 2.45 2.07 -0.83 0.15 116.25 121.22 1yqj h VAL 127 Ca -0.01 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1yqj h VAL 127 Cb 0.16 0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 29.94 1yqj h VAL 127 CO 0.02 0.18 -0.21 1.56 0.02 0.00 0.00 177.57 179.14 1yqj h GLN 128 N 0.96 -0.45 -0.71 1.57 4.20 -0.18 -0.71 115.11 119.78 1yqj h GLN 128 Ca 0.34 0.03 -0.04 0.00 0.06 0.00 0.00 58.65 59.04 1yqj h GLN 128 Cb 0.09 0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.94 1yqj h GLN 128 CO -0.14 -0.30 0.27 0.35 -0.67 0.00 0.00 178.83 178.33 1yqj h PHE 129 N -0.47 1.08 -0.02 2.96 3.57 -0.81 -1.31 116.94 121.94 1yqj h PHE 129 Ca -0.01 -0.08 -0.00 0.00 3.53 0.00 0.00 57.97 61.41 1yqj h PHE 129 Cb 0.43 -0.32 -0.00 0.00 2.79 0.00 0.00 35.95 38.84 1yqj h PHE 129 CO -0.14 0.83 -0.00 -0.07 -2.23 0.00 0.00 178.31 176.70 1yqj h LEU 130 N 1.04 0.03 -1.45 0.59 3.38 -0.48 -2.31 115.31 116.11 1yqj h LEU 130 Ca 0.24 -0.32 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 1yqj h LEU 130 Cb 0.22 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1yqj h LEU 130 CO -0.02 0.35 -0.27 0.40 0.09 0.00 0.00 178.44 178.98 1yqj h ILE 131 N -0.29 1.00 -0.18 1.22 1.08 -1.08 -2.34 117.51 116.91 1yqj h ILE 131 Ca 0.00 -1.01 -0.01 0.00 -0.39 0.00 0.00 64.86 63.45 1yqj h ILE 131 Cb 0.33 1.58 -0.01 0.00 -3.07 0.00 0.00 36.82 35.65 1yqj h ILE 131 CO 0.00 0.27 0.06 0.22 -0.69 0.00 0.00 178.15 178.01 1yqj h TYR 132 N 0.00 0.30 -0.67 1.37 3.20 -1.08 -2.08 116.97 118.01 1yqj h TYR 132 Ca -0.00 -0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.80 1yqj h TYR 132 Cb 0.55 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.71 1yqj h TYR 132 CO 0.00 0.39 0.25 1.96 -1.64 0.00 0.00 178.16 179.12 1yqj h GLN 133 N 0.12 1.00 -0.48 1.82 4.20 -1.12 0.30 115.11 120.95 1yqj h GLN 133 Ca 0.06 -0.18 -0.01 0.00 0.06 0.00 0.00 58.65 58.59 1yqj h GLN 133 Cb 0.23 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 1yqj h GLN 133 CO -0.00 0.83 0.27 0.82 -0.67 0.00 0.00 178.83 180.07 1yqj h ILE 134 N 0.97 1.16 0.00 2.54 2.04 -1.22 -1.01 117.51 121.99 1yqj h ILE 134 Ca 0.22 -0.41 -0.12 0.00 1.00 0.00 0.00 64.86 65.56 1yqj h ILE 134 Cb 0.21 0.57 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 1yqj h ILE 134 CO -0.02 0.17 -0.55 -0.07 0.00 0.00 0.00 178.15 177.68 1yqj h LEU 135 N 0.63 0.00 -0.35 1.44 3.38 -1.06 -0.05 115.31 119.30 1yqj h LEU 135 Ca 0.17 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.05 1yqj h LEU 135 Cb 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1yqj h LEU 135 CO -0.03 0.55 -0.14 -0.09 0.09 0.00 0.00 178.44 178.82 1yqj h ARG 136 N 0.00 0.72 -0.02 1.13 2.43 -0.58 -0.65 114.38 117.41 1yqj h ARG 136 Ca -0.01 -0.30 -0.16 0.00 -0.81 0.00 0.00 59.98 58.71 1yqj h ARG 136 Cb 1.08 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.58 1yqj h ARG 136 CO 0.07 0.90 -0.71 0.78 -1.51 0.00 0.00 179.97 179.51 1yqj h GLY 137 N 0.50 0.11 1.29 2.80 0.00 -1.08 -3.10 103.07 103.59 1yqj h GLY 137 Ca 0.08 -0.16 -0.14 0.00 0.00 0.00 0.00 47.33 47.11 1yqj h GLY 137 CO 0.05 0.14 -0.37 1.41 0.00 0.00 0.00 176.54 177.77 1yqj h LEU 138 N 0.07 0.83 -0.86 3.11 3.38 -0.83 -1.11 115.31 119.90 1yqj h LEU 138 Ca -0.01 -0.37 0.03 0.00 0.09 0.00 0.00 57.88 57.62 1yqj h LEU 138 Cb 1.25 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.72 1yqj h LEU 138 CO 0.10 1.11 0.56 0.50 0.09 0.00 0.00 178.44 180.79 1yqj h LYS 139 N 0.65 1.07 0.34 1.13 3.64 -1.10 0.18 116.57 122.47 1yqj h LYS 139 Ca 0.06 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 1yqj h LYS 139 Cb 0.92 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 1yqj h LYS 139 CO 0.08 0.71 -0.16 -0.92 -2.27 0.00 0.00 179.45 176.89 1yqj h TYR 140 N 1.10 -0.42 -0.63 1.91 3.20 -1.44 -0.77 116.97 119.92 1yqj h TYR 140 Ca 0.33 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.28 1yqj h TYR 140 Cb -0.04 0.14 -0.07 0.00 1.54 0.00 0.00 36.73 38.30 1yqj h TYR 140 CO -0.02 -0.09 0.28 0.82 -1.64 0.00 0.00 178.16 177.50 1yqj h ILE 141 N -0.78 0.82 0.00 1.81 2.04 -0.96 -1.64 117.51 118.81 1yqj h ILE 141 Ca -0.05 -0.17 -0.09 0.00 1.00 0.00 0.00 64.86 65.56 1yqj h ILE 141 Cb 0.51 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 1yqj h ILE 141 CO 0.08 0.09 -0.43 0.45 0.00 0.00 0.00 178.15 178.34 1yqj h HIS 142 N 0.49 0.00 0.00 1.37 3.86 -0.65 -2.40 115.15 117.82 1yqj h HIS 142 Ca 0.31 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.52 1yqj h HIS 142 Cb 0.34 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.81 1yqj h HIS 142 CO -0.14 0.43 0.00 0.66 0.86 0.00 0.00 177.93 179.74 1yqj h SER 143 N 0.00 0.00 -0.52 2.45 4.64 -0.14 -0.75 113.55 119.23 1yqj h SER 143 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1yqj h SER 143 Cb 0.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 1yqj h SER 143 CO 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.02 1yqj n ALA 144 N -2.00 2.41 -3.36 5.18 0.00 -0.99 -4.69 120.51 117.06 1yqj n ALA 144 Ca 0.00 -1.07 -0.19 0.00 0.00 0.00 0.00 53.44 52.19 1yqj n ALA 144 Cb 0.24 -0.92 0.06 0.00 0.00 0.00 0.00 19.45 18.83 1yqj n ALA 144 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1yqj n ASP 145 N 1.43 -5.53 -4.57 0.00 10.43 -0.29 -4.20 116.55 113.83 1yqj n ASP 145 Ca 0.21 -0.43 -0.32 0.00 2.57 0.00 0.00 54.79 56.82 1yqj n ASP 145 Cb 0.58 -4.14 -0.11 0.00 1.84 0.00 0.00 41.12 39.29 1yqj n ASP 145 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1yqj s ILE 146 N -3.25 3.50 -0.13 0.53 1.01 -0.94 -5.03 121.20 116.89 1yqj s ILE 146 Ca 0.46 -0.80 0.02 0.00 0.00 0.00 0.00 60.65 60.33 1yqj s ILE 146 Cb -0.20 -2.50 0.01 0.00 0.01 0.00 0.00 42.46 39.78 1yqj s ILE 146 CO 0.57 0.42 -0.19 -0.63 0.00 0.00 0.00 174.94 175.12 1yqj s ILE 147 N -0.95 1.81 0.05 2.92 1.01 -1.26 -3.88 121.20 120.90 1yqj s ILE 147 Ca 0.16 -0.82 -0.31 0.00 0.00 0.00 0.00 60.65 59.68 1yqj s ILE 147 Cb -0.11 -1.63 -0.18 0.00 0.01 0.00 0.00 42.46 40.55 1yqj s ILE 147 CO 0.06 0.50 1.51 -0.74 0.00 0.00 0.00 174.94 176.27 1yqj h HIS 148 N 7.50 -0.76 0.00 3.97 -0.00 -1.96 -3.45 115.15 120.45 1yqj h HIS 148 Ca -0.34 -0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.01 1yqj h HIS 148 Cb 1.17 0.25 0.00 0.00 -0.00 0.00 0.00 27.41 28.84 1yqj h HIS 148 CO 0.47 -0.44 0.00 0.54 -0.00 0.00 0.00 177.93 178.50 1yqj n ARG 149 N -5.41 0.00 -2.59 5.26 1.74 -1.26 -1.64 116.66 112.76 1yqj n ARG 149 Ca -0.13 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 56.84 1yqj n ARG 149 Cb 0.35 -0.66 0.03 0.00 -1.02 0.00 0.00 32.46 31.15 1yqj n ARG 149 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1yqj n ASP 150 N 0.21 2.57 -4.67 0.55 2.03 -1.26 -4.92 116.55 111.06 1yqj n ASP 150 Ca 0.00 -2.83 -0.43 0.00 0.52 0.00 0.00 54.79 52.05 1yqj n ASP 150 Cb 0.00 -0.47 -0.02 0.00 -0.72 0.00 0.00 41.12 39.90 1yqj n ASP 150 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1yqj s LEU 151 N -3.48 4.23 0.14 -2.67 2.96 -1.26 -4.84 118.68 113.76 1yqj s LEU 151 Ca 0.34 1.82 -0.24 0.00 -0.22 0.00 0.00 54.13 55.84 1yqj s LEU 151 Cb 0.40 -3.54 0.07 0.00 0.50 0.00 0.00 46.19 43.62 1yqj s LEU 151 CO -0.03 -0.76 0.61 -1.59 -1.32 0.00 0.00 176.35 173.27 1yqj s LYS 152 N 3.32 1.25 0.45 1.98 -2.85 -1.26 -4.85 119.74 117.78 1yqj s LYS 152 Ca 0.58 -0.39 0.30 0.00 -1.00 0.00 0.00 55.97 55.46 1yqj s LYS 152 Cb -0.25 0.58 1.39 0.00 -2.06 0.00 0.00 37.83 37.49 1yqj s LYS 152 CO 0.19 -0.53 1.67 -1.35 0.10 0.00 0.00 175.35 175.43 1yqj h PRO 153 N 2.10 0.14 0.00 1.78 0.11 -1.94 0.41 132.00 134.60 1yqj h PRO 153 Ca -0.33 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1yqj h PRO 153 Cb 1.29 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1yqj h PRO 153 CO 0.38 0.09 0.00 -1.13 -0.21 0.00 0.00 178.00 177.13 1yqj n SER 154 N -4.55 0.00 -1.22 -2.05 3.41 -1.26 -2.43 113.62 105.52 1yqj n SER 154 Ca 0.34 0.49 0.08 0.00 -0.26 0.00 0.00 58.87 59.52 1yqj n SER 154 Cb 1.34 -0.50 0.29 0.00 -0.26 