#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yqr n GLU 10 N 0.00 0.13 -4.44 -1.46 4.71 -1.26 -4.87 120.64 113.45 1yqr n GLU 10 Ca 0.00 0.20 -0.25 0.00 -0.01 0.00 0.00 57.16 57.10 1yqr n GLU 10 Cb 0.00 -1.68 -0.09 0.00 -1.01 0.00 0.00 31.44 28.66 1yqr n GLU 10 CO 0.00 0.00 0.00 -0.06 0.09 0.00 0.00 177.13 177.16 1yqr s PHE 11 N -3.10 2.46 0.00 -0.32 0.40 -1.26 -5.07 117.98 111.09 1yqr s PHE 11 Ca 0.10 -0.43 0.00 0.00 -0.60 0.00 0.00 56.93 56.00 1yqr s PHE 11 Cb 0.13 -1.35 0.00 0.00 0.51 0.00 0.00 43.02 42.31 1yqr s PHE 11 CO 0.49 0.57 0.00 0.41 0.70 0.00 0.00 175.22 177.38 1yqr n GLY 12 N -0.83 -1.41 3.75 4.36 0.00 -1.26 -4.84 105.19 104.95 1yqr n GLY 12 Ca -0.05 -1.55 -0.41 0.00 0.00 0.00 0.00 46.02 44.01 1yqr n GLY 12 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1yqr s HIS 13 N -1.33 3.09 0.64 1.61 3.76 -1.26 -4.78 115.29 117.02 1yqr s HIS 13 Ca 0.00 1.16 -0.10 0.00 -0.15 0.00 0.00 55.06 55.98 1yqr s HIS 13 Cb 0.00 -3.73 -0.00 0.00 1.11 0.00 0.00 32.58 29.96 1yqr s HIS 13 CO 0.00 -2.28 1.02 1.03 -0.85 0.00 0.00 174.74 173.66 1yqr s ARG 14 N -0.61 3.11 0.12 1.40 0.52 -1.26 -5.07 118.95 117.16 1yqr s ARG 14 Ca 0.56 0.42 0.04 0.00 -0.52 0.00 0.00 55.73 56.23 1yqr s ARG 14 Cb -0.40 -2.11 -0.04 0.00 0.52 0.00 0.00 34.95 32.92 1yqr s ARG 14 CO 0.44 -0.79 -0.10 0.95 0.02 0.00 0.00 175.30 175.82 1yqr s THR 15 N -3.20 1.01 0.38 0.02 -4.23 -1.26 -4.98 115.64 103.37 1yqr s THR 15 Ca 0.56 -1.88 0.05 0.00 -1.18 0.00 0.00 61.69 59.24 1yqr s THR 15 Cb -0.11 -1.64 0.25 0.00 1.34 0.00 0.00 72.50 72.34 1yqr s THR 15 CO 0.50 -0.70 2.02 0.25 -0.54 0.00 0.00 174.62 176.15 1yqr h LEU 16 N 3.10 0.55 -0.09 4.79 5.85 -1.99 -2.93 115.31 124.59 1yqr h LEU 16 Ca -0.37 -0.03 -0.21 0.00 0.84 0.00 0.00 57.88 58.12 1yqr h LEU 16 Cb 1.19 -0.14 0.01 0.00 0.37 0.00 0.00 40.66 42.09 1yqr h LEU 16 CO 0.60 0.43 -0.77 0.00 -0.34 0.00 0.00 178.44 178.37 1yqr h ALA 17 N 1.66 0.22 -0.01 1.25 0.00 -1.98 -3.21 119.26 117.18 1yqr h ALA 17 Ca 0.17 -0.60 -0.14 0.00 0.00 0.00 0.00 54.91 54.34 1yqr h ALA 17 Cb -0.01 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1yqr h ALA 17 CO -0.03 0.59 -0.65 0.66 0.00 0.00 0.00 179.25 179.81 1yqr h SER 18 N 0.36 0.05 -2.01 0.00 4.64 -1.95 -3.38 113.55 111.26 1yqr h SER 18 Ca -0.07 -0.03 -0.51 0.00 -0.47 0.00 0.00 61.79 60.71 1yqr h SER 18 Cb 1.41 -0.01 -0.40 0.00 -0.31 0.00 0.00 62.40 63.09 1yqr h SER 18 CO 0.16 0.69 -1.14 0.35 -0.87 0.00 0.00 176.83 176.02 1yqr n THR 19 N -3.78 -0.18 -0.29 2.95 -2.24 -1.12 -4.34 114.28 105.28 1yqr n THR 19 Ca -0.01 -4.44 0.11 0.00 -2.27 0.00 0.00 64.05 57.44 1yqr n THR 19 Cb 0.64 -0.93 0.26 0.00 -2.10 0.00 0.00 70.33 68.20 1yqr n THR 19 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1yqr h PRO 20 N 3.37 0.20 0.00 -0.78 0.11 -1.74 -1.00 132.00 132.16 1yqr h PRO 20 Ca 0.09 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1yqr h PRO 20 Cb 0.91 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.98 1yqr h PRO 20 CO 0.50 0.13 0.00 0.00 -0.21 0.00 0.00 178.00 178.43 1yqr n ALA 21 N -2.73 1.70 1.10 -0.75 0.00 -1.26 -2.52 120.51 116.04 1yqr n ALA 21 Ca 0.20 -0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.70 1yqr n ALA 21 Cb 0.63 -1.23 0.14 0.00 0.00 0.00 0.00 19.45 19.00 1yqr n ALA 21 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1yqr n LEU 22 N -1.42 1.74 -4.71 0.00 4.77 -0.38 -3.97 117.00 113.03 1yqr n LEU 22 Ca 0.05 -0.60 -0.33 0.00 -0.03 0.00 0.00 56.01 55.10 1yqr n LEU 22 Cb 0.14 -0.04 -0.08 0.00 -2.33 0.00 0.00 43.42 41.11 1yqr n LEU 22 CO 0.12 0.32 -0.30 0.26 -1.33 0.00 0.00 177.39 176.46 1yqr s TRP 23 N -2.45 3.13 0.05 -1.77 0.52 -1.05 -4.21 118.94 113.17 1yqr s TRP 23 Ca 0.21 0.11 0.05 0.00 0.02 0.00 0.00 56.10 56.50 1yqr s TRP 23 Cb 0.19 -1.68 -0.02 0.00 -1.15 0.00 0.00 33.47 30.80 1yqr s TRP 23 CO 0.53 0.49 -0.15 0.00 0.02 0.00 0.00 176.95 177.84 1yqr s ALA 24 N -1.13 1.25 0.35 0.98 0.00 -0.49 -4.88 121.76 117.83 1yqr s ALA 24 Ca 0.21 -0.89 0.08 0.00 0.00 0.00 0.00 51.96 51.36 1yqr s ALA 24 Cb -0.12 -0.18 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 1yqr s ALA 24 CO 0.12 0.23 0.22 -1.54 0.00 0.00 0.00 175.76 174.79 1yqr s SER 25 N -1.27 4.93 -0.07 0.00 1.04 -1.26 -0.40 113.70 116.67 1yqr s SER 25 Ca 0.02 -0.67 -0.00 0.00 0.48 0.00 0.00 55.95 55.77 1yqr s SER 25 Cb -0.08 -0.80 0.02 0.00 0.10 0.00 0.00 66.02 65.26 1yqr s SER 25 CO 0.02 -0.35 -0.04 -0.63 0.98 0.00 0.00 173.24 173.21 1yqr s ILE 26 N -2.39 0.64 -0.05 -1.02 1.01 0.38 -4.95 121.20 114.82 1yqr s ILE 26 Ca 0.40 -0.10 -0.34 0.00 0.00 0.00 0.00 60.65 60.61 1yqr s ILE 26 Cb -0.04 -0.70 -0.12 0.00 0.01 0.00 0.00 42.46 41.62 1yqr s ILE 26 CO 0.24 0.28 1.85 -2.65 0.00 0.00 0.00 174.94 174.67 1yqr n PRO 27 N 4.64 2.23 -3.15 2.79 -0.02 -1.26 -1.24 135.00 139.00 1yqr n PRO 27 Ca -0.15 0.82 0.05 0.00 -2.02 0.00 0.00 63.50 62.19 1yqr n PRO 27 Cb 0.50 -2.66 -0.00 0.00 -0.02 0.00 0.00 33.50 31.32 1yqr n PRO 27 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yqr s PRO 29 N 2.90 2.95 0.53 0.00 0.04 -1.25 -3.48 135.00 136.69 1yqr s PRO 29 Ca 0.16 1.58 0.19 0.00 0.04 0.00 0.00 61.00 62.97 1yqr s PRO 29 Cb -0.08 -1.95 1.38 0.00 0.04 0.00 0.00 34.50 33.88 1yqr s PRO 29 CO -0.22 -1.17 2.16 0.00 0.04 0.00 0.00 177.00 177.81 1yqr h ARG 30 N 0.54 0.00 0.00 4.56 3.08 -1.69 0.43 114.38 121.31 1yqr h ARG 30 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.56 1yqr h ARG 30 Cb 1.27 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.32 1yqr h ARG 30 CO 0.55 0.02 0.00 0.66 -1.07 0.00 0.00 179.97 180.12 1yqr h SER 31 N 0.00 0.00 0.33 7.04 4.64 -1.91 -1.91 113.55 121.75 1yqr h SER 31 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1yqr h SER 31 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1yqr h SER 31 CO 0.00 0.00 -1.32 -0.62 -0.87 0.00 0.00 176.83 174.03 1yqr n GLU 32 N -2.87 0.41 -3.57 4.77 -0.58 0.12 -3.29 120.64 115.63 1yqr n GLU 32 Ca -0.01 -0.05 -0.01 0.00 -0.42 0.00 0.00 57.16 56.67 1yqr n GLU 32 Cb 0.18 -1.59 -0.06 0.00 -0.57 0.00 0.00 31.44 29.40 1yqr n GLU 32 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 1yqr s LEU 33 N -4.20 -0.60 -0.34 -4.62 2.96 -0.72 -4.74 118.68 106.42 1yqr s LEU 33 Ca 0.00 0.91 0.04 0.00 -0.22 0.00 0.00 54.13 54.86 1yqr s LEU 33 Cb 0.14 1.80 0.10 0.00 0.50 0.00 0.00 46.19 48.73 1yqr s LEU 33 CO 0.84 -0.14 0.06 -0.13 -1.32 0.00 0.00 176.35 175.66 1yqr s ARG 34 N 1.80 1.44 0.24 1.98 1.81 -0.13 -4.39 118.95 121.70 1yqr s ARG 34 Ca -0.07 -1.85 -0.04 0.00 -1.72 0.00 0.00 55.73 52.04 1yqr s ARG 34 Cb -0.05 -3.13 0.46 0.00 -0.45 0.00 0.00 34.95 31.78 1yqr s ARG 34 CO -0.16 -0.95 1.71 -0.07 -0.68 0.00 0.00 175.30 175.15 1yqr h LEU 35 N 7.60 0.18 -0.01 2.53 3.38 -1.94 -0.05 115.31 127.00 1yqr h LEU 35 Ca -0.05 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1yqr h LEU 35 Cb 1.02 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1yqr h LEU 35 CO 0.52 0.05 0.00 -0.90 0.09 0.00 0.00 178.44 178.20 1yqr n ASP 36 N -5.06 0.01 -0.06 -0.43 5.75 -1.26 -1.27 116.55 114.22 1yqr n ASP 36 Ca 0.14 0.50 0.06 0.00 -0.01 0.00 0.00 54.79 55.48 1yqr n ASP 36 Cb 0.43 -0.50 -0.05 0.00 -1.03 0.00 0.00 41.12 39.97 1yqr n ASP 36 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1yqr n LEU 37 N -1.51 0.74 -0.04 -2.12 4.77 -0.10 -4.63 117.00 114.11 1yqr n LEU 37 Ca 0.03 -0.56 -0.06 0.00 -0.03 0.00 0.00 56.01 55.39 1yqr n LEU 37 Cb 0.14 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.21 1yqr n LEU 37 CO 0.11 0.17 -0.45 0.52 -1.33 0.00 0.00 177.39 176.41 1yqr n VAL 38 N -1.05 1.37 -0.34 4.08 0.31 -0.77 -4.53 118.33 117.40 1yqr n VAL 38 Ca 0.03 0.22 0.11 0.00 -0.01 0.00 0.00 64.34 64.69 1yqr n VAL 38 Cb 0.20 -2.04 0.30 0.00 -0.91 0.00 0.00 33.84 31.39 1yqr n VAL 38 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1yqr h LEU 39 N -0.61 0.75 -3.00 7.52 4.07 -1.44 -2.64 115.31 119.97 1yqr h LEU 39 Ca -0.02 0.09 0.00 0.00 0.08 0.00 0.00 57.88 58.03 1yqr h LEU 39 Cb 0.65 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 42.35 1yqr h LEU 39 CO -0.01 0.28 0.00 -0.81 -1.08 0.00 0.00 178.44 176.82 1yqr n PRO 40 N -4.78 3.20 -0.34 1.13 -0.04 -1.26 -4.58 135.00 128.33 1yqr n PRO 40 Ca 0.22 -2.62 0.06 0.00 -0.04 0.00 0.00 63.50 61.12 1yqr n PRO 40 Cb 0.53 -1.65 0.22 0.00 -0.04 0.00 0.00 33.50 32.56 1yqr n PRO 40 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1yqr n SER 41 N 0.90 2.96 0.00 3.54 7.64 -0.99 -4.92 113.62 122.75 1yqr n SER 41 Ca 0.21 -2.19 0.00 0.00 1.01 0.00 0.00 58.87 57.90 1yqr n SER 41 Cb 0.71 -0.41 0.00 0.00 -1.01 0.00 0.00 64.21 63.50 1yqr n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1yqr n GLY 42 N 0.96 0.86 0.05 0.23 0.00 -1.26 -4.79 105.19 101.24 1yqr n GLY 42 Ca 0.16 -0.19 -0.04 0.00 0.00 0.00 0.00 46.02 45.95 1yqr n GLY 42 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1yqr n GLN 43 N -2.24 0.28 -4.47 1.61 6.02 -1.26 -4.93 117.38 112.38 1yqr n GLN 43 Ca 0.00 0.27 -0.33 0.00 -0.01 0.00 0.00 57.00 56.93 1yqr n GLN 43 Cb 0.00 -1.17 -0.10 0.00 1.02 0.00 0.00 30.24 29.99 1yqr n GLN 43 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1yqr s SER 44 N -4.94 4.76 -0.10 1.08 0.15 -1.26 -5.01 113.70 108.37 1yqr s SER 44 Ca -0.12 -0.06 0.15 0.00 0.70 0.00 0.00 55.95 56.61 1yqr s SER 44 Cb 0.02 -1.18 0.48 0.00 -1.71 0.00 0.00 66.02 63.63 1yqr s SER 44 CO 0.18 0.31 1.40 0.49 1.20 0.00 0.00 173.24 176.83 1yqr n PHE 45 N 1.77 0.88 -1.19 3.44 3.01 -1.26 -4.63 117.46 119.47 1yqr n PHE 45 Ca -0.16 -0.69 0.01 0.00 1.01 0.00 0.00 57.45 57.62 1yqr n PHE 45 Cb 0.53 -0.20 0.23 0.00 -0.01 0.00 0.00 39.48 40.03 1yqr n PHE 45 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1yqr n ARG 46 N 0.16 2.48 -5.22 -1.08 5.12 -1.26 -4.77 116.66 112.09 1yqr n ARG 46 Ca 0.18 -3.00 -0.32 0.00 -1.93 0.00 0.00 57.85 52.79 1yqr n ARG 46 Cb 0.72 -1.87 -0.17 0.00 -1.16 0.00 0.00 32.46 29.99 1yqr n ARG 46 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1yqr s TRP 47 N -3.03 2.52 -0.02 -1.55 0.52 -1.26 -4.26 118.94 111.85 1yqr s TRP 47 Ca 0.44 -0.88 0.04 0.00 0.02 0.00 0.00 56.10 55.72 1yqr s TRP 47 Cb 0.38 -1.66 -0.01 0.00 -1.15 0.00 0.00 33.47 31.03 1yqr s TRP 47 CO 0.05 -0.32 -0.15 1.03 0.02 0.00 0.00 176.95 177.59 1yqr s ARG 48 N 0.10 1.32 -1.31 4.98 0.52 -0.63 -4.81 118.95 119.13 1yqr s ARG 48 Ca -0.12 -0.52 -0.16 0.00 -0.52 0.00 0.00 55.73 54.42 1yqr s ARG 48 Cb -0.16 -1.23 0.10 0.00 0.52 0.00 0.00 34.95 34.18 1yqr s ARG 48 CO 0.06 0.27 1.76 -1.91 0.02 0.00 0.00 175.30 175.50 1yqr n GLU 49 N 2.92 3.21 -0.04 3.54 2.13 -1.26 -0.68 120.64 130.47 1yqr n GLU 49 Ca -0.16 -3.32 0.03 0.00 0.66 0.00 0.00 57.16 54.37 1yqr n GLU 49 Cb 0.54 -3.32 0.37 0.00 0.27 0.00 0.00 31.44 29.30 1yqr n GLU 49 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 1yqr h GLN 50 N 7.07 0.63 -5.72 5.31 1.08 -1.81 -3.42 115.11 118.25 1yqr h GLN 50 Ca 0.44 -0.05 -0.50 0.00 -1.45 0.00 0.00 58.65 57.09 1yqr h GLN 50 Cb 0.81 -0.14 -0.23 0.00 -0.05 0.00 0.00 27.48 27.87 1yqr h GLN 50 CO 1.50 0.45 -0.81 -1.12 -0.95 0.00 0.00 178.83 177.90 1yqr s SER 51 N -6.63 2.08 0.03 1.46 0.01 -1.22 -5.05 113.70 104.38 1yqr s SER 51 Ca -0.09 -0.57 -0.38 0.00 1.31 0.00 0.00 55.95 56.23 1yqr s SER 51 Cb 0.17 -0.12 -0.17 0.00 0.21 0.00 0.00 66.02 66.10 1yqr s SER 51 CO 0.75 0.04 1.32 -0.81 0.41 0.00 0.00 173.24 174.95 1yqr n PRO 52 N 1.53 0.88 -0.76 12.44 -0.04 -1.26 0.15 135.00 147.94 1yqr n PRO 52 Ca -0.19 0.32 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 1yqr n PRO 52 Cb 0.54 -1.93 0.00 0.00 -0.04 0.00 0.00 33.50 32.07 1yqr n PRO 52 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1yqr n ALA 53 N 2.56 0.00 -3.60 0.55 0.00 -1.26 -4.96 120.51 113.80 1yqr n ALA 53 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.29 1yqr n ALA 53 Cb 0.16 -0.83 -0.14 0.00 0.00 0.00 0.00 19.45 18.63 1yqr n ALA 53 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1yqr s HIS 54 N -1.67 2.98 -0.20 0.00 3.76 0.12 -4.36 115.29 115.91 1yqr s HIS 54 Ca 0.00 -1.16 -0.06 0.00 -0.15 0.00 0.00 55.06 53.69 1yqr s HIS 54 Cb 0.00 -2.08 -0.03 0.00 1.11 0.00 0.00 32.58 31.58 1yqr s HIS 54 CO 0.00 -0.62 0.02 -1.58 -0.85 0.00 0.00 174.74 171.71 1yqr s TRP 55 N 1.42 3.08 0.02 1.40 0.52 0.36 -2.22 118.94 123.53 1yqr s TRP 55 Ca 0.04 -0.34 0.05 0.00 0.02 0.00 0.00 56.10 55.88 1yqr s TRP 55 Cb -0.15 -2.11 -0.03 0.00 -1.15 0.00 0.00 33.47 30.03 1yqr s TRP 55 CO -0.04 -0.18 -0.14 -1.12 0.02 0.00 0.00 176.95 175.50 1yqr s SER 56 N 0.97 4.12 -0.08 2.95 0.01 0.15 0.26 113.70 122.08 1yqr s SER 56 Ca 0.02 -0.31 -0.31 0.00 1.31 0.00 0.00 55.95 56.67 1yqr s SER 56 Cb -0.14 -0.80 0.11 0.00 0.21 0.00 0.00 66.02 65.40 1yqr s SER 56 CO 0.02 0.27 1.37 -0.83 0.41 0.00 0.00 173.24 174.48 1yqr s GLY 57 N -1.39 -0.28 -0.09 3.44 0.00 -0.60 -1.60 107.32 106.80 1yqr s GLY 57 Ca 0.15 0.36 -0.20 0.00 0.00 0.00 0.00 44.72 45.03 1yqr s GLY 57 CO 0.06 4.82 0.58 0.14 0.00 0.00 0.00 173.10 178.70 1yqr s VAL 58 N -2.03 5.12 -0.04 1.40 1.01 -1.26 -1.14 120.40 123.46 1yqr s VAL 58 Ca 0.27 1.17 -0.02 0.00 0.00 0.00 0.00 61.98 63.41 1yqr s VAL 58 Cb 0.02 -3.92 0.03 0.00 0.00 0.00 0.00 36.38 32.52 1yqr s VAL 58 CO -0.04 0.30 0.07 -0.22 0.00 0.00 0.00 175.10 175.22 1yqr s LEU 59 N 0.66 0.43 -1.39 3.92 0.20 0.16 -4.86 118.68 117.80 1yqr s LEU 59 Ca 0.31 0.13 -0.04 0.00 0.69 0.00 0.00 54.13 55.21 1yqr s LEU 59 Cb -0.16 -0.01 0.03 0.00 -0.43 0.00 0.00 46.19 45.61 1yqr s LEU 59 CO 0.14 -0.21 0.74 0.00 -0.29 0.00 0.00 176.35 176.73 1yqr n ALA 60 N 4.89 -1.80 -1.29 5.97 0.00 -1.26 -1.88 120.51 125.14 1yqr n ALA 60 Ca -0.13 -0.08 -0.10 0.00 0.00 0.00 0.00 53.44 53.13 1yqr n ALA 60 Cb 0.50 -2.59 -0.04 0.00 0.00 0.00 0.00 19.45 17.32 1yqr n ALA 60 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1yqr n ASP 61 N -2.98 -4.96 -4.10 0.00 8.00 -1.26 -4.99 116.55 106.26 1yqr n ASP 61 Ca -0.20 0.25 -0.10 0.00 0.71 0.00 0.00 54.79 55.45 1yqr n ASP 61 Cb 0.63 -3.34 -0.10 0.00 -0.02 0.00 0.00 41.12 38.29 1yqr n ASP 61 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1yqr s GLN 62 N -2.66 0.63 0.11 -1.24 -0.21 -0.79 -5.06 119.66 110.45 1yqr s GLN 62 Ca 0.00 -1.09 -0.22 0.00 0.02 0.00 0.00 55.36 54.07 1yqr s GLN 62 Cb 0.00 -0.03 -0.07 0.00 1.00 0.00 0.00 33.01 33.90 1yqr s GLN 62 CO 0.00 -0.04 0.66 0.08 -2.12 0.00 0.00 175.29 173.87 1yqr s VAL 63 N -3.03 4.58 0.08 1.09 1.01 -1.25 0.35 120.40 123.23 1yqr s VAL 63 Ca 0.02 1.43 -0.02 0.00 0.00 0.00 0.00 61.98 63.42 1yqr s VAL 63 Cb 0.01 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 1yqr s VAL 63 CO -0.05 0.54 0.02 0.26 0.00 0.00 0.00 175.10 175.86 1yqr s TRP 64 N -1.09 0.56 -0.04 5.22 0.52 -0.29 -1.45 118.94 122.37 1yqr s TRP 64 Ca 0.32 -1.06 0.03 0.00 0.02 0.00 0.00 56.10 55.41 1yqr s TRP 64 Cb -0.21 -0.37 0.01 0.00 -1.15 0.00 0.00 33.47 31.75 1yqr s TRP 64 CO 0.22 -0.44 -0.11 0.99 0.02 0.00 0.00 176.95 177.64 1yqr s THR 65 N -3.95 0.98 0.08 2.01 2.01 -0.78 -1.56 115.64 114.44 1yqr s THR 65 Ca 0.11 -0.43 0.07 0.00 0.31 0.00 0.00 61.69 61.75 1yqr s THR 65 Cb 0.07 -0.89 -0.03 0.00 0.01 0.00 0.00 72.50 71.67 1yqr s THR 65 CO -0.07 0.31 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.22 1yqr s LEU 66 N 0.43 2.26 -0.04 4.42 1.43 0.14 -2.35 118.68 124.97 1yqr s LEU 66 Ca -0.09 -0.62 -0.30 0.00 -1.03 0.00 0.00 54.13 52.09 1yqr s LEU 66 Cb -0.12 -0.80 0.07 0.00 0.03 0.00 0.00 46.19 45.36 1yqr s LEU 66 CO 0.02 0.05 0.66 0.28 0.23 0.00 0.00 176.35 177.58 1yqr s THR 67 N -1.10 0.00 0.18 5.49 -1.32 -0.85 -0.49 115.64 117.55 1yqr s THR 67 Ca 0.04 -0.02 0.07 0.00 -1.21 0.00 0.00 61.69 60.58 1yqr s THR 67 Cb -0.10 -0.98 -0.04 0.00 -1.51 0.00 0.00 72.50 69.87 1yqr s THR 67 CO 0.03 -0.01 -0.15 0.00 -2.21 0.00 0.00 174.62 172.28 1yqr s GLN 68 N -1.27 1.25 0.15 7.08 -2.07 -1.26 0.16 119.66 123.70 1yqr s GLN 68 Ca -0.11 -1.47 0.01 0.00 -1.82 0.00 0.00 55.36 51.96 1yqr s GLN 68 Cb -0.00 -1.11 0.01 0.00 -1.09 0.00 0.00 33.01 30.82 1yqr s GLN 68 CO 0.09 0.20 0.05 0.25 -1.32 0.00 0.00 175.29 174.56 1yqr n THR 69 N -0.04 0.00 -0.28 3.63 -2.24 0.49 -4.97 114.28 110.87 1yqr n THR 69 Ca -0.11 -0.68 -0.00 0.00 -2.27 0.00 0.00 64.05 60.99 1yqr n THR 69 Cb 0.59 -0.09 0.20 0.00 -2.10 0.00 0.00 70.33 68.93 1yqr n THR 69 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1yqr h GLU 70 N 0.00 1.11 -0.00 -0.78 4.57 -2.00 -3.28 114.58 114.19 1yqr h GLU 70 Ca -0.11 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.00 1yqr h GLU 70 Cb 0.38 -0.25 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 1yqr h GLU 70 CO 0.19 0.73 -0.04 0.39 -1.18 0.00 0.00 179.01 179.10 1yqr n GLU 71 N -4.41 2.56 -4.29 1.92 -0.58 -1.26 -2.49 120.64 112.09 1yqr n GLU 71 Ca 0.10 -0.33 -0.21 0.00 -0.42 0.00 0.00 57.16 56.29 1yqr n GLU 71 Cb 0.03 -0.83 -0.13 0.00 -0.57 0.00 0.00 31.44 29.95 1yqr n GLU 71 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 1yqr s GLN 72 N -0.61 1.01 -0.33 3.49 -1.52 -1.23 -1.16 119.66 119.31 1yqr s GLN 72 Ca 0.01 -1.00 -0.07 0.00 -1.95 0.00 0.00 55.36 52.35 1yqr s GLN 72 Cb 0.01 -1.12 0.02 0.00 -0.22 0.00 0.00 33.01 31.71 1yqr s GLN 72 CO 0.04 0.26 0.11 -1.17 -0.25 0.00 0.00 175.29 174.29 1yqr s LEU 73 N -1.64 4.18 -0.13 2.90 2.96 -0.37 -0.38 118.68 126.20 1yqr s LEU 73 Ca 0.03 -0.92 -0.17 0.00 -0.22 0.00 0.00 54.13 