0.00 0.00 64.21 65.08 1yqj n SER 154 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1yqj n ASN 155 N -1.50 4.24 -3.97 4.04 3.02 0.14 -4.84 115.26 116.40 1yqj n ASN 155 Ca 0.05 -2.57 -0.30 0.00 -0.03 0.00 0.00 54.58 51.72 1yqj n ASN 155 Cb 0.23 -0.51 -0.16 0.00 -0.61 0.00 0.00 39.78 38.73 1yqj n ASN 155 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1yqj s LEU 156 N -2.05 2.43 0.07 3.41 1.43 -1.02 -1.58 118.68 121.37 1yqj s LEU 156 Ca 0.43 -1.03 -0.22 0.00 -1.03 0.00 0.00 54.13 52.28 1yqj s LEU 156 Cb 0.30 -1.21 -0.06 0.00 0.03 0.00 0.00 46.19 45.25 1yqj s LEU 156 CO 0.17 -0.19 0.65 0.00 0.23 0.00 0.00 176.35 177.21 1yqj s ALA 157 N 1.39 3.50 0.02 4.21 0.00 -0.25 -0.21 121.76 130.42 1yqj s ALA 157 Ca -0.04 0.14 0.03 0.00 0.00 0.00 0.00 51.96 52.09 1yqj s ALA 157 Cb -0.18 -2.79 -0.01 0.00 0.00 0.00 0.00 23.12 20.14 1yqj s ALA 157 CO -0.07 0.26 -0.09 0.08 0.00 0.00 0.00 175.76 175.94 1yqj s VAL 158 N -0.69 0.66 0.52 0.00 1.01 0.74 -1.20 120.40 121.44 1yqj s VAL 158 Ca 0.32 -0.65 0.04 0.00 0.00 0.00 0.00 61.98 61.70 1yqj s VAL 158 Cb -0.20 -0.61 0.04 0.00 0.00 0.00 0.00 36.38 35.61 1yqj s VAL 158 CO 0.21 -0.02 0.35 -0.46 0.00 0.00 0.00 175.10 175.17 1yqj n ASN 159 N 2.32 2.77 0.29 3.32 0.23 -0.50 -3.65 115.26 120.03 1yqj n ASN 159 Ca -0.17 -2.86 0.19 0.00 -0.53 0.00 0.00 54.58 51.21 1yqj n ASN 159 Cb 0.56 0.01 0.99 0.00 -2.08 0.00 0.00 39.78 39.26 1yqj n ASN 159 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1yqj h GLU 160 N 0.00 0.00 -0.57 -3.83 5.08 -1.99 -0.32 114.58 112.95 1yqj h GLU 160 Ca -0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.02 1yqj h GLU 160 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1yqj h GLU 160 CO 0.54 0.00 0.00 -0.25 -1.00 0.00 0.00 179.01 178.30 1yqj n ASP 161 N -2.81 4.91 -1.94 1.42 8.00 -1.26 -4.92 116.55 119.95 1yqj n ASP 161 Ca -0.02 -2.66 -0.19 0.00 0.71 0.00 0.00 54.79 52.63 1yqj n ASP 161 Cb 0.10 -0.59 -0.03 0.00 -0.02 0.00 0.00 41.12 40.57 1yqj n ASP 161 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yqj s GLU 163 N -4.55 3.92 0.08 0.00 2.02 -1.26 -4.77 118.70 114.14 1yqj s GLU 163 Ca 0.00 0.38 0.07 0.00 0.02 0.00 0.00 54.97 55.44 1yqj s GLU 163 Cb 0.00 -3.23 -0.03 0.00 0.10 0.00 0.00 34.13 30.97 1yqj s GLU 163 CO 0.00 0.66 -0.19 -1.17 0.02 0.00 0.00 175.26 174.58 1yqj s LEU 164 N -0.96 2.25 -0.00 1.80 0.20 -1.26 -1.42 118.68 119.29 1yqj s LEU 164 Ca 0.23 -0.62 0.02 0.00 0.69 0.00 0.00 54.13 54.46 1yqj s LEU 164 Cb -0.16 -0.83 -0.01 0.00 -0.43 0.00 0.00 46.19 44.76 1yqj s LEU 164 CO 0.13 0.06 -0.07 -0.54 -0.29 0.00 0.00 176.35 175.63 1yqj s LYS 165 N -1.64 0.60 -0.03 1.98 1.02 -0.34 -4.34 119.74 116.99 1yqj s LYS 165 Ca 0.05 -0.29 -0.20 0.00 0.02 0.00 0.00 55.97 55.55 1yqj s LYS 165 Cb -0.09 -0.57 -0.05 0.00 -0.52 0.00 0.00 37.83 36.59 1yqj s LYS 165 CO 0.03 0.16 0.57 0.42 -0.92 0.00 0.00 175.35 175.61 1yqj s ILE 166 N -0.22 4.98 0.00 2.17 1.01 0.08 -1.09 121.20 128.13 1yqj s ILE 166 Ca 0.02 1.19 0.00 0.00 0.00 0.00 0.00 60.65 61.86 1yqj s ILE 166 Cb -0.03 -3.91 0.00 0.00 0.01 0.00 0.00 42.46 38.53 1yqj s ILE 166 CO -0.00 0.39 0.00 0.00 0.00 0.00 0.00 174.94 175.33 1yqj n LEU 167 N 2.96 0.00 -3.99 2.97 -0.00 -0.62 -0.55 117.00 117.77 1yqj n LEU 167 Ca -0.07 0.00 -0.39 0.00 -0.00 0.00 0.00 56.01 55.55 1yqj n LEU 167 Cb 0.51 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 43.95 1yqj n LEU 167 CO 0.43 0.00 -0.16 -0.67 -0.00 0.00 0.00 177.39 176.99 1yqj n ASP 168 N -1.11 -3.69 -4.76 1.45 -0.08 -1.26 -4.85 116.55 102.25 1yqj n ASP 168 Ca 0.00 -1.12 -0.40 0.00 -1.51 0.00 0.00 54.79 51.77 1yqj n ASP 168 Cb 0.00 -1.39 0.02 0.00 2.34 0.00 0.00 41.12 42.09 1yqj n ASP 168 CO 0.00 0.00 0.00 -0.36 0.12 0.00 0.00 177.20 176.96 1yqj s PHE 169 N -3.58 2.38 -0.26 -0.67 0.40 -1.26 -4.86 117.98 110.13 1yqj s PHE 169 Ca 0.37 1.27 -0.04 0.00 -0.60 0.00 0.00 56.93 57.94 1yqj s PHE 169 Cb -0.21 -3.92 -0.02 0.00 0.51 0.00 0.00 43.02 39.38 1yqj s PHE 169 CO 0.85 -3.02 2.87 0.41 0.70 0.00 0.00 175.22 177.03 1yqj n GLY 170 N 0.61 3.76 3.43 4.36 0.00 -0.65 -4.83 105.19 111.87 1yqj n GLY 170 Ca 0.06 -1.42 -0.44 0.00 0.00 0.00 0.00 46.02 44.22 1yqj n GLY 170 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yqj n LEU 171 N 1.34 5.30 0.00 0.99 4.32 -1.26 -4.43 117.00 123.26 1yqj n LEU 171 Ca 0.41 -4.56 0.00 0.00 -0.02 0.00 0.00 56.01 51.83 1yqj n LEU 171 Cb 0.66 -1.59 0.00 0.00 -1.62 0.00 0.00 43.42 40.87 1yqj n LEU 171 CO 0.25 0.85 0.00 0.00 -1.22 0.00 0.00 177.39 177.26 1yqj n ALA 172 N 5.09 0.00 0.00 -1.18 0.00 -1.26 -4.94 120.51 118.23 1yqj n ALA 172 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.79 1yqj n ALA 172 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 1yqj n ALA 172 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1yqj n ARG 173 N 0.00 0.00 -3.95 0.00 3.00 -1.26 -5.11 116.66 109.33 1yqj n ARG 173 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 57.85 57.53 1yqj n ARG 173 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 32.46 32.31 1yqj n ARG 173 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 1yqj s HIS 174 N -2.00 2.88 -0.43 -1.55 2.46 -1.26 -5.07 115.29 110.32 1yqj s HIS 174 Ca 0.00 -2.26 -0.40 0.00 0.47 0.00 0.00 55.06 52.87 1yqj s HIS 174 Cb 0.00 -2.11 -0.17 0.00 -0.13 0.00 0.00 32.58 30.17 1yqj s HIS 174 CO 0.00 -0.87 1.41 0.25 -2.47 0.00 0.00 174.74 173.07 1yqj n THR 175 N 4.52 0.00 0.07 0.89 -2.24 -1.26 -4.68 114.28 111.58 1yqj n THR 175 Ca -0.05 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.75 1yqj n THR 175 Cb 0.43 -0.43 0.14 0.00 -2.10 0.00 0.00 70.33 68.37 1yqj n THR 175 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1yqj n ASP 176 N 3.70 0.14 0.04 3.42 3.85 -1.26 0.22 116.55 126.67 1yqj n ASP 176 Ca 0.28 0.38 -0.11 0.00 -0.71 0.00 0.00 54.79 54.64 1yqj n ASP 176 Cb -0.05 -0.35 -0.13 0.00 -1.35 0.00 0.00 41.12 39.24 1yqj n ASP 176 CO 0.00 0.00 0.00 -0.78 -1.01 0.00 0.00 177.20 175.41 1yqj h ASP 177 N 0.00 0.15 -0.00 -1.12 3.58 -1.97 -3.14 116.42 113.92 1yqj h ASP 177 Ca 0.00 -0.20 0.00 0.00 0.42 0.00 0.00 57.03 57.25 1yqj h ASP 177 Cb 0.56 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.56 1yqj h ASP 177 CO 0.00 1.17 0.00 -1.84 -2.88 0.00 0.00 179.24 175.69 1yqj n GLU 178 N -3.32 1.03 -0.13 0.28 0.28 0.13 -2.12 120.64 116.79 1yqj n GLU 178 Ca -0.10 -0.04 0.07 0.00 -0.16 0.00 0.00 57.16 56.93 1yqj n GLU 178 Cb 1.01 -1.49 0.14 0.00 1.43 0.00 0.00 31.44 32.52 1yqj n GLU 178 CO 0.00 0.00 0.00 -1.33 -0.16 0.00 0.00 177.13 175.64 1yqj n MET 179 N -0.95 2.08 -3.35 3.44 2.81 -1.16 -4.71 117.12 115.29 1yqj n MET 179 Ca 0.23 -1.84 -0.38 0.00 -1.81 0.00 0.00 57.70 53.90 1yqj n MET 179 Cb 0.12 -1.30 -0.06 0.00 -0.71 0.00 0.00 33.22 31.26 1yqj n MET 179 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 1yqj s THR 180 N -1.05 5.07 0.00 2.03 2.01 -0.90 -4.83 115.64 117.97 1yqj s THR 180 Ca 0.24 0.97 0.00 0.00 0.31 0.00 0.00 61.69 63.21 1yqj s THR 180 Cb 0.13 -3.81 0.00 0.00 0.01 0.00 0.00 72.50 68.84 1yqj s THR 180 CO 0.18 0.43 0.00 0.61 -0.69 0.00 0.00 174.62 175.15 1yqj n GLY 181 N 2.65 -0.66 3.23 4.40 0.00 -1.25 -4.51 105.19 109.04 1yqj n GLY 181 Ca -0.09 -1.25 -0.43 0.00 0.00 0.00 0.00 46.02 44.25 1yqj n GLY 181 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1yqj n TYR 182 N 0.00 4.18 -4.58 1.61 9.36 -0.84 -3.80 117.16 123.10 1yqj n TYR 182 Ca 0.00 -2.97 -0.23 0.00 3.32 0.00 0.00 57.90 58.03 1yqj n TYR 182 Cb 0.00 -2.45 -0.16 0.00 -0.63 0.00 0.00 39.34 36.11 1yqj n TYR 182 CO 0.00 0.00 0.00 0.14 0.22 0.00 0.00 176.86 177.22 1yqj s VAL 183 N 2.95 1.06 0.44 2.97 -7.23 -1.26 -5.02 120.40 114.31 1yqj s VAL 183 Ca 0.48 -0.52 0.40 0.00 -1.81 0.00 0.00 61.98 60.53 1yqj s VAL 183 Cb 0.06 -0.92 0.42 0.00 0.56 0.00 0.00 36.38 36.51 1yqj s VAL 183 CO 0.01 0.32 2.22 0.00 -0.31 0.00 0.00 175.10 177.33 1yqj h ALA 184 N 6.28 1.01 0.00 1.32 0.00 -1.93 -2.45 119.26 123.50 1yqj h ALA 184 Ca -0.33 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1yqj h ALA 184 Cb 1.17 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1yqj h ALA 184 CO 0.48 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.99 1yqj n THR 185 N -3.11 1.04 0.03 0.00 -2.24 -1.26 -2.97 114.28 105.77 1yqj n THR 185 Ca -0.02 0.58 0.01 0.00 -2.27 0.00 0.00 64.05 62.36 1yqj n THR 185 Cb 0.17 -1.56 -0.02 0.00 -2.10 0.00 0.00 70.33 66.82 1yqj n THR 185 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1yqj n ARG 186 N -2.20 1.61 0.31 -0.78 0.63 -0.92 -4.75 116.66 110.56 1yqj n ARG 186 Ca -0.00 -0.02 0.18 0.00 -0.92 0.00 0.00 57.85 57.09 1yqj n ARG 186 Cb 0.09 -0.95 1.01 0.00 0.45 0.00 0.00 32.46 33.06 1yqj n ARG 186 CO 0.00 0.00 0.00 -1.49 -2.51 0.00 0.00 177.63 173.63 1yqj h TRP 187 N 0.00 0.00 -0.30 -0.14 6.55 -1.55 -2.51 115.95 118.00 1yqj h TRP 187 Ca 0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 1yqj h TRP 187 Cb 0.10 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.40 1yqj h TRP 187 CO 0.00 0.02 0.00 0.66 -1.05 0.00 0.00 178.44 178.07 1yqj n TYR 188 N -3.40 0.38 -2.93 0.49 4.01 -1.26 -4.56 117.16 109.90 1yqj n TYR 188 Ca -0.02 -0.23 -0.40 0.00 -0.16 0.00 0.00 57.90 57.08 1yqj n TYR 188 Cb 0.12 -0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.10 1yqj n TYR 188 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1yqj s ARG 189 N -1.35 4.56 0.53 -0.72 0.52 -0.95 -3.81 118.95 117.73 1yqj s ARG 189 Ca 0.32 1.17 -0.22 0.00 -0.52 0.00 0.00 55.73 56.47 1yqj s ARG 189 Cb 0.19 -3.34 -0.06 0.00 0.52 0.00 0.00 34.95 32.26 1yqj s ARG 189 CO 0.26 0.34 1.35 0.00 0.02 0.00 0.00 175.30 177.28 1yqj n ALA 190 N 2.51 1.60 -0.20 2.13 0.00 -1.26 -4.77 120.51 120.51 1yqj n ALA 190 Ca -0.02 0.15 -0.06 0.00 0.00 0.00 0.00 53.44 53.51 1yqj n ALA 190 Cb 0.50 -2.35 0.04 0.00 0.00 0.00 0.00 19.45 17.64 1yqj n ALA 190 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1yqj h PRO 191 N 1.56 0.72 -0.16 0.00 0.13 -1.96 -0.03 132.00 132.26 1yqj h PRO 191 Ca -0.51 -0.04 0.05 0.00 -0.87 0.00 0.00 66.00 64.63 1yqj h PRO 191 Cb 1.30 -0.16 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 1yqj h PRO 191 CO 0.58 0.47 0.15 1.05 -0.23 0.00 0.00 178.00 180.02 1yqj h GLU 192 N 0.74 0.00 0.00 0.86 9.09 -1.91 0.99 114.58 124.35 1yqj h GLU 192 Ca 0.22 0.00 -0.28 0.00 0.05 0.00 0.00 59.36 59.36 1yqj h GLU 192 Cb -0.04 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 27.01 1yqj h GLU 192 CO -0.07 0.00 -1.95 1.51 0.05 0.00 0.00 179.01 178.54 1yqj n ILE 193 N -3.98 1.31 0.06 -1.06 3.06 -0.93 -1.00 119.36 116.82 1yqj n ILE 193 Ca 0.01 -0.78 -0.06 0.00 -2.50 0.00 0.00 62.75 59.42 1yqj n ILE 193 Cb 0.27 -0.66 0.11 0.00 0.54 0.00 0.00 39.64 39.90 1yqj n ILE 193 CO 0.00 0.00 0.00 -0.03 -2.50 0.00 0.00 176.55 174.02 1yqj h MET 194 N 0.00 0.33 -0.08 9.51 4.05 0.19 -3.25 114.93 125.68 1yqj h MET 194 Ca -0.35 -0.22 0.00 0.00 -0.28 0.00 0.00 59.70 58.85 1yqj h MET 194 Cb 1.94 0.03 0.00 0.00 -0.80 0.00 0.00 31.60 32.77 1yqj h MET 194 CO 0.05 0.82 0.00 1.28 0.23 0.00 0.00 176.91 179.28 1yqj n LEU 195 N -3.91 2.13 -3.18 3.39 4.77 0.23 -5.01 117.00 115.41 1yqj n LEU 195 Ca -0.03 -1.21 -0.18 0.00 -0.03 0.00 0.00 56.01 54.57 1yqj n LEU 195 Cb 0.60 -0.05 0.08 0.00 -2.33 0.00 0.00 43.42 41.72 1yqj n LEU 195 CO 0.45 0.44 0.15 0.59 -1.33 0.00 0.00 177.39 177.69 1yqj n ASN 196 N 0.60 -3.63 0.04 -1.43 4.13 -0.92 -4.94 115.26 109.11 1yqj n ASN 196 Ca 0.07 -0.52 -0.09 0.00 1.68 0.00 0.00 54.58 55.73 1yqj n ASN 196 Cb 0.31 -4.55 0.06 0.00 -1.54 0.00 0.00 39.78 34.06 1yqj n ASN 196 CO 0.00 0.00 0.00 -0.50 0.28 0.00 0.00 177.26 177.04 1yqj h TRP 197 N -1.97 0.57 -2.34 3.10 6.55 -1.33 -3.44 115.95 117.09 1yqj h TRP 197 Ca -0.51 -0.22 0.02 0.00 0.95 0.00 0.00 58.89 59.13 1yqj h TRP 197 Cb 1.31 -0.10 -0.00 0.00 -0.86 0.00 0.00 29.16 29.51 1yqj h TRP 197 CO 0.41 0.95 0.21 0.00 -1.05 0.00 0.00 178.44 178.95 1yqj n MET 198 N -3.91 0.48 -2.39 0.49 0.00 -1.25 -1.16 117.12 109.39 1yqj n MET 198 Ca -0.03 -0.99 -0.43 0.00 0.00 0.00 0.00 57.70 56.25 1yqj n MET 198 Cb 0.64 1.27 -0.02 0.00 0.00 0.00 0.00 33.22 35.10 1yqj n MET 198 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 175.97 174.96 1yqj s HIS 199 N -4.92 2.60 0.37 3.17 3.76 -1.26 -4.84 115.29 114.17 1yqj s HIS 199 Ca 0.10 0.81 -0.24 0.00 -0.15 0.00 0.00 55.06 55.58 1yqj s HIS 199 Cb -0.02 -3.98 -0.10 0.00 1.11 0.00 0.00 32.58 29.59 1yqj s HIS 199 CO 0.05 -1.85 0.98 1.52 -0.85 0.00 0.00 174.74 174.59 1yqj s TYR 200 N 4.59 3.49 0.00 1.40 -0.85 -1.26 -5.07 117.35 119.65 1yqj s TYR 200 Ca 0.58 1.71 0.00 0.00 -0.52 0.00 0.00 57.07 58.84 1yqj s TYR 200 Cb -0.17 -2.96 0.00 0.00 0.38 0.00 0.00 41.96 39.21 1yqj s TYR 200 CO 0.25 -0.10 0.00 0.27 -1.52 0.00 0.00 175.55 174.45 1yqj n ASN 201 N 0.12 1.14 0.06 -0.18 6.94 -1.26 -5.00 115.26 117.08 1yqj n ASN 201 Ca 0.04 -0.13 0.11 0.00 -0.02 0.00 0.00 54.58 54.57 1yqj n ASN 201 Cb 0.51 0.00 0.44 0.00 -2.36 0.00 0.00 39.78 38.37 1yqj n ASN 201 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1yqj n GLN 202 N -0.06 0.11 0.05 -3.83 10.64 -1.26 -2.97 117.38 120.06 1yqj n GLN 202 Ca 0.00 0.27 0.08 0.00 -1.83 0.00 0.00 57.00 55.52 1yqj n GLN 202 Cb 0.00 -1.69 0.36 0.00 -0.86 0.00 0.00 30.24 28.05 1yqj n GLN 202 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 1yqj n THR 203 N -1.89 1.04 0.20 -0.39 -2.24 -1.26 -1.71 114.28 108.02 1yqj n THR 203 Ca 0.04 0.29 0.05 0.00 -2.27 0.00 0.00 64.05 62.16 1yqj n THR 203 Cb 0.26 -1.13 0.49 0.00 -2.10 0.00 0.00 70.33 67.84 1yqj n THR 203 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 1yqj h VAL 204 N 0.00 1.12 -0.15 2.28 -1.51 -1.92 -1.48 116.25 114.60 1yqj h VAL 204 Ca 0.00 -0.57 -0.12 0.00 -1.23 0.00 0.00 66.70 64.79 1yqj h VAL 204 Cb 0.25 1.24 -0.01 0.00 -2.13 0.00 0.00 31.29 30.64 1yqj h VAL 204 CO 0.00 0.17 -0.43 0.44 -1.23 0.00 0.00 177.57 176.52 1yqj h ASP 205 N 0.07 0.36 -0.49 4.19 3.32 -1.59 -2.75 116.42 119.53 1yqj h ASP 205 Ca 0.01 -0.16 -0.12 0.00 0.02 0.00 0.00 57.03 56.79 1yqj h ASP 205 Cb 0.28 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 1yqj h ASP 205 CO 0.02 0.75 -0.14 0.40 -1.72 0.00 0.00 179.24 178.55 1yqj h ILE 206 N 0.28 1.27 -0.45 0.35 1.08 -1.40 -1.71 117.51 116.93 1yqj h ILE 206 Ca 0.02 -1.29 0.05 0.00 -0.39 0.00 0.00 64.86 63.25 1yqj h ILE 206 Cb 0.87 1.02 -0.05 0.00 -3.07 0.00 0.00 36.82 35.60 1yqj h ILE 206 CO 0.07 0.45 0.18 -0.25 -0.69 0.00 0.00 178.15 177.92 1yqj h TRP 207 N 0.87 0.33 -0.73 1.37 2.91 -1.26 -1.12 115.95 118.32 1yqj h TRP 207 Ca 0.13 0.02 0.04 0.00 1.13 0.00 0.00 58.89 60.21 1yqj h TRP 207 Cb 0.70 -0.08 -0.05 0.00 -0.51 0.00 0.00 29.16 29.22 1yqj h TRP 207 CO 0.05 0.14 0.45 0.77 -1.03 0.00 0.00 178.44 178.82 1yqj h SER 208 N 0.37 0.72 -0.78 2.65 0.02 -1.20 -1.49 113.55 113.85 1yqj h SER 208 Ca 0.21 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.12 1yqj h SER 208 Cb 0.17 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 1yqj h SER 208 CO -0.19 0.49 0.31 0.58 -1.14 0.00 0.00 176.83 176.89 1yqj h VAL 209 N 0.86 1.26 -0.70 2.27 2.07 -0.62 -1.40 116.25 119.98 1yqj h VAL 209 Ca 0.30 -0.81 -0.00 0.00 0.82 0.00 0.00 66.70 67.01 1yqj h VAL 209 Cb 0.07 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.13 1yqj h VAL 209 CO -0.13 0.33 0.42 1.23 0.02 0.00 0.00 177.57 179.45 1yqj h GLY 210 N 1.16 1.02 1.02 2.17 0.00 -0.51 0.25 103.07 108.18 1yqj h GLY 210 Ca 0.26 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 1yqj h GLY 210 CO -0.02 0.41 0.49 0.00 0.00 0.00 0.00 176.54 177.42 1yqj h ILE 212 N 1.18 1.34 0.43 0.00 2.04 -0.68 -2.63 117.51 119.19 1yqj h ILE 212 Ca 0.30 -1.49 -0.02 0.00 1.00 0.00 0.00 64.86 64.65 1yqj h ILE 212 Cb -0.01 1.