52.85 1yqr s LEU 73 Cb -0.10 -1.90 -0.04 0.00 0.50 0.00 0.00 46.19 44.65 1yqr s LEU 73 CO 0.03 -0.28 0.43 -1.00 -1.32 0.00 0.00 176.35 174.22 1yqr s HIS 74 N 1.47 3.50 0.08 5.38 3.76 0.12 -0.47 115.29 129.14 1yqr s HIS 74 Ca 0.01 0.83 0.08 0.00 -0.15 0.00 0.00 55.06 55.82 1yqr s HIS 74 Cb -0.18 -2.50 -0.03 0.00 1.11 0.00 0.00 32.58 30.97 1yqr s HIS 74 CO 0.03 0.19 -0.20 0.00 -0.85 0.00 0.00 174.74 173.92 1yqr s THR 76 N -1.07 0.01 0.14 0.00 -1.32 -0.99 -1.40 115.64 111.01 1yqr s THR 76 Ca 0.06 -0.12 0.11 0.00 -1.21 0.00 0.00 61.69 60.53 1yqr s THR 76 Cb -0.10 -0.27 -0.04 0.00 -1.51 0.00 0.00 72.50 70.58 1yqr s THR 76 CO 0.03 -0.06 -0.26 -0.69 -2.21 0.00 0.00 174.62 171.43 1yqr s VAL 77 N -0.16 2.30 -0.36 5.08 1.01 -1.26 -1.87 120.40 125.14 1yqr s VAL 77 Ca -0.02 -1.78 0.03 0.00 0.00 0.00 0.00 61.98 60.20 1yqr s VAL 77 Cb -0.02 -2.03 0.11 0.00 0.00 0.00 0.00 36.38 34.43 1yqr s VAL 77 CO 0.00 0.07 0.09 -0.31 0.00 0.00 0.00 175.10 174.95 1yqr s TYR 78 N -1.14 3.22 0.00 5.22 1.51 -0.53 -4.84 117.35 120.79 1yqr s TYR 78 Ca 0.15 -2.76 0.00 0.00 -1.01 0.00 0.00 57.07 53.45 1yqr s TYR 78 Cb -0.10 -2.64 0.00 0.00 -0.11 0.00 0.00 41.96 39.12 1yqr s TYR 78 CO 0.07 -0.90 0.00 0.54 -1.11 0.00 0.00 175.55 174.14 1yqr n ARG 79 N 4.18 0.00 -0.80 -0.62 1.74 -1.26 -3.92 116.66 115.98 1yqr n ARG 79 Ca 0.03 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.21 1yqr n ARG 79 Cb 0.40 -0.05 -0.05 0.00 -1.02 0.00 0.00 32.46 31.75 1yqr n ARG 79 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1yqr n SER 83 N 0.00 -4.51 -4.75 0.55 3.41 -1.26 -4.92 113.62 102.14 1yqr n SER 83 Ca 0.00 0.73 -0.42 0.00 -0.26 0.00 0.00 58.87 58.92 1yqr n SER 83 Cb 0.00 -2.70 -0.01 0.00 -0.26 0.00 0.00 64.21 61.24 1yqr n SER 83 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1yqr n GLN 84 N -3.38 2.70 -1.78 4.33 -0.00 -1.26 -4.92 117.38 113.08 1yqr n GLN 84 Ca -0.04 0.96 -0.42 0.00 -0.00 0.00 0.00 57.00 57.50 1yqr n GLN 84 Cb 0.38 -2.73 -0.02 0.00 -0.00 0.00 0.00 30.24 27.87 1yqr n GLN 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1yqr s ALA 85 N -0.24 3.79 0.13 2.61 0.00 -1.26 -4.99 121.76 121.80 1yqr s ALA 85 Ca 0.62 1.56 -0.12 0.00 0.00 0.00 0.00 51.96 54.01 1yqr s ALA 85 Cb -0.49 -3.66 0.01 0.00 0.00 0.00 0.00 23.12 18.99 1yqr s ALA 85 CO 0.52 -0.95 0.32 -1.54 0.00 0.00 0.00 175.76 174.11 1yqr s SER 86 N 0.70 -0.07 0.86 0.00 1.04 -1.26 -5.06 113.70 109.92 1yqr s SER 86 Ca 0.66 -0.55 -0.11 0.00 0.48 0.00 0.00 55.95 56.43 1yqr s SER 86 Cb -0.48 0.43 0.12 0.00 0.10 0.00 0.00 66.02 66.19 1yqr s SER 86 CO 0.43 -0.84 1.17 0.00 0.98 0.00 0.00 173.24 174.97 1yqr s ARG 87 N -3.86 1.34 0.45 4.02 1.04 -1.25 -4.74 118.95 115.94 1yqr s ARG 87 Ca 0.07 1.62 -0.24 0.00 -1.04 0.00 0.00 55.73 56.14 1yqr s ARG 87 Cb 0.03 -1.76 -0.07 0.00 -2.04 0.00 0.00 34.95 31.11 1yqr s ARG 87 CO -0.09 -2.41 1.21 -2.14 -0.04 0.00 0.00 175.30 171.84 1yqr s PRO 88 N -4.45 3.78 0.66 3.89 0.02 -1.26 -4.98 135.00 132.66 1yqr s PRO 88 Ca 0.69 1.91 -0.08 0.00 0.02 0.00 0.00 61.00 63.54 1yqr s PRO 88 Cb -0.25 -2.51 0.03 0.00 0.02 0.00 0.00 34.50 31.79 1yqr s PRO 88 CO 0.55 -0.57 0.99 0.95 -0.33 0.00 0.00 177.00 178.59 1yqr s THR 89 N -1.44 3.22 0.27 0.99 -4.23 -1.26 -4.87 115.64 108.33 1yqr s THR 89 Ca 0.62 0.07 -0.00 0.00 -1.18 0.00 0.00 61.69 61.20 1yqr s THR 89 Cb -0.32 -3.34 0.27 0.00 1.34 0.00 0.00 72.50 70.46 1yqr s THR 89 CO 0.40 -0.38 1.85 -0.65 -0.54 0.00 0.00 174.62 175.29 1yqr h PRO 90 N -0.44 1.01 -0.18 3.99 0.11 -1.98 -0.19 132.00 134.31 1yqr h PRO 90 Ca -0.45 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 65.54 1yqr h PRO 90 Cb 1.27 -0.23 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 1yqr h PRO 90 CO 0.62 0.67 -0.11 -0.44 -0.21 0.00 0.00 178.00 178.53 1yqr h ASP 91 N 1.04 0.41 0.03 -2.05 3.45 -1.99 -0.92 116.42 116.38 1yqr h ASP 91 Ca 0.47 -0.43 -0.05 0.00 0.43 0.00 0.00 57.03 57.45 1yqr h ASP 91 Cb 0.38 -0.11 -0.01 0.00 -0.56 0.00 0.00 39.33 39.02 1yqr h ASP 91 CO -0.24 0.75 -0.12 -0.33 -1.57 0.00 0.00 179.24 177.73 1yqr h GLU 92 N 0.07 0.22 -0.27 3.56 5.08 -1.88 -1.23 114.58 120.12 1yqr h GLU 92 Ca 0.04 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.24 1yqr h GLU 92 Cb 0.60 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 1yqr h GLU 92 CO 0.03 0.36 -0.27 1.25 -1.00 0.00 0.00 179.01 179.37 1yqr h LEU 93 N 0.21 0.55 -1.35 1.33 5.85 -0.77 -1.89 115.31 119.25 1yqr h LEU 93 Ca 0.04 -0.20 -0.06 0.00 0.84 0.00 0.00 57.88 58.50 1yqr h LEU 93 Cb 0.36 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 1yqr h LEU 93 CO 0.02 0.81 -0.30 -0.33 -0.34 0.00 0.00 178.44 178.30 1yqr h GLU 94 N 0.48 0.00 -0.67 1.25 4.39 0.01 -1.75 114.58 118.30 1yqr h GLU 94 Ca 0.06 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.72 1yqr h GLU 94 Cb 0.72 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.34 1yqr h GLU 94 CO 0.06 0.30 0.22 0.00 -1.16 0.00 0.00 179.01 178.42 1yqr h ALA 95 N 1.70 1.13 -0.17 3.43 0.00 -0.76 0.68 119.26 125.26 1yqr h ALA 95 Ca -0.00 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 1yqr h ALA 95 Cb 0.63 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1yqr h ALA 95 CO 0.04 0.60 -0.04 0.28 0.00 0.00 0.00 179.25 180.13 1yqr h VAL 96 N 0.98 1.29 -0.44 0.00 2.07 -1.19 -1.27 116.25 117.68 1yqr h VAL 96 Ca 0.22 -1.02 -0.02 0.00 0.82 0.00 0.00 66.70 66.71 1yqr h VAL 96 Cb 0.26 1.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 1yqr h VAL 96 CO -0.01 0.30 0.20 0.03 0.02 0.00 0.00 177.57 178.11 1yqr h ARG 97 N 0.04 0.62 -0.11 1.57 3.08 -1.05 -1.80 114.38 116.73 1yqr h ARG 97 Ca 0.04 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 59.99 1yqr h ARG 97 Cb 0.48 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.41 1yqr h ARG 97 CO 0.02 0.50 -0.04 -0.22 -1.07 0.00 0.00 179.97 179.16 1yqr h LYS 98 N 0.62 0.22 -1.00 0.04 3.64 -0.71 -1.00 116.57 118.40 1yqr h LYS 98 Ca 0.16 -0.09 0.14 0.00 -1.27 0.00 0.00 60.65 59.59 1yqr h LYS 98 Cb 0.09 -0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 31.81 1yqr h LYS 98 CO -0.02 0.54 0.62 -0.92 -2.27 0.00 0.00 179.45 177.41 1yqr h TYR 99 N -0.11 1.10 -0.24 1.91 3.20 -0.68 -0.15 116.97 122.00 1yqr h TYR 99 Ca 0.03 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1yqr h TYR 99 Cb 0.46 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 38.39 1yqr h TYR 99 CO 0.06 0.38 0.00 1.19 -1.64 0.00 0.00 178.16 178.15 1yqr n PHE 100 N -4.65 0.31 -4.01 -3.82 3.01 -0.73 -0.18 117.46 107.39 1yqr n PHE 100 Ca 0.20 -0.15 -0.27 0.00 1.01 0.00 0.00 57.45 58.24 1yqr n PHE 100 Cb 0.42 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.86 1yqr n PHE 100 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1yqr n GLN 101 N 0.84 -3.12 0.10 -1.08 6.02 -0.07 -4.81 117.38 115.27 1yqr n GLN 101 Ca 0.17 0.38 0.08 0.00 -0.01 0.00 0.00 57.00 57.62 1yqr n GLN 101 Cb 0.46 -4.52 0.39 0.00 1.02 0.00 0.00 30.24 27.59 1yqr n GLN 101 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1yqr n LEU 102 N -4.42 0.38 0.13 1.08 4.77 -0.78 -1.29 117.00 116.87 1yqr n LEU 102 Ca -0.27 0.66 0.13 0.00 -0.03 0.00 0.00 56.01 56.50 1yqr n LEU 102 Cb 0.67 -0.69 0.42 0.00 -2.33 0.00 0.00 43.42 41.49 1yqr n LEU 102 CO 0.77 -0.74 0.88 0.44 -1.33 0.00 0.00 177.39 177.41 1yqr h ASP 103 N 0.00 0.00 -3.49 -1.43 3.32 -1.88 -3.41 116.42 109.53 1yqr h ASP 103 Ca 0.00 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.45 1yqr h ASP 103 Cb 0.06 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 39.51 1yqr h ASP 103 CO 0.00 0.00 0.46 -0.69 -1.72 0.00 0.00 179.24 177.29 1yqr s VAL 104 N -3.20 4.69 -0.41 -1.35 1.01 -0.42 -4.99 120.40 115.74 1yqr s VAL 104 Ca 0.08 1.06 -0.29 0.00 0.00 0.00 0.00 61.98 62.83 1yqr s VAL 104 Cb 0.11 -4.24 0.02 0.00 0.00 0.00 0.00 36.38 32.26 1yqr s VAL 104 CO 0.54 -0.43 1.24 -0.89 0.00 0.00 0.00 175.10 175.56 1yqr s THR 105 N 3.20 4.14 0.30 3.92 2.01 -1.26 -4.90 115.64 123.05 1yqr s THR 105 Ca 0.34 1.21 0.01 0.00 0.31 0.00 0.00 61.69 63.56 1yqr s THR 105 Cb -0.13 -4.38 0.15 0.00 0.01 0.00 0.00 72.50 68.15 1yqr s THR 105 CO 0.17 -0.77 1.84 0.25 -0.69 0.00 0.00 174.62 175.41 1yqr h LEU 106 N 11.30 0.63 -1.81 4.42 5.85 -1.90 -2.60 115.31 131.21 1yqr h LEU 106 Ca -0.25 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.33 1yqr h LEU 106 Cb 1.08 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.94 1yqr h LEU 106 CO 1.09 0.68 -0.05 0.00 -0.34 0.00 0.00 178.44 179.81 1yqr h ALA 107 N 1.40 1.84 -0.22 1.25 0.00 -1.91 -0.37 119.26 121.26 1yqr h ALA 107 Ca 0.14 -0.07 -0.19 0.00 0.00 0.00 0.00 54.91 54.78 1yqr h ALA 107 Cb 0.34 