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.96 1yqj h ILE 212 CO -0.05 0.45 -0.22 -0.03 0.00 0.00 0.00 178.15 178.30 1yqj h MET 213 N 0.14 -0.57 -0.79 2.37 4.05 -0.34 -1.47 114.93 118.32 1yqj h MET 213 Ca 0.02 0.04 0.16 0.00 -0.28 0.00 0.00 59.70 59.64 1yqj h MET 213 Cb 0.85 0.13 -0.11 0.00 -0.80 0.00 0.00 31.60 31.67 1yqj h MET 213 CO 0.06 -0.38 0.30 0.00 0.23 0.00 0.00 176.91 177.12 1yqj h ALA 214 N -0.02 1.14 -0.04 0.39 0.00 -1.24 -0.32 119.26 119.17 1yqj h ALA 214 Ca -0.06 0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 1yqj h ALA 214 Cb 0.46 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1yqj h ALA 214 CO 0.09 -0.26 -0.40 1.49 0.00 0.00 0.00 179.25 180.16 1yqj h GLU 215 N 0.40 0.09 -0.09 0.00 4.81 -1.21 0.01 114.58 118.60 1yqj h GLU 215 Ca 0.45 -0.04 -0.19 0.00 -0.13 0.00 0.00 59.36 59.46 1yqj h GLU 215 Cb 0.75 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.12 1yqj h GLU 215 CO -0.46 0.48 -0.72 -0.07 -0.73 0.00 0.00 179.01 177.52 1yqj h LEU 216 N 0.08 0.53 -0.15 1.64 3.38 -0.02 0.54 115.31 121.31 1yqj h LEU 216 Ca 0.01 -0.34 -0.23 0.00 0.09 0.00 0.00 57.88 57.40 1yqj h LEU 216 Cb 0.75 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 41.36 1yqj h LEU 216 CO 0.06 1.09 -0.89 -0.07 0.09 0.00 0.00 178.44 178.72 1yqj h LEU 217 N 0.31 0.79 0.00 1.67 3.38 -0.90 -3.35 115.31 117.21 1yqj h LEU 217 Ca -0.03 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.36 1yqj h LEU 217 Cb 1.30 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1yqj h LEU 217 CO 0.13 1.37 -1.76 0.35 0.09 0.00 0.00 178.44 178.62 1yqj n THR 218 N -3.86 0.00 -1.02 0.22 -2.24 -0.04 -4.98 114.28 102.36 1yqj n THR 218 Ca -0.08 -0.39 -0.01 0.00 -2.27 0.00 0.00 64.05 61.30 1yqj n THR 218 Cb 0.80 0.18 -0.00 0.00 -2.10 0.00 0.00 70.33 69.21 1yqj n THR 218 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yqj n GLY 219 N 1.40 0.47 3.10 3.38 0.00 0.19 -5.01 105.19 108.72 1yqj n GLY 219 Ca -0.03 -0.22 -0.21 0.00 0.00 0.00 0.00 46.02 45.57 1yqj n GLY 219 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yqj s ARG 220 N -0.78 0.98 0.26 1.61 1.81 -1.21 -5.02 118.95 116.60 1yqj s ARG 220 Ca 0.00 -0.54 -0.31 0.00 -1.72 0.00 0.00 55.73 53.17 1yqj s ARG 220 Cb 0.00 -0.96 -0.13 0.00 -0.45 0.00 0.00 34.95 33.41 1yqj s ARG 220 CO 0.00 0.26 1.49 2.41 -0.68 0.00 0.00 175.30 178.78 1yqj n THR 221 N 2.51 0.93 -0.05 0.02 -1.04 -1.26 -4.11 114.28 111.28 1yqj n THR 221 Ca -0.15 -0.23 -0.14 0.00 -2.04 0.00 0.00 64.05 61.49 1yqj n THR 221 Cb 0.55 -1.68 -0.08 0.00 -1.82 0.00 0.00 70.33 67.31 1yqj n THR 221 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1yqj h LEU 222 N 4.54 0.43 -6.08 -4.42 5.85 -1.92 -3.39 115.31 110.33 1yqj h LEU 222 Ca -0.46 -0.55 -0.58 0.00 0.84 0.00 0.00 57.88 57.13 1yqj h LEU 222 Cb 1.25 -0.12 -0.40 0.00 0.37 0.00 0.00 40.66 41.76 1yqj h LEU 222 CO 0.78 0.91 -0.87 0.49 -0.34 0.00 0.00 178.44 179.41 1yqj n PHE 223 N -4.46 1.56 -0.98 1.25 3.72 -1.26 -4.99 117.46 112.30 1yqj n PHE 223 Ca -0.07 -3.85 -0.26 0.00 -0.05 0.00 0.00 57.45 53.22 1yqj n PHE 223 Cb 0.44 -0.45 -0.05 0.00 -0.94 0.00 0.00 39.48 38.48 1yqj n PHE 223 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1yqj n PRO 224 N 1.10 2.65 -1.76 -1.08 -0.04 -1.26 -4.67 135.00 129.94 1yqj n PRO 224 Ca 0.25 -1.63 -0.39 0.00 -0.04 0.00 0.00 63.50 61.70 1yqj n PRO 224 Cb 0.47 -2.48 0.04 0.00 -0.04 0.00 0.00 33.50 31.49 1yqj n PRO 224 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1yqj s GLY 225 N 2.67 2.90 0.17 0.55 0.00 -1.26 -4.90 107.32 107.45 1yqj s GLY 225 Ca 0.55 1.40 0.26 0.00 0.00 0.00 0.00 44.72 46.92 1yqj s GLY 225 CO -0.04 1.95 1.62 -1.30 0.00 0.00 0.00 173.10 175.34 1yqj n THR 226 N -0.79 0.49 -3.82 0.90 -2.24 -1.26 -4.21 114.28 103.34 1yqj n THR 226 Ca 0.09 -0.27 -0.04 0.00 -2.27 0.00 0.00 64.05 61.55 1yqj n THR 226 Cb 0.44 -0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.26 1yqj n THR 226 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1yqj s ASP 227 N -4.36 -0.08 0.23 3.42 1.47 -1.25 -1.98 116.67 114.13 1yqj s ASP 227 Ca 0.09 -0.65 -0.06 0.00 1.18 0.00 0.00 52.55 53.11 1yqj s ASP 227 Cb 0.13 0.57 0.37 0.00 -0.34 0.00 0.00 42.92 43.65 1yqj s ASP 227 CO 0.64 -1.10 1.76 0.45 0.68 0.00 0.00 175.17 177.60 1yqj h HIS 228 N 2.00 0.58 -0.13 2.11 3.86 -1.88 0.32 115.15 122.00 1yqj h HIS 228 Ca -0.26 0.03 -0.10 0.00 -1.16 0.00 0.00 60.37 58.88 1yqj h HIS 228 Cb 1.23 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 29.55 1yqj h HIS 228 CO 0.93 0.16 -0.30 0.82 0.86 0.00 0.00 177.93 180.40 1yqj h ILE 229 N 0.53 1.37 -0.70 2.45 1.08 -1.99 -0.91 117.51 119.35 1yqj h ILE 229 Ca 0.37 -1.59 0.03 0.00 -0.39 0.00 0.00 64.86 63.27 1yqj h ILE 229 Cb 0.46 2.07 -0.04 0.00 -3.07 0.00 0.00 36.82 36.23 1yqj h ILE 229 CO -0.32 0.47 0.44 -0.78 -0.69 0.00 0.00 178.15 177.28 1yqj h ASP 230 N 0.03 0.74 -0.63 1.72 3.58 -1.90 -1.49 116.42 118.46 1yqj h ASP 230 Ca -0.00 -0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.39 1yqj h ASP 230 Cb 0.91 -0.16 -0.03 0.00 1.72 0.00 0.00 39.33 41.76 1yqj h ASP 230 CO 0.07 0.52 0.20 -0.61 -2.88 0.00 0.00 179.24 176.53 1yqj h GLN 231 N 0.88 1.01 -0.56 0.28 4.15 -0.85 -1.79 115.11 118.23 1yqj h GLN 231 Ca 0.28 -0.21 -0.07 0.00 0.77 0.00 0.00 58.65 59.42 1yqj h GLN 231 Cb -0.01 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.51 1yqj h GLN 231 CO -0.10 0.87 0.08 1.25 -1.93 0.00 0.00 178.83 179.01 1yqj h LEU 232 N 0.97 0.86 -0.64 -2.39 5.85 -0.51 -1.76 115.31 117.69 1yqj h LEU 232 Ca 0.21 -0.19 -0.06 0.00 0.84 0.00 0.00 57.88 58.69 1yqj h LEU 232 Cb 0.29 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 1yqj h LEU 232 CO -0.01 0.87 0.17 0.11 -0.34 0.00 0.00 178.44 179.24 1yqj h LYS 233 N 0.85 1.02 -0.95 1.25 1.57 -0.86 -0.10 116.57 119.36 1yqj h LYS 233 Ca 0.18 -0.24 0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1yqj h LYS 233 Cb 0.39 -0.14 -0.05 0.00 0.08 0.00 0.00 32.23 32.51 1yqj h LYS 233 CO 0.01 0.91 0.62 -0.07 -0.57 0.00 0.00 179.45 180.35 1yqj h LEU 234 N 0.94 1.07 -0.04 2.94 4.07 -0.93 -1.48 115.31 121.88 1yqj h LEU 234 Ca 0.20 -0.02 -0.01 0.00 0.08 0.00 0.00 57.88 58.13 1yqj h LEU 234 Cb 0.34 -0.26 -0.00 0.00 1.08 0.00 0.00 40.66 41.82 1yqj h LEU 234 CO -0.00 0.76 -0.02 0.40 -1.08 0.00 0.00 178.44 178.50 1yqj h ILE 235 N 1.26 1.32 0.00 1.22 2.04 -0.72 -3.11 117.51 119.51 1yqj h ILE 235 Ca 0.35 -0.99 -0.05 0.00 1.00 0.00 0.00 64.86 65.18 1yqj h ILE 235 Cb -0.11 1.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 1yqj h ILE 235 CO -0.09 0.27 -0.23 -0.07 0.00 0.00 0.00 178.15 178.02 1yqj h LEU 236 N -0.30 0.00 -0.34 1.44 3.38 -0.87 -0.77 115.31 117.85 1yqj h LEU 236 Ca 0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1yqj h LEU 236 Cb 0.44 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1yqj h LEU 236 CO 0.01 0.23 0.15 -0.09 0.09 0.00 0.00 178.44 178.83 1yqj h ARG 237 N 0.00 0.51 0.13 1.13 2.43 -1.27 0.74 114.38 118.04 1yqj h ARG 237 Ca -0.00 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.08 1yqj h ARG 237 Cb 0.51 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1yqj h ARG 237 CO 0.03 0.49 -0.06 1.25 -1.51 0.00 0.00 179.97 180.16 1yqj h LEU 238 N 0.41 -0.15 -1.00 3.80 5.85 -1.40 -3.36 115.31 119.46 1yqj h LEU 238 Ca 0.12 -0.40 0.00 0.00 0.84 0.00 0.00 57.88 58.43 1yqj h LEU 238 Cb 0.16 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.23 1yqj h LEU 238 CO -0.01 0.42 -0.07 1.33 -0.34 0.00 0.00 178.44 179.77 1yqj n VAL 239 N -4.90 0.00 0.00 1.05 0.24 -0.33 -0.33 118.33 114.06 1yqj n VAL 239 Ca -0.08 -0.26 0.00 0.00 -2.04 0.00 0.00 64.34 61.96 1yqj n VAL 239 Cb 0.27 0.64 0.00 0.00 -1.47 0.00 0.00 33.84 33.28 1yqj n VAL 239 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1yqj n GLY 240 N 1.24 -1.68 3.81 7.63 0.00 0.26 -4.23 105.19 112.22 1yqj n GLY 240 Ca 0.17 -1.54 -0.33 0.00 0.00 0.00 0.00 46.02 44.31 1yqj n GLY 240 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1yqj s THR 241 N -2.79 4.17 0.43 2.61 -4.23 0.05 -4.64 115.64 111.24 1yqj s THR 241 Ca 0.00 1.31 -0.24 0.00 -1.18 0.00 0.00 61.69 61.57 1yqj s