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1yqr h ALA 107 CO 0.01 0.12 -0.60 1.96 0.00 0.00 0.00 179.25 180.74 1yqr h GLN 108 N 0.05 0.81 -0.03 0.00 1.08 -1.88 -2.16 115.11 112.98 1yqr h GLN 108 Ca 0.01 -0.57 -0.01 0.00 -1.45 0.00 0.00 58.65 56.64 1yqr h GLN 108 Cb 0.13 0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 27.65 1yqr h GLN 108 CO 0.01 1.19 -0.01 -0.07 -0.95 0.00 0.00 178.83 178.99 1yqr h LEU 109 N 0.56 0.07 -1.00 1.46 3.38 -1.35 -2.51 115.31 115.92 1yqr h LEU 109 Ca -0.01 -0.40 0.11 0.00 0.09 0.00 0.00 57.88 57.67 1yqr h LEU 109 Cb 1.22 -0.02 -0.08 0.00 0.09 0.00 0.00 40.66 41.87 1yqr h LEU 109 CO 0.13 0.45 0.63 1.88 0.09 0.00 0.00 178.44 181.62 1yqr h TYR 110 N -0.31 1.15 0.13 1.13 -1.99 -1.14 0.29 116.97 116.22 1yqr h TYR 110 Ca 0.01 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.76 1yqr h TYR 110 Cb 0.42 -0.37 0.00 0.00 2.00 0.00 0.00 36.73 38.79 1yqr h TYR 110 CO 0.06 0.48 -0.06 1.25 -0.00 0.00 0.00 178.16 179.89 1yqr h HIS 111 N 1.02 -0.16 0.75 4.88 -0.00 -1.33 0.74 115.15 121.06 1yqr h HIS 111 Ca 0.48 -0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.82 1yqr h HIS 111 Cb 0.43 0.05 -0.00 0.00 -0.00 0.00 0.00 27.41 27.89 1yqr h HIS 111 CO -0.00 -0.00 -0.43 1.25 -0.00 0.00 0.00 177.93 178.74 1yqr h HIS 112 N -0.28 -1.14 -0.87 5.26 -0.00 -0.90 -0.47 115.15 116.76 1yqr h HIS 112 Ca -0.02 -0.02 0.16 0.00 -0.00 0.00 0.00 60.37 60.49 1yqr h HIS 112 Cb 0.22 0.40 -0.10 0.00 -0.00 0.00 0.00 27.41 27.93 1yqr h HIS 112 CO -0.04 -0.66 0.45 -1.49 -0.00 0.00 0.00 177.93 176.19 1yqr h TRP 113 N -1.11 0.78 -0.94 5.26 6.55 -0.99 -0.05 115.95 125.46 1yqr h TRP 113 Ca -0.10 0.03 0.01 0.00 0.95 0.00 0.00 58.89 59.79 1yqr h TRP 113 Cb 0.88 -0.22 -0.05 0.00 -0.86 0.00 0.00 29.16 28.92 1yqr h TRP 113 CO -0.08 0.17 0.62 0.78 -1.05 0.00 0.00 178.44 178.88 1yqr h GLY 114 N 0.62 1.32 1.12 1.49 0.00 -0.39 -1.34 103.07 105.89 1yqr h GLY 114 Ca 0.48 -0.49 -0.12 0.00 0.00 0.00 0.00 47.33 47.20 1yqr h GLY 114 CO -0.38 0.48 -0.16 1.76 0.00 0.00 0.00 176.54 178.24 1yqr h SER 115 N 1.26 1.02 -0.06 0.19 0.02 0.66 -3.12 113.55 113.53 1yqr h SER 115 Ca 0.35 -0.36 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1yqr h SER 115 Cb -0.14 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.12 1yqr h SER 115 CO -0.08 1.16 0.00 1.33 -1.14 0.00 0.00 176.83 178.10 1yqr n VAL 116 N -4.13 0.05 -3.31 2.27 0.24 -0.90 -4.74 118.33 107.82 1yqr n VAL 116 Ca 0.01 -0.33 -0.09 0.00 -2.04 0.00 0.00 64.34 61.88 1yqr n VAL 116 Cb 0.43 0.69 -0.06 0.00 -1.47 0.00 0.00 33.84 33.43 1yqr n VAL 116 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1yqr s ASP 117 N -1.91 0.43 0.34 -1.34 3.68 -0.52 -5.00 116.67 112.35 1yqr s ASP 117 Ca 0.35 -0.45 0.07 0.00 2.13 0.00 0.00 52.55 54.65 1yqr s ASP 117 Cb 0.20 1.08 0.77 0.00 -1.45 0.00 0.00 42.92 43.52 1yqr s ASP 117 CO 0.32 -0.35 1.85 -1.28 0.13 0.00 0.00 175.17 175.84 1yqr h SER 118 N 8.10 0.72 -0.23 -0.34 0.87 -1.85 -1.12 113.55 119.70 1yqr h SER 118 Ca -0.08 0.05 -0.14 0.00 -1.23 0.00 0.00 61.79 60.39 1yqr h SER 118 Cb 1.12 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.98 1yqr h SER 118 CO 0.26 0.35 -0.37 -0.74 -0.53 0.00 0.00 176.83 175.80 1yqr h HIS 119 N 0.75 0.91 -0.33 2.24 -0.00 -1.93 -2.59 115.15 114.20 1yqr h HIS 119 Ca 0.48 -0.26 -0.00 0.00 -0.00 0.00 0.00 60.37 60.59 1yqr h HIS 119 Cb 0.72 -0.20 -0.02 0.00 -0.00 0.00 0.00 27.41 27.92 1yqr h HIS 119 CO -0.00 1.02 0.20 0.35 -0.00 0.00 0.00 177.93 179.50 1yqr h PHE 120 N 0.63 0.42 -0.95 5.26 3.57 -1.55 -2.26 116.94 122.06 1yqr h PHE 120 Ca 0.06 0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.66 1yqr h PHE 120 Cb 0.92 -0.14 -0.07 0.00 2.79 0.00 0.00 35.95 39.45 1yqr h PHE 120 CO 0.05 0.30 0.61 0.37 -2.23 0.00 0.00 178.31 177.40 1yqr h GLN 121 N 0.43 0.95 0.40 1.11 4.15 -1.25 0.25 115.11 121.14 1yqr h GLN 121 Ca 0.12 -0.06 -0.02 0.00 0.77 0.00 0.00 58.65 59.46 1yqr h GLN 121 Cb -0.01 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.47 1yqr h GLN 121 CO -0.02 0.63 -0.19 0.93 -1.93 0.00 0.00 178.83 178.24 1yqr h GLU 122 N 0.97 -0.51 -0.66 1.69 5.08 -1.02 -2.80 114.58 117.33 1yqr h GLU 122 Ca 0.45 0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.78 1yqr h GLU 122 Cb 0.40 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.74 1yqr h GLU 122 CO -0.21 -0.31 0.16 0.28 -1.00 0.00 0.00 179.01 177.94 1yqr h VAL 123 N -0.58 1.26 -0.19 3.13 2.07 -0.98 -2.89 116.25 118.07 1yqr h VAL 123 Ca -0.05 -0.94 0.05 0.00 0.82 0.00 0.00 66.70 66.58 1yqr h VAL 123 Cb 0.44 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1yqr h VAL 123 CO 0.09 0.36 0.17 0.00 0.02 0.00 0.00 177.57 178.21 1yqr h ALA 124 N 1.07 1.91 -0.27 1.67 0.00 -0.46 -1.39 119.26 121.79 1yqr h ALA 124 Ca 0.21 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1yqr h ALA 124 Cb 0.36 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1yqr h ALA 124 CO 0.00 -0.27 0.06 -0.56 0.00 0.00 0.00 179.25 178.48 1yqr h GLN 125 N 0.00 0.39 -0.26 0.00 -0.00 -1.27 -2.96 115.11 111.01 1yqr h GLN 125 Ca 0.09 -0.05 0.00 0.00 -0.00 0.00 0.00 58.65 58.68 1yqr h GLN 125 Cb 0.43 -0.07 0.00 0.00 -0.00 0.00 0.00 27.48 27.84 1yqr h GLN 125 CO -0.00 0.37 0.00 1.63 -0.00 0.00 0.00 178.83 180.83 1yqr n LYS 126 N -4.38 2.01 -3.17 0.06 5.02 -0.55 -4.68 118.16 112.47 1yqr n LYS 126 Ca 0.01 -1.85 -0.19 0.00 -2.02 0.00 0.00 58.31 54.25 1yqr n LYS 126 Cb 0.17 -1.33 -0.03 0.00 -0.02 0.00 0.00 35.03 33.81 1yqr n LYS 126 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1yqr n PHE 127 N 0.87 0.49 -1.79 2.13 3.01 -1.03 -5.11 117.46 116.04 1yqr n PHE 127 Ca 0.13 -3.82 -0.31 0.00 1.01 0.00 0.00 57.45 54.45 1yqr n PHE 127 Cb 0.44 -0.42 0.02 0.00 -0.01 0.00 0.00 39.48 39.51 1yqr n PHE 127 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 1yqr s GLN 128 N -2.43 3.32 0.00 -1.08 -0.21 -1.24 -4.25 119.66 113.77 1yqr s GLN 128 Ca 0.40 0.88 0.00 0.00 0.02 0.00 0.00 55.36 56.67 1yqr s GLN 128 Cb 0.33 -2.04 0.00 0.00 1.00 0.00 0.00 33.01 32.30 1yqr s GLN 128 CO -0.09 -0.79 0.00 0.41 -2.12 0.00 0.00 175.29 172.70 1yqr n GLY 129 N -2.23 0.68 3.56 3.09 0.00 -1.21 -4.52 105.19 104.57 1yqr n GLY 129 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1yqr n GLY 129 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yqr s VAL 130 N -2.30 4.89 0.38 1.61 1.01 -1.26 -0.96 120.40 123.78 1yqr s VAL 130 Ca 0.00 0.51 0.04 0.00 0.00 0.00 0.00 61.98 62.54 1yqr s VAL 130 Cb 0.00 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 32.27 1yqr s VAL 130 CO 0.00 -0.34 0.16 0.00 0.00 0.00 0.00 175.10 174.93 1yqr s ARG 131 N 2.69 1.86 -0.16 2.72 1.70 -1.26 -4.74 118.95 121.76 1yqr s ARG 131 Ca 0.24 -2.12 -0.08 0.00 -0.47 0.00 0.00 55.73 53.30 1yqr s ARG 131 Cb -0.14 -0.36 -0.04 0.00 -0.57 0.00 0.00 34.95 33.83 1yqr s ARG 131 CO 0.15 -0.51 0.13 -0.51 -1.08 0.00 0.00 175.30 173.48 1yqr s LEU 132 N -3.53 4.26 0.44 -1.89 2.01 -1.26 -4.96 118.68 113.74 1yqr s LEU 132 Ca 0.28 0.34 -0.21 0.00 0.01 0.00 0.00 54.13 54.55 1yqr s LEU 132 Cb 0.03 -2.07 -0.10 0.00 0.01 0.00 0.00 46.19 44.06 1yqr s LEU 132 CO 0.18 0.30 0.97 -0.76 1.01 0.00 0.00 176.35 178.04 1yqr s LEU 133 N -0.35 3.95 -0.58 1.79 1.02 -1.26 -4.52 118.68 118.73 1yqr s LEU 133 Ca 0.11 1.76 -0.15 0.00 0.02 0.00 0.00 54.13 55.88 1yqr s LEU 133 Cb -0.12 -4.51 0.14 0.00 0.02 0.00 0.00 46.19 41.73 1yqr s LEU 133 CO 0.01 -0.44 0.52 -0.60 0.02 0.00 0.00 176.35 175.86 1yqr s ARG 134 N -3.11 3.02 0.41 1.70 3.52 0.74 -4.73 118.95 120.50 1yqr s ARG 134 Ca 0.62 -1.84 0.03 0.00 -0.13 0.00 0.00 55.73 54.41 1yqr s ARG 134 Cb -0.12 -4.27 -0.00 0.00 -1.56 0.00 0.00 34.95 29.00 1yqr s ARG 134 CO 0.16 -1.31 0.60 -0.65 -0.81 0.00 0.00 175.30 173.28 1yqr s GLN 135 N 1.33 3.05 0.17 5.12 -0.21 -0.31 -4.73 119.66 124.08 1yqr s GLN 135 Ca 0.06 -0.72 -0.30 0.00 0.02 0.00 0.00 55.36 54.41 1yqr s GLN 135 Cb -0.26 -2.66 -0.07 0.00 1.00 0.00 0.00 33.01 31.01 1yqr s GLN 135 CO 0.01 -0.17 1.10 0.34 -2.12 0.00 0.00 175.29 174.45 1yqr s ASP 136 N -4.22 7.26 0.20 5.90 2.15 -1.26 -4.44 116.67 122.26 1yqr s ASP 136 Ca 0.48 2.08 -0.10 0.00 0.43 0.00 0.00 52.55 55.43 1yqr s ASP 136 Cb -0.10 -2.60 0.26 0.00 -0.30 0.00 0.00 42.92 40.18 1yqr s ASP 136 CO 0.35 -0.23 1.76 -0.65 -0.17 0.00 0.00 175.17 176.22 1yqr h PRO 137 N 5.22 0.43 0.48 4.34 0.11 -1.96 -1.14 132.00 139.49 1yqr h PRO 137 Ca -0.44 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 1yqr h PRO 137 Cb 1.21 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1yqr h PRO 137 CO 0.73 0.29 -0.23 0.82 -0.21 0.00 0.00 178.00 179.39 1yqr h ILE 138 N 0.45 0.52 -0.72 4.15 1.08 -1.98 0.30 117.51 121.31 