THR 241 Cb 0.00 -3.55 -0.10 0.00 1.34 0.00 0.00 72.50 70.19 1yqj s THR 241 CO 0.00 -0.34 1.06 -2.65 -0.54 0.00 0.00 174.62 172.15 1yqj n PRO 242 N -0.91 1.44 -2.68 3.99 -0.02 -1.26 -4.85 135.00 130.70 1yqj n PRO 242 Ca 0.08 0.52 -0.22 0.00 -2.02 0.00 0.00 63.50 61.85 1yqj n PRO 242 Cb 0.53 -2.12 0.09 0.00 -0.02 0.00 0.00 33.50 31.99 1yqj n PRO 242 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1yqj s GLY 243 N -0.73 1.77 0.28 -1.23 0.00 -1.26 -4.89 107.32 101.25 1yqj s GLY 243 Ca 0.63 -1.77 -0.02 0.00 0.00 0.00 0.00 44.72 43.57 1yqj s GLY 243 CO 0.56 -1.26 1.90 0.00 0.00 0.00 0.00 173.10 174.31 1yqj h ALA 244 N -0.31 1.42 0.02 3.20 0.00 -1.99 -1.61 119.26 120.00 1yqj h ALA 244 Ca -0.36 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.55 1yqj h ALA 244 Cb 1.27 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 18.71 1yqj h ALA 244 CO 0.42 0.45 -0.33 0.93 0.00 0.00 0.00 179.25 180.72 1yqj h GLU 245 N 1.15 -0.47 -0.53 0.00 5.08 -2.00 -1.79 114.58 116.02 1yqj h GLU 245 Ca 0.41 0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.71 1yqj h GLU 245 Cb 0.13 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1yqj h GLU 245 CO -0.15 -0.32 -0.02 1.25 -1.00 0.00 0.00 179.01 178.77 1yqj h LEU 246 N -0.49 0.88 -0.43 1.33 6.46 -1.90 -3.13 115.31 118.03 1yqj h LEU 246 Ca 0.06 -0.24 0.07 0.00 -0.12 0.00 0.00 57.88 57.65 1yqj h LEU 246 Cb 0.57 -0.24 -0.06 0.00 -0.73 0.00 0.00 40.66 40.20 1yqj h LEU 246 CO -0.26 0.96 0.06 -0.07 -0.62 0.00 0.00 178.44 178.51 1yqj h LEU 247 N 0.83 -0.06 -2.10 2.25 4.07 -0.75 0.91 115.31 120.46 1yqj h LEU 247 Ca 0.15 0.08 0.00 0.00 0.08 0.00 0.00 57.88 58.20 1yqj h LEU 247 Cb 0.52 0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.39 1yqj h LEU 247 CO 0.03 0.00 0.00 0.50 -1.08 0.00 0.00 178.44 177.89 1yqj h LYS 248 N 0.18 0.00 0.00 1.13 3.11 -1.30 -2.04 116.57 117.66 1yqj h LYS 248 Ca 0.21 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 58.05 1yqj h LYS 248 Cb 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.52 1yqj h LYS 248 CO -0.31 0.00 -0.13 0.87 -2.81 0.00 0.00 179.45 177.07 1yqj h LYS 249 N 0.00 0.00 -5.81 1.90 1.57 -0.80 -3.43 116.57 110.00 1yqj h LYS 249 Ca 0.00 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.19 1yqj h LYS 249 Cb 0.28 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.51 1yqj h LYS 249 CO 0.00 0.00 0.39 0.42 -0.57 0.00 0.00 179.45 179.69 1yqj s ILE 250 N -3.13 4.88 0.09 1.86 1.01 -0.77 -4.74 121.20 120.39 1yqj s ILE 250 Ca 0.09 1.53 -0.13 0.00 0.00 0.00 0.00 60.65 62.15 1yqj s ILE 250 Cb 0.11 -4.10 -0.20 0.00 0.01 0.00 0.00 42.46 38.28 1yqj s ILE 250 CO 0.63 -0.02 1.24 0.28 0.00 0.00 0.00 174.94 177.07 1yqj h SER 251 N 7.55 0.89 -2.78 3.58 0.02 -1.42 -3.44 113.55 117.94 1yqj h SER 251 Ca -0.26 -0.67 -0.54 0.00 -0.84 0.00 0.00 61.79 59.47 1yqj h SER 251 Cb 1.11 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.38 1yqj h SER 251 CO 0.85 1.47 0.94 -0.55 -1.14 0.00 0.00 176.83 178.40 1yqj s SER 252 N -7.22 6.75 0.24 3.07 0.15 -1.26 -4.88 113.70 110.56 1yqj s SER 252 Ca -0.10 2.21 0.02 0.00 0.70 0.00 0.00 55.95 58.78 1yqj s SER 252 Cb 0.08 -2.55 0.28 0.00 -1.71 0.00 0.00 66.02 62.11 1yqj s SER 252 CO 0.91 -0.81 1.61 -0.08 1.20 0.00 0.00 173.24 176.07 1yqj h GLU 253 N 8.37 0.41 -0.36 5.44 4.81 -1.98 -1.74 114.58 129.52 1yqj h GLU 253 Ca -0.39 -0.22 -0.05 0.00 -0.13 0.00 0.00 59.36 58.57 1yqj h GLU 253 Cb 1.18 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.56 1yqj h GLU 253 CO 0.93 0.79 0.03 1.03 -0.73 0.00 0.00 179.01 181.05 1yqj h SER 254 N 0.33 0.61 -0.89 1.04 0.87 -1.99 -0.45 113.55 113.07 1yqj h SER 254 Ca 0.02 -0.29 -0.01 0.00 -1.23 0.00 0.00 61.79 60.28 1yqj h SER 254 Cb 0.94 -0.16 -0.04 0.00 -0.44 0.00 0.00 62.40 62.70 1yqj h SER 254 CO 0.08 0.74 0.52 0.00 -0.53 0.00 0.00 176.83 177.64 1yqj h ALA 255 N 0.89 1.13 -0.43 6.23 0.00 -1.92 0.17 119.26 125.32 1yqj h ALA 255 Ca 0.11 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1yqj h ALA 255 Cb 0.41 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1yqj h ALA 255 CO 0.01 0.61 0.17 0.00 0.00 0.00 0.00 179.25 180.04 1yqj h ARG 256 N 1.23 0.65 -0.49 0.00 3.08 -1.06 0.14 114.38 117.93 1yqj h ARG 256 Ca 0.32 -0.12 -0.00 0.00 0.07 0.00 0.00 59.98 60.24 1yqj h ARG 256 Cb -0.02 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 1yqj h ARG 256 CO -0.06 0.60 0.29 -0.91 -1.07 0.00 0.00 179.97 178.83 1yqj h ASN 257 N 0.56 0.60 -0.07 7.04 2.35 -0.54 -1.68 115.58 123.83 1yqj h ASN 257 Ca 0.14 -0.06 -0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1yqj h ASN 257 Cb 0.20 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.41 1yqj h ASN 257 CO -0.01 0.48 0.04 0.22 -1.65 0.00 0.00 177.43 176.51 1yqj h TYR 258 N 0.66 0.10 -0.26 1.19 3.20 -0.33 -2.34 116.97 119.19 1yqj h TYR 258 Ca 0.18 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.11 1yqj h TYR 258 Cb -0.00 -0.03 -0.07 0.00 1.54 0.00 0.00 36.73 38.17 1yqj h TYR 258 CO -0.03 0.15 -0.19 0.82 -1.64 0.00 0.00 178.16 177.27 1yqj h ILE 259 N 0.01 0.47 0.00 1.81 1.08 -0.44 0.44 117.51 120.88 1yqj h ILE 259 Ca 0.02 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.49 1yqj h ILE 259 Cb 0.09 0.47 0.00 0.00 -3.07 0.00 0.00 36.82 34.31 1yqj h ILE 259 CO -0.00 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.46 1yqj n GLN 260 N -5.35 0.13 0.22 2.37 6.02 -0.66 -1.77 117.38 118.35 1yqj n GLN 260 Ca -0.00 0.52 0.11 0.00 -0.01 0.00 0.00 57.00 57.61 1yqj n GLN 260 Cb 0.26 -1.85 0.33 0.00 1.02 0.00 0.00 30.24 30.01 1yqj n GLN 260 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1yqj h SER 261 N 0.00 0.00 -3.85 1.08 4.64 -0.34 -3.45 113.55 111.63 1yqj h SER 261 Ca 0.00 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.85 1yqj h SER 261 Cb 0.15 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.21 1yqj h SER 261 CO 0.00 0.15 0.29 -0.76 -0.87 0.00 0.00 176.83 175.64 1yqj s LEU 262 N -6.39 4.27 0.16 5.97 1.43 -0.73 -5.00 118.68 118.39 1yqj s LEU 262 Ca 0.04 1.72 -0.31 0.00 -1.03 0.00 0.00 54.13 54.54 1yqj s LEU 262 Cb 0.08 -4.02 -0.09 0.00 0.03 0.00 0.00 46.19 42.19 1yqj s LEU 262 CO 0.65 -0.10 1.47 -0.89 0.23 0.00 0.00 176.35 177.71 1yqj s THR 263 N -1.70 2.92 0.37 5.49 2.01 -1.26 -4.93 115.64 118.54 1yqj s THR 263 Ca 0.51 0.68 -0.28 0.00 0.31 0.00 0.00 61.69 62.91 1yqj s THR 263 Cb -0.16 -3.43 -0.10 0.00 0.01 0.00 0.00 72.50 68.81 1yqj s THR 263 CO 0.21 0.06 1.40 -1.10 -0.69 0.00 0.00 174.62 174.51 1yqj s GLN 264 N 0.84 4.13 0.00 4.92 -0.21 -1.26 -4.94 119.66 123.14 1yqj s GLN 264 Ca 0.66 2.39 0.02 0.00 0.02 0.00 0.00 55.36 58.44 1yqj s GLN 264 Cb -0.40 -2.94 -0.01 0.00 1.00 0.00 0.00 33.01 30.66 1yqj s GLN 264 CO 0.33 -0.45 -0.06 -1.64 -2.12 0.00 0.00 175.29 171.35 1yqj s MET 265 N -2.05 0.46 0.64 2.91 -1.94 -1.26 -4.97 119.30 113.09 1yqj s MET 265 Ca 0.53 -0.26 -0.10 0.00 -1.71 0.00 0.00 55.69 54.15 1yqj s MET 265 Cb -0.43 -0.43 -0.00 0.00 2.01 0.00 0.00 34.83 35.98 1yqj s MET 265 CO 0.57 0.11 1.01 -1.25 -0.01 0.00 0.00 175.02 175.46 1yqj s PRO 266 N -0.29 3.08 0.24 2.03 0.04 -1.26 -0.77 135.00 138.08 1yqj s PRO 266 Ca 0.01 0.39 -0.30 0.00 0.04 0.00 0.00 61.00 61.14 1yqj s PRO 266 Cb -0.03 -2.12 -0.09 0.00 0.04 0.00 0.00 34.50 32.30 1yqj s PRO 266 CO -0.00 -0.79 1.31 0.21 0.04 0.00 0.00 177.00 177.77 1yqj s LYS 267 N -5.19 4.38 0.80 4.56 2.20 -1.26 -3.88 119.74 121.35 1yqj s LYS 267 Ca 0.56 2.11 -0.12 0.00 -0.36 0.00 0.00 55.97 58.16 1yqj s LYS 267 Cb -0.11 -3.15 0.07 0.00 -1.51 0.00 0.00 37.83 33.13 1yqj s LYS 267 CO 0.50 -0.23 1.10 -1.64 -0.36 0.00 0.00 175.35 174.72 1yqj s MET 268 N -0.65 2.04 -0.49 4.03 -1.94 0.55 -4.90 119.30 117.93 1yqj s MET 268 Ca 0.54 0.61 -0.24 0.00 -1.71 0.00 0.00 55.69 54.89 1yqj s MET 268 Cb -0.38 -1.91 0.03 0.00 2.01 0.00 0.00 34.83 34.58 1yqj s MET 268 CO 0.43 -1.65 0.88 1.21 -0.01 0.00 0.00 175.02 175.88 1yqj s ASN 269 N -3.92 6.41 0.52 3.03 3.84 -1.26 -4.91 114.94 118.65 1yqj s ASN 269 Ca 0.61 -0.15 0.20 0.00 0.21 0.00 0.00 52.86 53.73 1yqj s ASN 269 Cb -0.14 -2.42 1.37 0.00 -0.55 0.00 0.00 41.25 39.51 1yqj s ASN 269 CO 0.54 -1.07 2.14 -0.26 -2.79 0.00 0.00 177.10 175.66 1yqj h PHE 270 N 9.14 0.00 0.00 0.43 -1.00 -1.94 -0.49 116.94 123.08 1yqj h PHE 270 Ca -0.25 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.49 1yqj h PHE 270 Cb 1.08 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.63 1yqj h PHE 270 CO 0.86 0.04 -0.17 0.00 -1.61 0.00 0.00 178.31 177.43 1yqj h ALA 271 N 1.96 1.24 0.00 2.45 0.00 -1.91 0.36 119.26 123.35 1yqj h ALA 271 Ca -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1yqj h ALA 271 Cb 0.08 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1yqj h ALA 271 CO 0.01 0.22 -1.16 0.09 0.00 0.00 0.00 179.25 178.40 1yqj n ASN 272 N -3.64 0.58 0.02 0.00 5.03 -0.27 -3.85 115.26 113.13 1yqj n ASN 272 Ca -0.01 -0.23 -0.22 0.00 0.87 0.00 0.00 54.58 54.99 1yqj n ASN 272 Cb 0.30 0.97 -0.14 0.00 -1.02 0.00 0.00 39.78 39.89 1yqj n ASN 272 CO 0.00 0.00 0.00 0.58 -1.83 0.00 0.00 177.26 176.01 1yqj h VAL 273 N 0.00 0.71 -2.46 2.41 2.07 -0.57 -3.38 116.25 115.03 1yqj h VAL 273 Ca 0.00 -2.37 -0.74 0.00 0.82 0.00 0.00 66.70 64.41 1yqj h VAL 273 Cb 0.76 2.56 -0.32 0.00 -1.52 0.00 0.00 31.29 32.77 1yqj h VAL 273 CO 0.00 0.87 0.43 0.49 0.02 0.00 0.00 177.57 179.38 1yqj n PHE 274 N -3.55 2.95 -1.71 1.57 3.72 0.12 -5.04 117.46 115.52 1yqj n PHE 274 Ca -0.30 -3.04 -0.42 0.00 -0.05 0.00 0.00 57.45 53.63 1yqj n PHE 274 Cb 1.04 -1.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.55 1yqj n PHE 274 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1yqj s ILE 275 N -3.60 2.34 0.00 4.37 1.01 -1.25 -2.29 121.20 121.78 1yqj s ILE 275 Ca 0.38 0.01 0.00 0.00 0.00 0.00 0.00 60.65 61.05 1yqj s ILE 275 Cb 0.15 -3.01 0.00 0.00 0.01 0.00 0.00 42.46 39.62 1yqj s ILE 275 CO -0.04 0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.51 1yqj n GLY 276 N 4.17 1.41 3.83 6.18 0.00 -1.26 -5.03 105.19 114.48 1yqj n GLY 276 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1yqj n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yqj s ALA 277 N -3.33 2.90 -0.01 4.61 0.00 -0.97 -4.95 121.76 120.01 1yqj s ALA 277 Ca 0.00 0.24 -0.34 0.00 0.00 0.00 0.00 51.96 51.87 1yqj s ALA 277 Cb 0.00 -3.17 -0.12 0.00 0.00 0.00 0.00 23.12 19.83 1yqj s ALA 277 CO 0.00 -0.58 1.81 -1.71 0.00 0.00 0.00 175.76 175.27 1yqj n ASN 278 N -1.97 3.43 -0.17 0.00 2.85 -1.26 -4.83 115.26 113.30 1yqj n ASN 278 Ca 0.08 1.00 0.29 0.00 -0.11 0.00 0.00 54.58 55.83 1yqj n ASN 278 Cb 0.53 -1.40 0.72 0.00 1.24 0.00 0.00 39.78 40.87 1yqj n ASN 278 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1yqj h PRO 279 N 8.43 0.00 -0.05 1.20 0.11 -1.97 0.21 132.00 139.93 1yqj h PRO 279 Ca -0.48 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.42 1yqj h PRO 279 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1yqj h PRO 279 CO 0.93 0.00 -0.85 -0.07 -0.21 0.00 0.00 178.00 177.80 1yqj h LEU 280 N 0.00 0.60 -0.52 2.35 3.38 -1.99 -2.43 115.31 116.70 1yqj h LEU 280 Ca 0.43 -0.44 -0.14 0.00 0.09 0.00 0.00 57.88 57.82 1yqj h LEU 280 Cb 1.86 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 42.42 1yqj h LEU 280 CO -0.00 1.22 -0.28 0.00 0.09 0.00 0.00 178.44 179.47 1yqj h ALA 281 N 0.76 0.70 -0.69 1.53 0.00 -1.00 -1.94 119.26 118.63 1yqj h ALA 281 Ca -0.06 -0.41 -0.05 0.00 0.00 0.00 0.00 54.91 54.39 1yqj h ALA 281 Cb 1.47 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 1yqj h ALA 281 CO 0.15 0.67 0.25 0.28 0.00 0.00 0.00 179.25 180.60 1yqj h VAL 282 N 0.78 1.25 -0.20 0.00 2.07 -1.24 -0.92 116.25 117.99 1yqj h VAL 282 Ca 0.09 -0.82 -0.01 0.00 0.82 0.00 0.00 66.70 66.79 1yqj h VAL 282 Cb 0.84 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 1yqj h VAL 282 CO 0.07 0.32 0.09 -0.78 0.02 0.00 0.00 177.57 177.30 1yqj h ASP 283 N 0.99 0.26 -0.65 0.57 3.58 -1.25 -2.08 116.42 117.83 1yqj h ASP 283 Ca 0.23 -0.12 0.00 0.00 0.42 0.00 0.00 57.03 57.55 1yqj h ASP 283 Cb 0.25 -0.07 -0.03 0.00 1.72 0.00 0.00 39.33 41.20 1yqj h ASP 283 CO -0.01 0.31 0.42 0.25 -2.88 0.00 0.00 179.24 177.33 1yqj h LEU 284 N 0.19 0.76 -0.80 2.28 5.85 -1.18 -2.31 115.31 120.09 1yqj h LEU 284 Ca 0.07 -0.03 0.06 0.00 0.84 0.00 0.00 57.88 58.81 1yqj h LEU 284 Cb 0.12 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 40.90 1yqj h LEU 284 CO -0.01 0.56 0.49 -0.07 -0.34 0.00 0.00 178.44 179.07 1yqj h LEU 285 N 0.88 0.77 -1.72 2.25 3.38 -0.95 0.31 115.31 120.23 1yqj h LEU 285 Ca 0.24 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.19 1yqj h LEU 285 Cb -0.08 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1yqj h LEU 285 CO -0.05 0.49 -0.18 -0.33 0.09 0.00 0.00 178.44 178.47 1yqj h GLU 286 N 0.90 0.00 0.00 1.13 5.08 -0.89 0.97 114.58 121.76 1yqj h GLU 286 Ca 0.35 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.62 1yqj h GLU 286 Cb 0.16 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1yqj h GLU 286 CO -0.17 0.18 -0.43 0.87 -1.00 0.00 0.00 179.01 178.46 1yqj h LYS 287 N 0.00 0.00 0.10 2.33 6.56 -0.46 -3.34 116.57 121.75 1yqj h LYS 287 Ca -0.00 0.00 -0.36 0.00 -1.06 0.00 0.00 60.65 59.23 1yqj h LYS 287 Cb 0.37 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 32.01 1yqj h LYS 287 CO 0.02 0.43 -2.01 -1.33 -2.06 0.00 0.00 179.45 174.51 1yqj n MET 288 N -3.22 0.73 -1.62 3.15 2.81 -0.55 -1.89 117.12 116.52 1yqj n MET 288 Ca 0.02 0.28 -0.32 0.00 -1.81 0.00 0.00 57.70 55.87 1yqj n MET 288 Cb 0.70 -1.68 -0.05 0.00 -0.71 0.00 0.00 33.22 31.47 1yqj n MET 288 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1yqj n LEU 289 N -3.56 7.17 -4.65 4.03 4.77 0.27 -4.38 117.00 120.67 1yqj n LEU 289 Ca -0.34 -4.33 -0.36 0.00 -0.03 0.00 0.00 56.01 50.95 1yqj n LEU 289 Cb 1.00 -1.33 -0.10 0.00 -2.33 0.00 0.00 43.42 40.67 1yqj n LEU 289 CO 0.38 1.89 -0.19 -0.69 -1.33 0.00 0.00 177.39 177.45 1yqj s VAL 290 N -1.08 5.22 0.20 4.08 1.01 -1.26 -4.88 120.40 123.69 1yqj s VAL 290 Ca 0.59 0.13 -0.10 0.00 0.00 0.00 0.00 61.98 62.59 1yqj s VAL 290 Cb 0.28 -3.42 0.13 0.00 0.00 0.00 0.00 36.38 33.37 1yqj s VAL 290 CO -0.13 0.36 1.74 0.25 0.00 0.00 0.00 175.10 177.31 1yqj h LEU 291 N 7.43 0.16 -8.53 3.92 5.85 -1.90 -3.36 115.31 118.87 1yqj h LEU 291 Ca -0.38 0.08 -0.56 0.00 0.84 0.00 0.00 57.88 57.86 1yqj h LEU 291 Cb 1.17 0.08 -0.08 0.00 0.37 0.00 0.00 40.66 42.19 1yqj h LEU 291 CO 0.66 0.10 0.93 -0.62 -0.34 0.00 0.00 178.44 179.18 1yqj s ASP 292 N -5.37 6.39 0.59 1.25 -1.08 -1.26 -4.88 116.67 112.31 1yqj s ASP 292 Ca -0.13 -0.05 0.29 0.00 -0.52 0.00 0.00 52.55 52.14 1yqj s ASP 292 Cb 0.17 -2.54 1.44 0.00 -1.46 0.00 0.00 42.92 40.53 1yqj s ASP 292 CO 0.74 -1.50 1.85 0.77 0.52 0.00 0.00 175.17 177.55 1yqj h SER 293 N 9.59 0.00 0.66 -0.34 4.64 -1.97 0.26 113.55 126.38 1yqj h SER 293 Ca -0.26 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.06 1yqj h SER 293 Cb 1.06 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1yqj h SER 293 CO 1.19 0.00 -0.03 0.44 -0.87 0.00 0.00 176.83 177.56 1yqj h ASP 294 N 0.00 0.00 -0.31 4.97 3.45 -1.92 -2.73 116.42 119.89 1yqj h ASP 294 Ca 0.25 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.71 1yqj h ASP 294 Cb 1.33 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.10 1yqj h ASP 294 CO -0.00 0.03 0.00 0.29 -1.57 0.00 0.00 179.24 177.99 1yqj n LYS 295 N -3.19 2.25 -2.46 3.56 5.02 0.08 -4.99 118.16 118.44 1yqj n LYS 295 Ca -0.01 -1.93 -0.35 0.00 -2.02 0.00 0.00 58.31 54.00 1yqj n LYS 295 Cb 0.24 -1.32 -0.03 0.00 -0.02 0.00 0.00 35.03 33.91 1yqj n LYS 295 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1yqj s ARG 296 N -1.05 3.76 0.43 1.97 0.52 -1.03 -4.97 118.95 118.57 1yqj s ARG 296 Ca 0.25 1.48 -0.24 0.00 -0.52 0.00 0.00 55.73 56.70 1yqj s ARG 296 Cb 0.14 -2.18 -0.08 0.00 0.52 0.00 0.00 34.95 33.36 1yqj s ARG 296 CO 0.19 -0.49 1.21 -1.50 0.02 0.00 0.00 175.30 174.73 1yqj s ILE 297 N -1.84 2.97 0.44 1.52 2.07 -0.79 -5.02 121.20 120.54 1yqj s ILE 297 Ca 0.67 0.79 -0.04 0.00 -1.41 0.00 0.00 60.65 60.66 1yqj s ILE 297 Cb -0.20 -3.43 -0.04 0.00 0.13 0.00 0.00 42.46 38.92 1yqj s ILE 297 CO 0.24 0.05 0.72 0.42 -1.91 0.00 0.00 174.94 174.46 1yqj s THR 298 N -1.41 4.96 0.17 4.00 -4.23 -1.26 -4.90 115.64 112.97 1yqj s THR 298 Ca 0.60 0.03 -0.14 0.00 -1.18 0.00 0.00 61.69 60.99 1yqj s THR 298 Cb -0.32 -3.86 0.06 0.00 1.34 0.00 0.00 72.50 69.71 1yqj s THR 298 CO 0.40 -0.76 1.77 0.00 -0.54 0.00 0.00 174.62 175.48 1yqj h ALA 299 N 0.40 0.54 -0.51 3.99 0.00 -1.94 0.27 119.26 122.02 1yqj h ALA 299 Ca -0.48 0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.53 1yqj h ALA 299 Cb 1.21 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.93 1yqj h ALA 299 CO 0.62 -0.18 0.23 0.00 0.00 0.00 0.00 179.25 179.91 1yqj h ALA 300 N 1.26 0.65 -0.41 0.00 0.00 -1.93 -1.32 119.26 117.51 1yqj h ALA 300 Ca 0.20 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 55.05 1yqj h ALA 300 Cb 0.15 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1yqj h ALA 300 CO -0.17 -0.14 -0.17 1.96 0.00 0.00 0.00 179.25 180.73 1yqj h GLN 301 N 0.44 0.78 -0.74 0.00 4.20 -1.70 -3.10 115.11 114.99 1yqj h GLN 301 Ca 0.24 -0.29 -0.03 0.00 0.06 0.00 0.00 58.65 58.63 1yqj h GLN 301 Cb 0.20 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.90 1yqj h GLN 301 CO -0.20 0.89 0.34 0.00 -0.67 0.00 0.00 178.83 179.20 1yqj h ALA 302 N 1.12 0.96 -0.29 3.87 0.00 0.23 -2.49 119.26 122.67 1yqj h ALA 302 Ca 0.11 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 54.92 1yqj h ALA 302 Cb 0.67 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1yqj h ALA 302 CO 0.05 0.54 0.20 -0.07 0.00 0.00 0.00 179.25 179.97 1yqj h LEU 303 N 1.05 0.09 -0.62 0.00 3.38 -1.19 0.59 115.31 118.60 1yqj h LEU 303 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1yqj h LEU 303 Cb 0.14 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1yqj h LEU 303 CO -0.03 0.06 0.00 0.00 0.09 0.00 0.00 178.44 178.56 1yqj n ALA 304 N -2.57 2.57 -2.00 1.53 0.00 -0.94 -4.70 120.51 114.41 1yqj n ALA 304 Ca 0.03 -0.35 -0.41 0.00 0.00 0.00 0.00 53.44 52.71 1yqj n ALA 304 Cb 0.30 -1.21 -0.04 0.00 0.00 0.00 0.00 19.45 18.50 1yqj n ALA 304 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1yqj s HIS 305 N -1.91 3.48 0.60 0.00 5.04 0.20 -4.90 115.29 117.81 1yqj s HIS 305 Ca 0.33 1.52 0.28 0.00 -1.54 0.00 0.00 55.06 55.64 1yqj s HIS 305 Cb 0.17 -3.37 1.23 0.00 0.04 0.00 0.00 32.58 30.64 1yqj s HIS 305 CO 0.26 -0.96 1.62 0.00 -2.34 0.00 0.00 174.74 173.32 1yqj h ALA 306 N 4.91 2.53 0.00 1.58 0.00 -1.90 0.15 119.26 126.54 1yqj h ALA 306 Ca -0.45 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1yqj h ALA 306 Cb 1.21 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 1yqj h ALA 306 CO 0.72 -1.20 -0.09 -0.92 0.00 0.00 0.00 179.25 177.76 1yqj h TYR 307 N 0.00 0.00 -0.44 0.00 3.20 -1.90 -2.10 116.97 115.73 1yqj h TYR 307 Ca 0.34 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.21 1yqj h TYR 307 Cb 2.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 40.27 1yqj h TYR 307 CO 0.00 0.09 0.00 1.19 -1.64 0.00 0.00 178.16 177.80 1yqj n PHE 308 N -3.87 1.42 -0.33 -3.82 3.72 0.53 -4.69 117.46 110.42 1yqj n PHE 308 Ca -0.02 -0.76 0.17 0.00 -0.05 0.00 0.00 57.45 56.79 1yqj n PHE 308 Cb 0.18 -0.36 0.38 0.00 -0.94 0.00 0.00 39.48 38.74 1yqj n PHE 308 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1yqj h ALA 309 N 2.94 1.68 0.00 4.37 0.00 -1.46 0.37 119.26 127.16 1yqj h ALA 309 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1yqj h ALA 309 Cb 1.61 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.52 1yqj h ALA 309 CO 0.31 -0.39 0.00 0.37 0.00 0.00 0.00 179.25 179.54 1yqj h GLN 310 N 0.42 0.00 0.00 0.00 4.15 -1.85 -3.31 115.11 114.53 1yqj h GLN 310 Ca 0.63 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 60.02 1yqj h GLN 310 Cb 1.29 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.97 1yqj h GLN 310 CO -0.54 0.00 -1.29 0.66 -1.93 0.00 0.00 178.83 175.73 1yqj n TYR 311 N -2.71 0.00 -1.75 3.99 4.01 0.27 -5.04 117.16 115.93 1yqj n TYR 311 Ca 0.02 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.34 1yqj n TYR 311 Cb 0.32 -0.17 -0.03 0.00 -0.31 0.00 0.00 39.34 39.14 1yqj n TYR 311 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1yqj s HIS 312 N -2.29 2.78 -0.30 -0.72 2.46 0.10 -4.99 115.29 112.34 1yqj s HIS 312 Ca -0.02 0.31 0.01 0.00 0.47 0.00 0.00 55.06 55.82 1yqj s HIS 312 Cb 0.03 -4.12 0.14 0.00 -0.13 0.00 0.00 32.58 28.50 1yqj s HIS 312 CO 0.22 -4.32 0.34 0.34 -2.47 0.00 0.00 174.74 168.85 1yqj s ASP 313 N 1.47 1.29 0.66 9.88 2.15 -1.26 -4.98 116.67 125.87 1yqj s ASP 313 Ca 0.75 -0.81 0.31 0.00 0.43 0.00 0.00 52.55 53.24 1yqj s ASP 313 Cb -0.48 0.66 1.69 0.00 -0.30 0.00 0.00 42.92 44.49 1yqj s ASP 313 CO 0.33 -0.36 1.96 1.55 -0.17 0.00 0.00 175.17 178.48 1yqj h PRO 314 N 8.04 0.00 -0.03 4.34 0.13 -1.96 0.41 132.00 142.93 1yqj h PRO 314 Ca -0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 1yqj h PRO 314 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1yqj h PRO 314 CO 0.30 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 177.82 1yqj n ASP 315 N -3.00 2.03 -0.85 1.44 10.43 -1.26 -4.13 116.55 121.21 1yqj n ASP 315 Ca -0.01 -1.68 0.05 0.00 2.57 0.00 0.00 54.79 55.72 1yqj n ASP 315 Cb 0.37 -0.01 0.11 0.00 1.84 0.00 0.00 41.12 43.44 1yqj n ASP 315 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 1yqj n ASP 316 N 0.59 1.37 -3.64 -2.24 2.03 0.14 -4.88 116.55 109.92 1yqj n ASP 316 Ca 0.17 -2.96 -0.27 0.00 0.52 0.00 0.00 54.79 52.25 1yqj n ASP 316 Cb 0.44 -0.41 -0.11 0.00 -0.72 0.00 0.00 41.12 40.32 1yqj n ASP 316 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1yqj n GLU 317 N -0.48 1.11 -1.53 -0.67 1.02 -1.18 -4.94 120.64 113.97 1yqj n GLU 317 Ca 0.12 -3.89 -0.34 0.00 -0.02 0.00 0.00 57.16 53.03 1yqj n GLU 317 Cb 0.85 -1.99 0.08 0.00 -0.02 0.00 0.00 31.44 30.36 1yqj n GLU 317 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 1yqj s PRO 318 N -0.84 2.33 0.48 3.49 0.02 -1.26 -4.99 135.00 134.23 1yqj s PRO 318 Ca 0.29 1.67 0.06 0.00 0.02 0.00 0.00 61.00 63.04 1yqj s PRO 318 Cb 0.01 -1.87 -0.00 0.00 0.02 0.00 0.00 34.50 32.66 1yqj s PRO 318 CO -0.18 -1.67 0.31 0.14 -0.33 0.00 0.00 177.00 175.28 1yqj s VAL 319 N -2.06 2.02 0.29 3.83 -7.23 -1.26 -4.12 120.40 111.85 1yqj s VAL 319 Ca 0.72 -1.54 0.07 0.00 -1.81 0.00 0.00 61.98 59.42 1yqj s VAL 319 Cb -0.27 -2.56 -0.03 0.00 0.56 0.00 0.00 36.38 34.08 1yqj s VAL 319 CO 0.44 0.00 0.26 0.00 -0.31 0.00 0.00 175.10 175.49 1yqj s ALA 320 N -2.67 3.75 0.69 1.32 0.00 -1.26 -5.00 121.76 118.60 1yqj s ALA 320 Ca 0.37 -1.49 -0.12 0.00 0.00 0.00 0.00 51.96 50.72 1yqj s ALA 320 Cb -0.00 -1.32 0.01 0.00 0.00 0.00 0.00 23.12 21.81 1yqj s ALA 320 CO 0.22 0.14 1.07 -0.51 0.00 0.00 0.00 175.76 176.69 1yqj s ASP 321 N -3.93 5.20 0.42 0.00 -0.00 -1.26 -4.68 116.67 112.41 1yqj s ASP 321 Ca 0.37 1.75 -0.25 0.00 -0.00 0.00 0.00 52.55 54.41 1yqj s ASP 321 Cb -0.07 -2.51 -0.10 0.00 -0.00 0.00 0.00 42.92 40.23 1yqj s ASP 321 CO 0.26 -1.56 1.23 -2.65 -0.00 0.00 0.00 175.17 172.44 1yqj n PRO 322 N -2.95 1.82 -4.07 8.23 -0.02 -1.26 -4.73 135.00 132.03 1yqj n PRO 322 Ca 0.08 0.65 -0.32 0.00 -2.02 0.00 0.00 63.50 61.89 1yqj n PRO 322 Cb 0.53 -2.32 -0.15 0.00 -0.02 0.00 0.00 33.50 31.54 1yqj n PRO 322 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1yqj s TYR 323 N -1.21 3.26 -0.40 6.00 5.04 -1.26 -5.09 117.35 123.71 1yqj s TYR 323 Ca 0.61 -2.31 -0.28 0.00 -2.44 0.00 0.00 57.07 52.65 1yqj s TYR 323 Cb -0.52 -1.93 0.02 0.00 0.35 0.00 0.00 41.96 39.88 1yqj s TYR 323 CO 0.58 -0.88 1.05 0.34 -1.34 0.00 0.00 175.55 175.30 1yqj s ASP 324 N 1.10 6.73 -0.21 4.32 -1.08 -1.26 -4.88 116.67 121.39 1yqj s ASP 324 Ca -0.09 0.66 0.14 0.00 -0.52 0.00 0.00 52.55 52.75 1yqj s ASP 324 