1yqr h ILE 138 Ca 0.30 -0.08 0.02 0.00 -0.39 0.00 0.00 64.86 64.71 1yqr h ILE 138 Cb 0.33 0.56 -0.04 0.00 -3.07 0.00 0.00 36.82 34.60 1yqr h ILE 138 CO -0.27 0.01 0.46 -0.08 -0.69 0.00 0.00 178.15 177.58 1yqr h GLU 139 N -0.69 0.89 -0.67 2.37 4.81 -1.88 -2.06 114.58 117.34 1yqr h GLU 139 Ca -0.07 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.04 1yqr h GLU 139 Cb 0.52 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 29.67 1yqr h GLU 139 CO 0.11 0.59 0.15 0.00 -0.73 0.00 0.00 179.01 179.13 1yqr h LEU 141 N 1.01 0.30 -0.14 0.00 5.85 -0.00 -2.34 115.31 119.99 1yqr h LEU 141 Ca 0.21 -0.15 -0.19 0.00 0.84 0.00 0.00 57.88 58.58 1yqr h LEU 141 Cb 0.38 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 1yqr h LEU 141 CO 0.00 0.37 -0.92 -0.26 -0.34 0.00 0.00 178.44 177.29 1yqr h PHE 142 N 0.21 0.00 -0.23 1.25 -1.00 -1.29 -2.24 116.94 113.64 1yqr h PHE 142 Ca 0.07 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.82 1yqr h PHE 142 Cb 0.16 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.71 1yqr h PHE 142 CO -0.01 0.92 0.02 0.77 -1.61 0.00 0.00 178.31 178.40 1yqr h SER 143 N 0.00 0.38 1.50 2.17 0.02 -0.76 -2.87 113.55 113.99 1yqr h SER 143 Ca -0.01 -0.28 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 1yqr h SER 143 Cb 1.64 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 64.08 1yqr h SER 143 CO 0.12 0.57 0.00 -0.26 -1.14 0.00 0.00 176.83 176.12 1yqr h PHE 144 N 0.18 0.00 -0.22 3.45 -1.00 -1.46 -1.79 116.94 116.09 1yqr h PHE 144 Ca 0.07 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.78 1yqr h PHE 144 Cb 0.36 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.90 1yqr h PHE 144 CO 0.03 0.00 -0.16 0.82 -1.61 0.00 0.00 178.31 177.39 1yqr h ILE 145 N 0.00 1.22 0.00 -0.55 2.04 -1.28 -0.85 117.51 118.09 1yqr h ILE 145 Ca 0.00 -0.99 0.00 0.00 1.00 0.00 0.00 64.86 64.87 1yqr h ILE 145 Cb 0.75 1.23 0.00 0.00 -0.74 0.00 0.00 36.82 38.06 1yqr h ILE 145 CO 0.00 0.32 0.00 0.00 0.00 0.00 0.00 178.15 178.47 1yqr n SER 147 N -2.14 0.52 -4.67 0.00 3.41 -0.32 -4.75 113.62 105.66 1yqr n SER 147 Ca 0.05 0.60 -0.53 0.00 -0.26 0.00 0.00 58.87 58.73 1yqr n SER 147 Cb 0.37 -0.72 -0.06 0.00 -0.26 0.00 0.00 64.21 63.54 1yqr n SER 147 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1yqr n SER 148 N -2.04 2.49 -4.09 4.04 2.88 -1.22 -2.05 113.62 113.62 1yqr n SER 148 Ca 0.04 1.07 -0.42 0.00 -1.33 0.00 0.00 58.87 58.22 1yqr n SER 148 Cb 0.27 -1.23 -0.00 0.00 -0.75 0.00 0.00 64.21 62.50 1yqr n SER 148 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1yqr s ASN 150 N -3.72 -0.03 0.06 0.00 3.84 -0.87 -5.13 114.94 109.09 1yqr s ASN 150 Ca 0.38 -0.17 -0.04 0.00 0.21 0.00 0.00 52.86 53.24 1yqr s ASN 150 Cb -0.20 0.25 -0.05 0.00 -0.55 0.00 0.00 41.25 40.70 1yqr s ASN 150 CO 0.97 -0.44 0.28 0.54 -2.79 0.00 0.00 177.10 175.66 1yqr s ASN 151 N -1.55 6.45 0.33 -4.21 2.20 -1.26 -4.93 114.94 111.97 1yqr s ASN 151 Ca -0.12 0.49 0.12 0.00 -0.94 0.00 0.00 52.86 52.40 1yqr s ASN 151 Cb -0.05 -2.05 1.04 0.00 -2.00 0.00 0.00 41.25 38.18 1yqr s ASN 151 CO 0.01 0.17 1.62 0.40 -2.94 0.00 0.00 177.10 176.36 1yqr h ILE 152 N 2.49 0.15 -0.12 0.54 2.04 -1.98 -0.09 117.51 120.55 1yqr h ILE 152 Ca -0.47 -0.05 -0.02 0.00 1.00 0.00 0.00 64.86 65.32 1yqr h ILE 152 Cb 1.18 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.26 1yqr h ILE 152 CO 0.71 0.03 0.01 0.00 0.00 0.00 0.00 178.15 178.90 1yqr h ALA 153 N 1.91 0.16 -0.75 1.87 0.00 -1.97 0.10 119.26 120.59 1yqr h ALA 153 Ca 0.71 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 55.40 1yqr h ALA 153 Cb 1.67 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.39 1yqr h ALA 153 CO -0.73 -0.17 0.24 -0.09 0.00 0.00 0.00 179.25 178.50 1yqr h ARG 154 N -0.03 1.16 -0.27 0.00 2.43 -1.67 -1.09 114.38 114.91 1yqr h ARG 154 Ca 0.04 -0.25 0.02 0.00 -0.81 0.00 0.00 59.98 58.98 1yqr h ARG 154 Cb 0.32 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.68 1yqr h ARG 154 CO 0.00 0.98 0.13 0.82 -1.51 0.00 0.00 179.97 180.40 1yqr h ILE 155 N 1.11 0.99 -0.78 1.20 2.04 -0.93 -0.92 117.51 120.22 1yqr h ILE 155 Ca 0.24 -0.10 0.09 0.00 1.00 0.00 0.00 64.86 66.10 1yqr h ILE 155 Cb 0.30 0.69 -0.07 0.00 -0.74 0.00 0.00 36.82 37.00 1yqr h ILE 155 CO -0.01 0.05 0.43 0.74 0.00 0.00 0.00 178.15 179.36 1yqr h THR 156 N 0.28 0.89 -0.01 -0.27 2.02 -0.26 -1.25 112.91 114.31 1yqr h THR 156 Ca 0.11 -0.25 -0.00 0.00 0.77 0.00 0.00 66.41 67.04 1yqr h THR 156 Cb 0.03 0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 66.55 1yqr h THR 156 CO -0.08 0.13 0.00 1.23 0.37 0.00 0.00 175.52 177.18 1yqr h GLY 157 N 0.72 0.01 0.81 2.16 0.00 -0.35 -1.99 103.07 104.43 1yqr h GLY 157 Ca 0.38 -0.01 0.03 0.00 0.00 0.00 0.00 47.33 47.73 1yqr h GLY 157 CO -0.25 0.01 0.25 -0.33 0.00 0.00 0.00 176.54 176.22 1yqr h MET 158 N -0.10 0.49 -0.55 4.80 2.86 -0.77 -2.01 114.93 119.65 1yqr h MET 158 Ca 0.00 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 1yqr h MET 158 Cb 0.11 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 1yqr h MET 158 CO -0.00 0.32 0.21 0.28 1.06 0.00 0.00 176.91 178.79 1yqr h VAL 159 N 0.50 1.20 -0.26 -2.22 2.07 -1.14 0.12 116.25 116.53 1yqr h VAL 159 Ca 0.20 -0.64 -0.08 0.00 0.82 0.00 0.00 66.70 66.99 1yqr h VAL 159 Cb 0.07 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1yqr h VAL 159 CO -0.12 0.25 -0.15 -0.33 0.02 0.00 0.00 177.57 177.24 1yqr h GLU 160 N 0.79 0.56 -0.59 1.57 5.08 -1.03 -1.31 114.58 119.65 1yqr h GLU 160 Ca 0.19 -0.26 -0.03 0.00 -1.00 0.00 0.00 59.36 58.26 1yqr h GLU 160 Cb 0.17 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.38 1yqr h GLU 160 CO -0.02 0.83 0.24 0.00 -1.00 0.00 0.00 179.01 179.06 1yqr h ARG 161 N 0.28 0.89 -0.78 2.33 3.08 -1.06 0.20 114.38 119.31 1yqr h ARG 161 Ca 0.05 -0.16 -0.02 0.00 0.07 0.00 0.00 59.98 59.92 1yqr h ARG 161 Cb 0.68 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.55 1yqr h ARG 161 CO 0.04 0.75 0.40 1.25 -1.07 0.00 0.00 179.97 181.35 1yqr h LEU 162 N 0.82 0.99 -0.25 3.04 6.46 -0.70 -1.10 115.31 124.58 1yqr h LEU 162 Ca 0.20 -0.11 -0.20 0.00 -0.12 0.00 0.00 57.88 57.64 1yqr h LEU 162 Cb 0.20 -0.25 0.00 0.00 -0.73 0.00 0.00 40.66 39.88 1yqr h LEU 162 CO -0.02 0.82 -0.68 0.00 -0.62 0.00 0.00 178.44 177.95 1yqr h GLN 164 N 0.57 0.97 0.00 0.00 4.15 -0.31 0.46 115.11 120.95 1yqr h GLN 164 Ca -0.02 -0.09 -0.14 0.00 0.77 0.00 0.00 58.65 59.16 1yqr h GLN 164 Cb 1.29 -0.20 -0.02 0.00 0.21 0.00 0.00 27.48 28.76 1yqr h GLN 164 CO 0.14 0.70 -0.68 0.00 -1.93 0.00 0.00 178.83 177.05 1yqr h ALA 165 N 1.22 0.56 0.00 3.38 0.00 -1.22 -3.39 119.26 119.81 1yqr h ALA 165 Ca 0.25 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1yqr h ALA 165 Cb -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1yqr h ALA 165 CO -0.05 0.85 0.00 1.19 0.00 0.00 0.00 179.25 181.25 1yqr n PHE 166 N -3.28 0.00 -3.59 0.00 3.01 -0.71 -5.08 117.46 107.81 1yqr n PHE 166 Ca 0.01 0.00 -0.26 0.00 1.01 0.00 0.00 57.45 58.21 1yqr n PHE 166 Cb 0.81 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 40.25 1yqr n PHE 166 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1yqr s GLY 167 N -0.11 1.65 0.34 1.37 0.00 0.16 -4.47 107.32 106.26 1yqr s GLY 167 Ca 0.00 -0.84 -0.29 0.00 0.00 0.00 0.00 44.72 43.60 1yqr s GLY 167 CO 0.00 -0.78 1.47 -4.14 0.00 0.00 0.00 173.10 169.65 1yqr s PRO 168 N -3.64 4.17 -0.02 2.90 0.02 -1.24 -4.62 135.00 132.59 1yqr s PRO 168 Ca 0.39 2.48 -0.30 0.00 0.02 0.00 0.00 61.00 63.59 1yqr s PRO 168 Cb -0.10 -3.01 -0.03 0.00 0.02 0.00 0.00 34.50 31.37 1yqr s PRO 168 CO 0.31 -0.48 1.05 0.50 -0.33 0.00 0.00 177.00 178.05 1yqr s ARG 169 N -1.51 4.48 0.00 5.54 3.52 -1.26 0.15 118.95 129.87 1yqr s ARG 169 Ca 0.55 1.51 0.00 0.00 -0.13 0.00 0.00 55.73 57.66 1yqr s ARG 169 Cb -0.45 -3.47 0.00 0.00 -1.56 0.00 0.00 34.95 29.47 1yqr s ARG 169 CO 0.56 -0.19 0.00 1.28 -0.81 0.00 0.00 175.30 176.14 1yqr n LEU 170 N 4.28 0.00 -5.00 -0.88 4.77 0.12 -4.91 117.00 115.38 1yqr n LEU 170 Ca 0.08 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.87 1yqr n LEU 170 Cb 0.49 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.61 1yqr n LEU 170 CO 0.53 0.00 0.27 0.27 -1.33 0.00 0.00 177.39 177.13 1yqr s ILE 171 N 4.08 2.75 -0.12 -0.08 -5.25 -1.26 -4.79 121.20 116.54 1yqr s ILE 171 Ca 0.00 -0.86 0.03 0.00 -0.99 0.00 0.00 60.65 58.84 1yqr s ILE 171 Cb 0.00 -2.90 0.00 0.00 2.95 0.00 0.00 42.46 42.52 1yqr s ILE 171 CO 0.00 0.00 -0.23 -1.58 -1.79 0.00 0.00 174.94 171.34 1yqr s GLN 172 N -4.57 3.05 -0.14 0.37 0.74 -1.26 -1.18 119.66 116.67 1yqr s GLN 172 Ca 0.57 -0.87 0.02 0.00 0.05 0.00 0.00 55.36 55.14 1yqr s GLN 172 Cb -0.09 -2.36 0.01 0.00 1.10 0.00 0.00 33.01 31.67 1yqr s GLN 172 CO 0.36 0.11 -0.20 -0.51 -0.55 0.00 0.00 175.29 174.50 1yqr s LEU 173 N 0.52 2.01 0.00 3.68 1.43 -0.10 -4.89 118.68 121.33 1yqr s LEU 173 Ca -0.14 -0.57 0.00 0.00 -1.03 0.00 0.00 54.13 52.39 1yqr s LEU 173 Cb -0.17 -1.37 0.00 0.00 0.03 0.00 0.00 46.19 44.68 1yqr s LEU 173 CO 0.05 0.05 0.00 0.47 0.23 0.00 0.00 176.35 177.15 1yqr n ASP 174 N 4.21 0.00 -1.50 2.29 8.00 -1.26 -0.47 116.55 127.81 1yqr n ASP 174 Ca -0.20 0.00 0.08 0.00 0.71 0.00 0.00 54.79 55.38 1yqr n ASP 174 Cb 0.51 0.00 0.35 0.00 -0.02 0.00 0.00 41.12 41.96 1yqr n ASP 174 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1yqr n ASP 175 N 6.07 5.01 -4.46 -2.24 5.68 -1.26 -4.92 116.55 120.42 1yqr n ASP 175 Ca 0.00 -2.94 -0.36 0.00 -0.50 0.00 0.00 54.79 50.99 1yqr n ASP 175 Cb 0.00 -0.63 -0.12 0.00 -1.14 0.00 0.00 41.12 39.23 1yqr n ASP 175 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1yqr s VAL 176 N -2.75 4.18 -0.27 2.12 1.01 0.38 -5.07 120.40 120.00 1yqr s VAL 176 Ca 0.50 -0.23 -0.09 0.00 0.00 0.00 0.00 61.98 62.16 1yqr s VAL 176 Cb 0.38 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.81 1yqr s VAL 176 CO 0.14 0.39 0.12 -0.89 0.00 0.00 0.00 175.10 174.86 1yqr s THR 177 N 1.23 4.64 0.21 3.92 2.01 -1.26 -0.93 115.64 125.46 1yqr s THR 177 Ca 0.04 -0.13 -0.27 0.00 0.31 0.00 0.00 61.69 61.64 1yqr s THR 177 Cb -0.15 -3.22 -0.09 0.00 0.01 0.00 0.00 72.50 69.06 1yqr s THR 177 CO 0.02 0.26 0.85 -0.31 -0.69 0.00 0.00 174.62 174.76 1yqr s TYR 178 N 1.65 3.91 0.00 4.92 1.51 -0.32 -4.96 117.35 124.06 1yqr s TYR 178 Ca 0.06 1.75 0.06 0.00 -1.01 0.00 0.00 57.07 57.93 1yqr s TYR 178 Cb -0.16 -2.86 -0.02 0.00 -0.11 0.00 0.00 41.96 38.82 1yqr s TYR 178 CO 0.06 0.46 -0.19 -1.01 -1.11 0.00 0.00 175.55 173.76 1yqr s HIS 179 N -1.22 1.71 0.80 2.71 3.76 -1.26 0.15 115.29 121.93 1yqr s HIS 179 Ca 0.39 -0.34 -0.12 0.00 -0.15 0.00 0.00 55.06 54.85 1yqr s HIS 179 Cb -0.24 -1.08 0.07 0.00 1.11 0.00 0.00 32.58 32.45 1yqr s HIS 179 CO 0.28 0.00 1.12 0.20 -0.85 0.00 0.00 174.74 175.50 1yqr s GLY 180 N -0.65 1.61 0.34 -2.22 0.00 0.12 -4.89 107.32 101.63 1yqr s GLY 180 Ca 0.07 -0.40 -0.28 0.00 0.00 0.00 0.00 44.72 44.11 1yqr s GLY 180 CO -0.00 0.06 1.22 -0.12 0.00 0.00 0.00 173.10 174.25 1yqr s PHE 181 N -3.32 3.19 0.67 1.90 5.36 -1.26 -3.60 117.98 120.91 1yqr s PHE 181 Ca 0.61 1.53 -0.17 0.00 -0.96 0.00 0.00 56.93 57.93 1yqr s PHE 181 Cb -0.13 -3.51 -0.00 0.00 -0.34 0.00 0.00 43.02 39.04 1yqr s PHE 181 CO 0.52 -1.39 1.29 -2.14 -1.46 0.00 0.00 175.22 172.04 1yqr s PRO 182 N -1.84 2.44 0.76 10.12 0.02 -1.26 -4.59 135.00 140.66 1yqr s PRO 182 Ca 0.50 2.04 -0.07 0.00 0.02 0.00 0.00 61.00 63.48 1yqr s PRO 182 Cb -0.35 -1.84 0.11 0.00 0.02 0.00 0.00 34.50 32.44 1yqr s PRO 182 CO 0.46 -1.67 1.08 -1.54 -0.33 0.00 0.00 177.00 174.99 1yqr s SER 183 N -1.47 4.34 0.12 2.53 1.04 -1.26 -4.89 113.70 114.10 1yqr s SER 183 Ca 0.82 0.23 -0.17 0.00 0.48 0.00 0.00 55.95 57.31 1yqr s SER 183 Cb -0.37 -0.69 -0.03 0.00 0.10 0.00 0.00 66.02 65.03 1yqr s SER 183 CO 0.41 -1.90 1.64 -0.07 0.98 0.00 0.00 173.24 174.30 1yqr h LEU 184 N -0.81 0.48 -0.44 2.42 4.07 -1.96 -2.14 115.31 116.93 1yqr h LEU 184 Ca -0.43 -0.19 0.04 0.00 0.08 0.00 0.00 57.88 57.38 1yqr h LEU 184 Cb 1.29 -0.13 -0.04 0.00 1.08 0.00 0.00 40.66 42.86 1yqr h LEU 184 CO 0.51 0.54 0.20 1.56 -1.08 0.00 0.00 178.44 180.18 1yqr h GLN 185 N 0.39 0.40 -0.48 1.13 7.50 -1.94 0.16 115.11 122.27 1yqr h GLN 185 Ca 0.11 -0.02 -0.04 0.00 0.50 0.00 0.00 58.65 59.20 1yqr h GLN 185 Cb 0.23 -0.09 -0.02 0.00 0.05 0.00 0.00 27.48 27.65 1yqr h GLN 185 CO -0.01 0.26 0.14 0.00 -1.50 0.00 0.00 178.83 177.73 1yqr h ALA 186 N 1.25 0.63 0.00 3.87 0.00 -1.90 -1.28 119.26 121.83 1yqr h ALA 186 Ca 0.19 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1yqr h ALA 186 Cb 0.12 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1yqr h ALA 186 CO -0.15 0.29 -0.18 -0.07 0.00 0.00 0.00 179.25 179.14 1yqr h LEU 187 N 0.64 0.00 0.00 0.00 3.38 -0.89 -2.39 115.31 116.05 1yqr h LEU 187 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1yqr h LEU 187 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1yqr h LEU 187 CO -0.00 0.18 -0.42 0.00 0.09 0.00 0.00 178.44 178.29 1yqr n ALA 188 N -2.26 2.77 -0.76 1.53 0.00 0.53 -4.45 120.51 117.87 1yqr n ALA 188 Ca -0.01 -0.19 -0.33 0.00 0.00 0.00 0.00 53.44 52.91 1yqr n ALA 188 Cb 0.33 -1.26 0.14 0.00 0.00 0.00 0.00 19.45 18.66 1yqr n ALA 188 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yqr n GLY 189 N 1.35 -2.53 3.77 0.00 0.00 -0.53 -4.86 105.19 102.39 1yqr n GLY 189 Ca 0.04 -0.72 -0.37 0.00 0.00 0.00 0.00 46.02 44.98 1yqr n GLY 189 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1yqr s PRO 190 N -3.28 3.90 -0.43 1.61 0.04 -1.26 -3.35 135.00 132.23 1yqr s PRO 190 Ca 0.53 1.69 0.00 0.00 0.04 0.00 0.00 61.00 63.26 1yqr s PRO 190 Cb -0.13 -2.45 0.00 0.00 0.04 0.00 0.00 34.50 31.96 1yqr s PRO 190 CO 0.68 -0.41 0.00 0.39 0.04 0.00 0.00 177.00 177.69 1yqr n GLU 191 N -0.35 -1.70 0.00 4.56 1.02 -1.26 -4.87 120.64 118.04 1yqr n GLU 191 Ca 0.06 0.60 -0.11 0.00 -0.02 0.00 0.00 57.16 57.70 1yqr n GLU 191 Cb 0.49 -4.94 -0.05 0.00 -0.02 0.00 0.00 31.44 26.91 1yqr n GLU 191 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1yqr h VAL 192 N 0.00 0.98 -0.14 2.62 2.07 -1.89 -1.81 116.25 118.08 1yqr h VAL 192 Ca -0.08 -0.03 0.05 0.00 0.82 0.00 0.00 66.70 67.46 1yqr h VAL 192 Cb 0.97 0.89 -0.06 0.00 -1.52 0.00 0.00 31.29 31.57 1yqr h VAL 192 CO 0.12 0.01 -0.31 -0.08 0.02 0.00 0.00 177.57 177.34 1yqr h GLU 193 N 0.08 -0.36 -0.87 1.57 4.81 -1.86 0.20 114.58 118.15 1yqr h GLU 193 Ca 0.04 0.02 0.11 0.00 -0.13 0.00 0.00 59.36 59.41 1yqr h GLU 193 Cb 0.02 0.08 -0.06 0.00 0.63 0.00 0.00 28.75 29.42 1yqr h GLU 193 CO -0.04 -0.24 0.56 0.00 -0.73 0.00 0.00 179.01 178.56 1yqr h ALA 194 N 0.47 1.73 -0.38 2.92 0.00 -1.89 0.16 119.26 122.27 1yqr h ALA 194 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.89 1yqr h ALA 194 Cb 0.53 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1yqr h ALA 194 CO -0.35 0.07 -0.26 1.25 0.00 0.00 0.00 179.25 179.96 1yqr h HIS 195 N 0.78 0.99 -0.45 0.00 -0.00 -0.28 -2.16 115.15 114.04 1yqr h HIS 195 Ca 0.42 -0.27 -0.08 0.00 -0.00 0.00 0.00 60.37 60.44 1yqr h HIS 195 Cb 0.53 -0.22 -0.02 0.00 -0.00 0.00 0.00 27.41 27.70 1yqr h HIS 195 CO -0.00 1.05 -0.05 -0.07 -0.00 0.00 0.00 177.93 178.85 1yqr h LEU 196 N 0.64 0.74 -0.85 0.26 3.38 0.64 -1.69 115.31 118.44 1yqr h LEU 196 Ca 0.07 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 1yqr h LEU 196 Cb 0.83 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.34 1yqr h LEU 196 CO 0.07 0.84 0.40 0.03 0.09 0.00 0.00 178.44 179.88 1yqr h ARG 197 N 0.70 1.22 0.00 1.13 3.08 -0.57 0.11 114.38 120.05 1yqr h ARG 197 Ca 0.13 -0.18 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 1yqr h ARG 197 Cb 0.51 -0.22 -0.00 0.00 0.08 0.00 0.00 29.97 30.34 1yqr h ARG 197 CO 0.03 0.94 -0.02 0.87 -1.07 0.00 0.00 179.97 180.72 1yqr h LYS 198 N 1.21 0.00 -0.17 0.04 1.57 -0.87 -0.48 116.57 117.86 1yqr h LYS 198 Ca 0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 1yqr h LYS 198 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1yqr h LYS 198 CO -0.04 0.02 0.00 1.28 -0.57 0.00 0.00 179.45 180.14 1yqr n LEU 199 N -3.13 1.69 0.00 2.94 4.77 0.30 -4.94 117.00 118.63 1yqr n LEU 199 Ca -0.00 -0.71 0.00 0.00 -0.03 0.00 0.00 56.01 55.27 1yqr n LEU 199 Cb 0.26 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1yqr n LEU 199 CO 0.26 0.36 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 1yqr n GLY 200 N 1.13 0.43 0.00 -0.72 0.00 -0.19 -4.85 105.19 100.99 1yqr n GLY 200 Ca 0.16 -1.00 0.14 0.00 0.00 0.00 0.00 46.02 45.32 1yqr n GLY 200 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yqr n LEU 201 N 0.00 0.00 0.00 0.99 4.32 -0.94 -4.99 117.00 116.38 1yqr n LEU 201 Ca 0.00 0.47 0.00 0.00 -0.02 0.00 0.00 56.01 56.46 1yqr n LEU 201 Cb 0.05 -0.47 0.00 0.00 -1.62 0.00 0.00 43.42 41.38 1yqr n LEU 201 CO 0.00 -0.01 0.00 0.61 -1.22 0.00 0.00 177.39 176.77 1yqr n GLY 202 N 1.40 1.25 0.31 -0.72 0.00 -1.26 -2.29 105.19 103.88 1yqr n GLY 202 Ca 0.08 -0.63 0.17 0.00 0.00 0.00 0.00 46.02 45.63 1yqr n GLY 202 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1yqr h TYR 203 N 0.00 0.00 -0.23 1.61 -0.00 -2.00 -1.20 116.97 115.15 1yqr h TYR 203 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 58.73 58.80 1yqr h TYR 203 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.72 1yqr h TYR 203 CO 0.00 0.00 0.19 0.00 -0.00 0.00 0.00 178.16 178.35 1yqr h ARG 