Cb -0.20 -2.52 0.49 0.00 -1.46 0.00 0.00 42.92 39.23 1yqj s ASP 324 CO -0.05 -1.01 1.40 0.00 0.52 0.00 0.00 175.17 176.03 1yqj n GLN 325 N 7.19 2.34 0.13 4.34 10.64 -1.26 -4.68 117.38 136.08 1yqj n GLN 325 Ca 0.10 -2.93 0.16 0.00 -1.83 0.00 0.00 57.00 52.51 1yqj n GLN 325 Cb 0.48 -1.79 0.72 0.00 -0.86 0.00 0.00 30.24 28.79 1yqj n GLN 325 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1yqj h SER 326 N 1.29 0.00 0.08 2.61 4.64 -2.02 0.73 113.55 120.88 1yqj h SER 326 Ca 0.07 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1yqj h SER 326 Cb 1.46 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.55 1yqj h SER 326 CO 0.25 0.00 -0.02 2.19 -0.87 0.00 0.00 176.83 178.38 1yqj h PHE 327 N 0.00 0.00 -0.81 4.77 -0.00 -1.96 -2.22 116.94 116.73 1yqj h PHE 327 Ca 0.14 0.00 0.06 0.00 -0.00 0.00 0.00 57.97 58.17 1yqj h PHE 327 Cb 0.59 0.00 -0.05 0.00 -0.00 0.00 0.00 35.95 36.49 1yqj h PHE 327 CO 0.00 0.02 0.53 0.93 -0.00 0.00 0.00 178.31 179.79 1yqj h GLU 328 N 0.00 0.87 -0.54 6.09 4.39 -1.23 0.80 114.58 124.96 1yqj h GLU 328 Ca -0.00 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.65 1yqj h GLU 328 Cb 0.07 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 28.52 1yqj h GLU 328 CO 0.00 0.58 0.00 -1.13 -1.16 0.00 0.00 179.01 177.30 1yqj n SER 329 N -4.48 2.97 -4.89 1.42 3.41 -0.84 -4.92 113.62 106.31 1yqj n SER 329 Ca 0.12 -2.13 -0.33 0.00 -0.26 0.00 0.00 58.87 56.27 1yqj n SER 329 Cb 0.20 -0.39 -0.05 0.00 -0.26 0.00 0.00 64.21 63.70 1yqj n SER 329 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1yqj s ARG 330 N -1.50 3.63 -0.19 4.33 3.52 0.27 -5.09 118.95 123.92 1yqj s ARG 330 Ca 0.34 -0.04 -0.02 0.00 -0.13 0.00 0.00 55.73 55.88 1yqj s ARG 330 Cb 0.19 -2.99 -0.00 0.00 -1.56 0.00 0.00 34.95 30.59 1yqj s ARG 330 CO 0.20 0.57 -0.10 0.34 -0.81 0.00 0.00 175.30 175.51 1yqj s ASP 331 N -1.98 3.98 0.13 -2.12 2.15 -1.26 -5.02 116.67 112.55 1yqj s ASP 331 Ca 0.33 -0.43 -0.04 0.00 0.43 0.00 0.00 52.55 52.85 1yqj s ASP 331 Cb -0.13 -1.65 -0.03 0.00 -0.30 0.00 0.00 42.92 40.81 1yqj s ASP 331 CO 0.20 0.03 0.12 -0.76 -0.17 0.00 0.00 175.17 174.60 1yqj s LEU 332 N 1.14 1.57 0.70 -1.34 1.43 -1.26 -5.15 118.68 115.77 1yqj s LEU 332 Ca 0.01 -1.06 -0.10 0.00 -1.03 0.00 0.00 54.13 51.95 1yqj s LEU 332 Cb -0.14 0.60 0.03 0.00 0.03 0.00 0.00 46.19 46.70 1yqj s LEU 332 CO -0.03 -0.77 1.06 -0.76 0.23 0.00 0.00 176.35 176.09 1yqj s LEU 333 N -3.00 2.88 0.14 1.79 1.43 -1.26 -4.86 118.68 115.80 1yqj s LEU 333 Ca 0.20 0.90 -0.26 0.00 -1.03 0.00 0.00 54.13 53.93 1yqj s LEU 333 Cb 0.06 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.65 1yqj s LEU 333 CO -0.00 -1.42 1.60 0.40 0.23 0.00 0.00 176.35 177.16 1yqj h ILE 334 N -0.62 0.25 -0.00 -0.59 2.04 -1.92 -1.34 117.51 115.32 1yqj h ILE 334 Ca -0.45 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.41 1yqj h ILE 334 Cb 1.28 0.25 -0.00 0.00 -0.74 0.00 0.00 36.82 37.60 1yqj h ILE 334 CO 0.63 0.00 0.00 0.44 0.00 0.00 0.00 178.15 179.23 1yqj h ASP 335 N -0.39 0.00 0.57 1.72 3.32 -1.96 0.97 116.42 120.65 1yqj h ASP 335 Ca 0.11 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.91 1yqj h ASP 335 Cb 0.56 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.11 1yqj h ASP 335 CO -0.39 0.00 -1.10 -0.33 -1.72 0.00 0.00 179.24 175.70 1yqj h GLU 336 N 0.00 0.28 -0.18 3.56 5.08 -1.66 -0.89 114.58 120.78 1yqj h GLU 336 Ca 0.00 -0.40 -0.16 0.00 -1.00 0.00 0.00 59.36 57.80 1yqj h GLU 336 Cb 0.01 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1yqj h GLU 336 CO -0.00 1.14 -0.57 -1.49 -1.00 0.00 0.00 179.01 177.09 1yqj h TRP 337 N 0.11 0.69 -0.34 4.33 -0.00 -0.23 -2.08 115.95 118.43 1yqj h TRP 337 Ca -0.10 -0.25 -0.12 0.00 -0.00 0.00 0.00 58.89 58.42 1yqj h TRP 337 Cb 1.79 -0.13 -0.01 0.00 -0.00 0.00 0.00 29.16 30.81 1yqj h TRP 337 CO 0.05 0.99 -0.29 -0.22 -0.00 0.00 0.00 178.44 178.97 1yqj h LYS 338 N 0.42 0.72 -0.42 0.49 3.64 -0.80 -1.83 116.57 118.78 1yqj h LYS 338 Ca 0.00 -0.32 -0.13 0.00 -1.27 0.00 0.00 60.65 58.94 1yqj h LYS 338 Cb 1.11 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.90 1yqj h LYS 338 CO 0.11 0.93 -0.23 1.03 -2.27 0.00 0.00 179.45 179.01 1yqj h SER 339 N 0.61 0.94 -0.59 4.20 0.87 -1.00 -0.47 113.55 118.11 1yqj h SER 339 Ca 0.07 -0.41 -0.04 0.00 -1.23 0.00 0.00 61.79 60.18 1yqj h SER 339 Cb 0.81 -0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 62.48 1yqj h SER 339 CO 0.07 1.14 0.23 -0.07 -0.53 0.00 0.00 176.83 177.67 1yqj h LEU 340 N 0.73 0.85 0.12 2.23 3.38 -1.26 -1.14 115.31 120.21 1yqj h LEU 340 Ca 0.09 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1yqj h LEU 340 Cb 0.80 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1yqj h LEU 340 CO 0.07 0.78 -0.06 0.74 0.09 0.00 0.00 178.44 180.05 1yqj h THR 341 N 0.90 1.04 -0.98 0.22 2.02 -1.09 -2.41 112.91 112.61 1yqj h THR 341 Ca 0.21 -0.70 0.13 0.00 0.77 0.00 0.00 66.41 66.83 1yqj h THR 341 Cb 0.21 1.47 -0.09 0.00 -1.74 0.00 0.00 68.15 68.01 1yqj h THR 341 CO -0.02 0.17 0.62 0.22 0.37 0.00 0.00 175.52 176.88 1yqj h TYR 342 N -0.49 1.08 -0.71 3.16 3.20 -0.84 -0.13 116.97 122.23 1yqj h TYR 342 Ca -0.02 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 1yqj h TYR 342 Cb 0.40 -0.34 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 1yqj h TYR 342 CO 0.03 0.40 0.36 -0.44 -1.64 0.00 0.00 178.16 176.87 1yqj h ASP 343 N 0.91 0.91 0.04 -2.11 5.19 -1.11 -1.80 116.42 118.46 1yqj h ASP 343 Ca 0.50 -0.12 -0.12 0.00 -0.62 0.00 0.00 57.03 56.67 1yqj h ASP 343 Cb 0.58 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 39.85 1yqj h ASP 343 CO -0.27 0.77 -0.40 -0.33 -3.12 0.00 0.00 179.24 175.90 1yqj h GLU 344 N 0.99 0.46 0.15 3.56 4.39 -0.67 -2.58 114.58 120.87 1yqj h GLU 344 Ca 0.25 -0.22 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 1yqj h GLU 344 Cb 0.08 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1yqj h GLU 344 CO -0.03 0.78 -0.07 0.28 -1.16 0.00 0.00 179.01 178.80 1yqj h VAL 345 N 0.38 0.99 0.00 3.13 2.07 -0.60 -3.07 116.25 119.14 1yqj h VAL 345 Ca 0.04 -0.66 0.00 0.00 0.82 0.00 0.00 66.70 66.90 1yqj h VAL 345 Cb 0.86 1.39 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 1yqj h VAL 345 CO 0.07 0.15 0.00 0.16 0.02 0.00 0.00 177.57 177.98 1yqj h ILE 346 N -0.52 0.00 -0.28 4.57 3.07 -1.38 -2.90 117.51 120.07 1yqj h ILE 346 Ca -0.02 -0.30 0.00 0.00 1.55 0.00 0.00 64.86 66.09 1yqj h ILE 346 Cb 0.41 1.10 0.00 0.00 -0.27 0.00 0.00 36.82 38.05 1yqj h ILE 346 CO 0.03 0.00 0.00 -1.54 -1.05 0.00 0.00 178.15 175.59 1yqj n SER 347 N -2.30 3.04 -4.73 2.16 3.41 -0.97 -4.97 113.62 109.26 1yqj n SER 347 Ca 0.03 -1.94 -0.42 0.00 -0.26 0.00 0.00 58.87 56.28 1yqj n SER 347 Cb 0.27 -0.18 -0.02 0.00 -0.26 0.00 0.00 64.21 64.02 1yqj n SER 347 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1yqj s PHE 348 N -1.64 2.89 -0.20 7.33 5.36 -1.10 -5.00 117.98 125.62 1yqj s PHE 348 Ca 0.36 0.56 -0.02 0.00 -0.96 0.00 0.00 56.93 56.87 1yqj s PHE 348 Cb 0.21 -4.07 -0.00 0.00 -0.34 0.00 0.00 43.02 38.82 1yqj s PHE 348 CO 0.31 -3.87 -0.09 0.08 -1.46 0.00 0.00 175.22 170.19 1yqj s VAL 349 N 0.73 3.03 0.75 3.12 1.01 -1.26 -5.06 120.40 122.72 1yqj s VAL 349 Ca 0.70 -0.62 -0.15 0.00 0.00 0.00 0.00 61.98 61.91 1yqj s VAL 349 Cb -0.48 -2.35 0.05 0.00 0.00 0.00 0.00 36.38 33.60 1yqj s VAL 349 CO 0.38 0.46 1.24 -2.16 0.00 0.00 0.00 175.10 175.02 1yqj s PRO 350 N 1.31 1.97 0.45 2.72 0.04 -1.26 -4.94 135.00 135.28 1yqj s PRO 350 Ca 0.04 1.88 -0.25 0.00 0.04 0.00 0.00 61.00 62.71 1yqj s PRO 350 Cb -0.14 -1.80 -0.08 0.00 0.04 0.00 0.00 34.50 32.52 1yqj s PRO 350 CO -0.05 -2.00 1.32 -2.14 0.04 0.00 0.00 177.00 174.18 1yqj s PRO 351 N -3.85 3.72 0.00 0.56 0.02 -1.26 -5.16 135.00 129.03 1yqj s PRO 351 Ca 0.77 2.18 0.00 0.00 0.02 0.00 0.00 61.00 63.97 1yqj s PRO 351 Cb -0.32 -2.60 0.00 0.00 0.02 0.00 0.00 34.50 31.60 1yqj s PRO 351 CO 0.47 -0.71 0.38 -2.30 -0.33 0.00 0.00 177.00 174.51