204 N 0.00 0.00 -0.86 0.10 3.08 -1.82 -1.18 114.38 113.70 1yqr h ARG 204 Ca 0.01 0.00 0.08 0.00 0.07 0.00 0.00 59.98 60.14 1yqr h ARG 204 Cb 0.05 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.04 1yqr h ARG 204 CO -0.00 0.00 0.52 0.00 -1.07 0.00 0.00 179.97 179.42 1yqr h ALA 205 N 1.84 1.20 -0.33 0.04 0.00 -1.31 -1.64 119.26 119.07 1yqr h ALA 205 Ca 0.11 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1yqr h ALA 205 Cb 0.49 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1yqr h ALA 205 CO -0.00 0.21 0.19 -0.09 0.00 0.00 0.00 179.25 179.56 1yqr h ARG 206 N 0.91 0.38 -0.30 0.00 9.65 -1.40 -2.68 114.38 120.94 1yqr h ARG 206 Ca 0.39 -0.02 -0.09 0.00 -1.10 0.00 0.00 59.98 59.16 1yqr h ARG 206 Cb 0.26 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 28.74 1yqr h ARG 206 CO -0.21 0.25 -0.19 1.88 2.80 0.00 0.00 179.97 184.51 1yqr h TYR 207 N 0.39 0.60 0.44 2.20 0.05 -1.42 -0.27 116.97 118.97 1yqr h TYR 207 Ca 0.13 -0.11 -0.02 0.00 0.05 0.00 0.00 58.73 58.77 1yqr h TYR 207 Cb -0.00 -0.15 0.00 0.00 1.01 0.00 0.00 36.73 37.59 1yqr h TYR 207 CO -0.07 0.70 -0.21 0.28 -1.05 0.00 0.00 178.16 177.80 1yqr h VAL 208 N 0.49 0.56 0.12 -2.88 2.07 -1.10 0.83 116.25 116.35 1yqr h VAL 208 Ca 0.08 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.60 1yqr h VAL 208 Cb 0.61 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 1yqr h VAL 208 CO 0.04 0.00 -0.10 -1.28 0.02 0.00 0.00 177.57 176.25 1yqr h SER 209 N -0.60 -0.26 -0.51 0.57 0.87 -1.35 -1.95 113.55 110.31 1yqr h SER 209 Ca -0.06 0.02 0.06 0.00 -1.23 0.00 0.00 61.79 60.58 1yqr h SER 209 Cb 0.46 0.09 -0.05 0.00 -0.44 0.00 0.00 62.40 62.46 1yqr h SER 209 CO 0.10 -0.16 0.22 0.00 -0.53 0.00 0.00 176.83 176.45 1yqr h ALA 210 N 0.63 0.64 0.00 6.23 0.00 -0.94 -1.34 119.26 124.48 1yqr h ALA 210 Ca -0.00 0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1yqr h ALA 210 Cb 0.22 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1yqr h ALA 210 CO -0.02 -0.16 -0.42 0.77 0.00 0.00 0.00 179.25 179.43 1yqr h SER 211 N 0.42 0.00 -0.19 0.00 0.02 -0.74 0.11 113.55 113.17 1yqr h SER 211 Ca 0.24 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.12 1yqr h SER 211 Cb 0.21 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.75 1yqr h SER 211 CO -0.21 0.42 -0.14 0.00 -1.14 0.00 0.00 176.83 175.76 1yqr h ALA 212 N 1.58 0.27 -0.37 3.77 0.00 -0.62 -2.05 119.26 121.84 1yqr h ALA 212 Ca -0.00 -0.32 -0.08 0.00 0.00 0.00 0.00 54.91 54.50 1yqr h ALA 212 Cb 0.80 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1yqr h ALA 212 CO 0.05 0.15 -0.09 0.00 0.00 0.00 0.00 179.25 179.37 1yqr h ARG 213 N 0.10 0.72 -0.54 0.00 3.08 -1.09 -2.44 114.38 114.21 1yqr h ARG 213 Ca 0.04 -0.27 0.07 0.00 0.07 0.00 0.00 59.98 59.88 1yqr h ARG 213 Cb 0.66 -0.04 -0.06 0.00 0.08 0.00 0.00 29.97 30.61 1yqr h ARG 213 CO 0.04 0.87 0.23 0.00 -1.07 0.00 0.00 179.97 180.04 1yqr h ALA 214 N 0.83 0.69 -0.29 0.04 0.00 -0.78 0.64 119.26 120.40 1yqr h ALA 214 Ca 0.09 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1yqr h ALA 214 Cb 0.60 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1yqr h ALA 214 CO 0.04 -0.15 0.05 0.82 0.00 0.00 0.00 179.25 180.01 1yqr h ILE 215 N 0.44 1.23 0.01 0.00 2.04 -1.30 0.11 117.51 120.04 1yqr h ILE 215 Ca 0.26 -0.77 -0.22 0.00 1.00 0.00 0.00 64.86 65.13 1yqr h ILE 215 Cb 0.24 1.18 -0.00 0.00 -0.74 0.00 0.00 36.82 37.50 1yqr h ILE 215 CO -0.23 0.25 -0.94 -0.07 0.00 0.00 0.00 178.15 177.17 1yqr h LEU 216 N 0.29 0.44 0.00 1.44 3.38 -1.06 0.79 115.31 120.60 1yqr h LEU 216 Ca 0.09 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1yqr h LEU 216 Cb 0.32 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1yqr h LEU 216 CO 0.00 1.17 -0.94 -0.62 0.09 0.00 0.00 178.44 178.14 1yqr n GLU 217 N -3.71 0.90 0.00 1.13 1.02 0.22 -4.16 120.64 116.04 1yqr n GLU 217 Ca -0.06 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 1yqr n GLU 217 Cb 0.84 -1.37 0.00 0.00 -0.02 0.00 0.00 31.44 30.88 1yqr n GLU 217 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1yqr n GLU 218 N -1.49 0.00 0.00 3.49 1.02 0.24 -4.88 120.64 119.02 1yqr n GLU 218 Ca 0.03 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.30 1yqr n GLU 218 Cb 0.30 -0.72 0.41 0.00 -0.02 0.00 0.00 31.44 31.42 1yqr n GLU 218 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1yqr n GLN 219 N -2.12 0.20 0.00 3.49 1.13 -0.31 -4.94 117.38 114.83 1yqr n GLN 219 Ca 0.00 -0.09 0.00 0.00 -1.94 0.00 0.00 57.00 54.97 1yqr n GLN 219 Cb 0.27 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.12 1yqr n GLN 219 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1yqr n GLY 220 N 1.45 1.47 7.00 1.08 0.00 -1.08 -4.73 105.19 110.38 1yqr n GLY 220 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1yqr n GLY 220 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yqr n GLY 221 N -1.40 -0.75 0.29 -0.02 0.00 0.27 -3.84 105.19 99.73 1yqr n GLY 221 Ca 0.00 -1.07 0.07 0.00 0.00 0.00 0.00 46.02 45.02 1yqr n GLY 221 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1yqr h LEU 222 N 0.00 0.28 -1.55 0.99 5.85 -1.95 -1.25 115.31 117.68 1yqr h LEU 222 Ca 0.00 0.12 0.17 0.00 0.84 0.00 0.00 57.88 59.01 1yqr h LEU 222 Cb 0.00 0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.07 1yqr h LEU 222 CO 0.00 0.08 0.54 0.00 -0.34 0.00 0.00 178.44 178.73 1yqr h ALA 223 N 1.58 2.14 -0.27 1.25 0.00 -1.98 -1.01 119.26 120.98 1yqr h ALA 223 Ca 0.44 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.35 1yqr h ALA 223 Cb 0.71 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1yqr h ALA 223 CO -0.43 -0.38 0.14 2.35 0.00 0.00 0.00 179.25 180.93 1yqr h TRP 224 N 0.42 0.37 -0.20 0.00 7.01 -1.33 -0.77 115.95 121.45 1yqr h TRP 224 Ca 0.41 -0.01 -0.04 0.00 2.11 0.00 0.00 58.89 61.36 1yqr h TRP 224 Cb 0.97 -0.12 -0.01 0.00 -2.10 0.00 0.00 29.16 27.90 1yqr h TRP 224 CO -0.00 0.33 -0.04 1.25 -2.79 0.00 0.00 178.44 177.19 1yqr h LEU 225 N 0.31 0.39 -0.74 0.65 6.46 -1.28 -3.28 115.31 117.82 1yqr h LEU 225 Ca 0.09 -0.36 -0.06 0.00 -0.12 0.00 0.00 57.88 57.44 1yqr h LEU 225 Cb 0.08 -0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 39.88 1yqr h LEU 225 CO -0.01 0.65 0.25 1.56 -0.62 0.00 0.00 178.44 180.27 1yqr h GLN 226 N 0.11 1.14 0.00 1.25 4.20 -1.18 -2.56 115.11 118.08 1yqr h GLN 226 Ca 0.05 -0.24 0.00 0.00 0.06 0.00 0.00 58.65 58.52 1yqr h GLN 226 Cb 0.48 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.09 1yqr h GLN 226 CO 0.02 0.96 0.00 0.00 -0.67 0.00 0.00 178.83 179.14 1yqr n GLN 227 N -4.28 0.15 0.22 1.46 -0.00 -0.30 -2.29 117.38 112.35 1yqr n GLN 227 Ca 0.06 0.18 0.15 0.00 -0.00 0.00 0.00 57.00 57.40 1yqr n GLN 227 Cb 0.22 -1.50 0.61 0.00 -0.00 0.00 0.00 30.24 29.56 1yqr n GLN 227 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 1yqr h LEU 228 N 0.00 0.00 -1.23 2.61 4.07 -1.52 -2.72 115.31 116.52 1yqr h LEU 228 Ca 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.95 1yqr h LEU 228 Cb 0.14 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.85 1yqr h LEU 228 CO 0.00 0.00 0.35 0.03 -1.08 0.00 0.00 178.44 177.74 1yqr h ARG 229 N 0.00 0.88 0.00 1.13 3.08 -1.65 -2.17 114.38 115.65 1yqr h ARG 229 Ca 0.00 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1yqr h ARG 229 Cb 0.48 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1yqr h ARG 229 CO 0.00 0.64 -0.11 0.93 -1.07 0.00 0.00 179.97 180.36 1yqr h GLU 230 N 0.89 0.00 -7.41 0.04 3.07 -1.72 -3.46 114.58 105.98 1yqr h GLU 230 Ca 0.23 0.00 -0.49 0.00 -0.50 0.00 0.00 59.36 58.60 1yqr h GLU 230 Cb 0.02 0.00 0.11 0.00 -0.84 0.00 0.00 28.75 28.03 1yqr h GLU 230 CO -0.04 0.00 0.35 -1.12 -1.40 0.00 0.00 179.01 176.80 1yqr s SER 231 N -5.34 4.72 0.55 1.42 0.01 -0.82 -5.04 113.70 109.22 1yqr s SER 231 Ca 0.08 1.32 -0.16 0.00 1.31 0.00 0.00 55.95 58.50 1yqr s SER 231 Cb 0.09 -2.08 -0.06 0.00 0.21 0.00 0.00 66.02 64.18 1yqr s SER 231 CO 0.65 -1.83 1.02 -0.94 0.41 0.00 0.00 173.24 172.55 1yqr s SER 232 N -3.95 6.24 0.25 2.44 1.04 -1.26 -4.78 113.70 113.67 1yqr s SER 232 Ca 0.60 1.67 -0.04 0.00 0.48 0.00 0.00 55.95 58.66 1yqr s SER 232 Cb -0.14 -2.52 0.49 0.00 0.10 0.00 0.00 66.02 63.95 1yqr s SER 232 CO 0.54 -0.85 1.69 0.22 0.98 0.00 0.00 173.24 175.82 1yqr h TYR 233 N 0.64 0.34 -0.27 5.02 3.20 -1.96 0.21 116.97 124.16 1yqr h TYR 233 Ca -0.47 0.04 0.03 0.00 3.14 0.00 0.00 58.73 61.48 1yqr h TYR 233 Cb 1.20 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 39.41 1yqr h TYR 233 CO 0.62 -0.06 0.08 0.93 -1.64 0.00 0.00 178.16 178.09 1yqr h GLU 234 N 0.30 0.19 0.57 1.82 3.07 -1.99 0.11 114.58 118.66 1yqr h GLU 234 Ca 0.43 -0.01 -0.03 0.00 -0.50 0.00 0.00 59.36 59.25 1yqr h GLU 234 Cb 0.73 -0.04 0.01 0.00 -0.84 0.00 0.00 28.75 28.61 1yqr h GLU 234 CO -0.50 0.13 -0.28 0.93 -1.40 0.00 0.00 179.01 177.89 1yqr h GLU 235 N 0.20 -0.74 -0.50 2.33 4.39 -1.57 -2.30 114.58 116.40 1yqr h GLU 235 Ca 0.12 0.05 0.09 0.00 0.34 0.00 0.00 59.36 59.96 1yqr h GLU 235 Cb 0.09 0.17 -0.10 0.00 -0.10 0.00 0.00 28.75 28.81 1yqr h GLU 235 CO -0.13 -0.44 -0.36 0.00 -1.16 0.00 0.00 179.01 176.92 1yqr h ALA 236 N -0.66 -0.19 -0.91 3.43 0.00 -0.47 0.02 119.26 120.49 1yqr h ALA 236 Ca -0.08 0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.01 1yqr h ALA 236 Cb 0.65 0.80 -0.06 0.00 0.00 0.00 0.00 17.79 19.18 1yqr h ALA 236 CO 0.13 -0.74 0.59 1.25 0.00 0.00 0.00 179.25 180.48 1yqr h HIS 237 N -0.23 1.07 -0.12 0.00 -0.00 -0.80 -1.45 115.15 113.63 1yqr h HIS 237 Ca 0.19 0.03 -0.03 0.00 -0.00 0.00 0.00 60.37 60.56 1yqr h HIS 237 Cb 0.55 -0.35 -0.00 0.00 -0.00 0.00 0.00 27.41 27.61 1yqr h HIS 237 CO -0.61 0.58 -0.03 -0.22 -0.00 0.00 0.00 177.93 177.64 1yqr h LYS 238 N 1.07 0.23 -0.12 5.26 1.63 -0.53 -2.70 116.57 121.41 1yqr h LYS 238 Ca 0.38 -0.09 0.04 0.00 -0.85 0.00 0.00 60.65 60.13 1yqr h LYS 238 Cb 0.15 -0.01 -0.05 0.00 -0.60 0.00 0.00 32.23 31.72 1yqr h LYS 238 CO -0.14 0.53 -0.16 0.00 -3.45 0.00 0.00 179.45 176.23 1yqr h ALA 239 N 0.69 -0.10 -0.90 5.00 0.00 -0.69 -2.68 119.26 120.59 1yqr h ALA 239 Ca 0.03 0.04 0.09 0.00 0.00 0.00 0.00 54.91 55.08 1yqr h ALA 239 Cb 0.45 0.33 -0.06 0.00 0.00 0.00 0.00 17.79 18.50 1yqr h ALA 239 CO 0.01 -0.62 0.58 -0.07 0.00 0.00 0.00 179.25 179.15 1yqr h LEU 240 N -0.21 0.83 -0.05 0.00 3.38 -1.29 -1.68 115.31 116.30 1yqr h LEU 240 Ca 0.09 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1yqr h LEU 240 Cb 0.34 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1yqr h LEU 240 CO -0.24 0.49 0.00 0.00 0.09 0.00 0.00 178.44 178.78 1yqr h ILE 242 N 0.00 1.39 -3.02 0.00 2.04 -1.35 -3.45 117.51 113.11 1yqr h ILE 242 Ca 0.00 -1.48 -0.58 0.00 1.00 0.00 0.00 64.86 63.80 1yqr h ILE 242 Cb 0.09 2.11 0.12 0.00 -0.74 0.00 0.00 36.82 38.41 1yqr h ILE 242 CO 0.00 0.43 0.22 0.18 0.00 0.00 0.00 178.15 178.98 1yqr n LEU 243 N -4.53 2.69 -4.74 1.44 4.77 -1.01 -4.90 117.00 110.71 1yqr n LEU 243 Ca -0.07 1.09 -0.42 0.00 -0.03 0.00 0.00 56.01 56.58 1yqr n LEU 243 Cb 0.41 -1.37 -0.02 0.00 -2.33 0.00 0.00 43.42 40.11 1yqr n LEU 243 CO 0.40 -1.29 1.17 -2.84 -1.33 0.00 0.00 177.39 173.50 1yqr s PRO 244 N -1.93 4.22 0.00 3.23 0.02 -1.26 -2.25 135.00 137.03 1yqr s PRO 244 Ca 0.61 2.37 0.00 0.00 0.02 0.00 0.00 61.00 64.00 1yqr s PRO 244 Cb -0.58 -3.11 0.00 0.00 0.02 0.00 0.00 34.50 30.83 1yqr s PRO 244 CO 0.58 -0.52 0.00 0.41 -0.33 0.00 0.00 177.00 177.14 1yqr n GLY 245 N 2.74 1.60 3.34 0.52 0.00 -1.26 -4.49 105.19 107.65 1yqr n GLY 245 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1yqr n GLY 245 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yqr s VAL 246 N -2.89 4.80 0.00 1.61 1.01 -0.95 -4.83 120.40 119.14 1yqr s VAL 246 Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 61.98 60.81 1yqr s VAL 246 Cb 0.00 -3.87 0.00 0.00 0.00 0.00 0.00 36.38 32.51 1yqr s VAL 246 CO 0.00 -0.52 0.00 0.61 0.00 0.00 0.00 175.10 175.19 1yqr n GLY 247 N 5.08 2.08 0.14 4.51 0.00 -1.26 -4.39 105.19 111.34 1yqr n GLY 247 Ca -0.11 -2.07 -0.09 0.00 0.00 0.00 0.00 46.02 43.74 1yqr n GLY 247 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1yqr h THR 248 N 0.01 1.08 0.03 2.61 2.02 -1.96 -1.24 112.91 115.46 1yqr h THR 248 Ca 0.00 -0.14 -0.00 0.00 0.77 0.00 0.00 66.41 67.04 1yqr h THR 248 Cb 0.00 0.65 0.00 0.00 -1.74 0.00 0.00 68.15 67.06 1yqr h THR 248 CO 0.00 0.07 -0.01 -0.61 0.37 0.00 0.00 175.52 175.34 1yqr h GLN 249 N 0.39 -0.04 -1.00 6.66 4.15 -1.96 -1.29 115.11 122.02 1yqr h GLN 249 Ca 0.11 0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.55 1yqr h GLN 249 Cb -0.04 0.01 -0.05 0.00 0.21 0.00 0.00 27.48 27.60 1yqr h GLN 249 CO -0.02 0.24 0.66 0.28 -1.93 0.00 0.00 178.83 178.06 1yqr h VAL 250 N -0.31 1.23 -0.69 2.39 2.07 -1.90 -0.71 116.25 118.33 1yqr h VAL 250 Ca -0.00 -0.46 -0.07 0.00 0.82 0.00 0.00 66.70 66.99 1yqr h VAL 250 Cb 0.29 -0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 29.82 1yqr h VAL 250 CO 0.01 0.24 0.14 0.00 0.02 0.00 0.00 177.57 177.98 1yqr h ALA 251 N 1.38 0.94 -0.34 1.67 0.00 -1.14 -2.19 119.26 119.59 1yqr h ALA 251 Ca 0.38 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 1yqr h ALA 251 Cb -0.10 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 1yqr h ALA 251 CO -0.10 0.67 -0.10 -0.44 0.00 0.00 0.00 179.25 179.28 1yqr h ASP 252 N 1.05 0.68 -0.68 0.00 3.32 -0.57 -0.50 116.42 119.72 1yqr h ASP 252 Ca 0.21 -0.37 0.11 0.00 0.02 0.00 0.00 57.03 57.00 1yqr h ASP 252 Cb 0.41 -0.18 -0.08 0.00 0.22 0.00 0.00 39.33 39.69 1yqr h ASP 252 CO 0.01 0.90 0.28 0.00 -1.72 0.00 0.00 179.24 178.71 1yqr h ILE 254 N 0.47 1.28 -0.75 0.00 2.04 -1.18 0.33 117.51 119.69 1yqr h ILE 254 Ca 0.35 -1.11 -0.02 0.00 1.00 0.00 0.00 64.86 65.08 1yqr h ILE 254 Cb 0.45 1.33 -0.03 0.00 -0.74 0.00 0.00 36.82 37.82 1yqr h ILE 254 CO -0.32 0.36 0.38 0.00 0.00 0.00 0.00 178.15 178.56 1yqr h LEU 256 N 1.05 0.23 0.00 0.00 5.85 -0.76 -0.55 115.31 121.12 1yqr h LEU 256 Ca 0.26 -0.65 0.00 0.00 0.84 0.00 0.00 57.88 58.33 1yqr h LEU 256 Cb 0.09 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.06 1yqr h LEU 256 CO -0.04 0.84 -0.74 0.24 -0.34 0.00 0.00 178.44 178.40 1yqr h MET 257 N -0.37 0.00 0.00 1.25 2.86 -0.94 -3.39 114.93 114.33 1yqr h MET 257 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1yqr h MET 257 Cb 0.83 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.49 1yqr h MET 257 CO 0.04 0.00 -0.32 0.00 1.06 0.00 0.00 176.91 177.68 1yqr n ALA 258 N -2.11 1.02 -1.02 6.32 0.00 -0.18 -1.16 120.51 123.39 1yqr n ALA 258 Ca 0.01 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.54 1yqr n ALA 258 Cb 0.53 0.00 0.24 0.00 0.00 0.00 0.00 19.45 20.22 1yqr n ALA 258 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1yqr n LEU 259 N -0.67 3.60 -3.80 0.00 4.77 -0.90 -4.58 117.00 115.43 1yqr n LEU 259 Ca 0.00 -3.04 -0.28 0.00 -0.03 0.00 0.00 56.01 52.66 1yqr n LEU 259 Cb 0.00 -0.53 0.05 0.00 -2.33 0.00 0.00 43.42 40.61 1yqr n LEU 259 CO 0.00 0.69 0.16 0.47 -1.33 0.00 0.00 177.39 177.38 1yqr n ASP 260 N -0.69 -5.36 -4.12 -1.43 8.00 -1.20 -4.60 116.55 107.16 1yqr n ASP 260 Ca 0.20 -0.69 -0.36 0.00 0.71 0.00 0.00 54.79 54.65 1yqr n ASP 260 Cb 0.85 -4.31 -0.06 0.00 -0.02 0.00 0.00 41.12 37.57 1yqr n ASP 260 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1yqr s LYS 261 N -6.50 3.34 0.22 -1.24 -0.14 -0.23 -4.93 119.74 110.26 1yqr s LYS 261 Ca 0.63 -3.30 0.17 0.00 -1.36 0.00 0.00 55.97 52.11 1yqr s LYS 261 Cb -0.30 -3.99 0.86 0.00 -1.68 0.00 0.00 37.83 32.72 1yqr s LYS 261 CO 0.79 -1.26 1.53 -0.35 -0.76 0.00 0.00 175.35 175.30 1yqr n PRO 262 N 2.31 0.11 0.00 -1.68 -0.04 -1.26 -1.57 135.00 132.87 1yqr n PRO 262 Ca 0.22 0.53 0.13 0.00 -0.04 0.00 0.00 63.50 64.33 1yqr n PRO 262 Cb 0.37 -1.81 0.29 0.00 -0.04 0.00 0.00 33.50 32.31 1yqr n PRO 262 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1yqr n GLN 263 N -2.05 1.53 -2.23 0.54 0.00 -0.76 -0.79 117.38 113.63 1yqr n GLN 263 Ca 0.00 -1.08 -0.42 0.00 0.00 0.00 0.00 57.00 55.50 1yqr n GLN 263 Cb 0.09 -1.48 -0.03 0.00 0.00 0.00 0.00 30.24 28.82 1yqr n GLN 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1yqr s ALA 264 N -2.21 3.56 -0.27 2.61 0.00 -0.61 -4.31 121.76 120.52 1yqr s ALA 264 Ca 0.29 0.95 0.02 0.00 0.00 0.00 0.00 51.96 53.22 1yqr s ALA 264 Cb 0.20 -3.56 0.07 0.00 0.00 0.00 0.00 23.12 19.83 1yqr s ALA 264 CO 0.42 -0.78 -0.03 0.08 0.00 0.00 0.00 175.76 175.45 1yqr s VAL 265 N 1.88 1.87 0.10 0.00 1.01 -1.26 -3.52 120.40 120.48 1yqr s VAL 265 Ca 0.64 -1.65 -0.31 0.00 0.00 0.00 0.00 61.98 60.66 1yqr s VAL 265 Cb -0.33 -2.16 -0.08 0.00 0.00 0.00 0.00 36.38 33.82 1yqr s VAL 265 CO 0.28 -0.25 1.40 -2.84 0.00 0.00 0.00 175.10 173.69 1yqr s PRO 266 N 1.20 4.31 -0.36 2.72 0.02 -1.26 -4.84 135.00 136.79 1yqr s PRO 266 Ca -0.01 2.07 -0.03 0.00 0.02 0.00 0.00 61.00 63.04 1yqr s PRO 266 Cb -0.19 -3.29 0.08 0.00 0.02 0.00 0.00 34.50 31.12 1yqr s PRO 266 CO -0.08 -0.46 0.12 0.08 -0.33 0.00 0.00 177.00 176.33 1yqr s VAL 267 N 1.26 3.28 0.02 3.83 1.01 -1.26 -4.89 120.40 123.64 1yqr s VAL 267 Ca 0.65 -1.66 0.00 0.00 0.00 0.00 0.00 61.98 60.97 1yqr s VAL 267 Cb -0.36 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 32.96 1yqr s VAL 267 CO 0.30 -0.40 0.00 -0.90 0.00 0.00 0.00 175.10 174.10 1yqr n ASP 268 N 4.64 2.00 -0.37 3.32 5.75 -1.26 -4.80 116.55 125.83 1yqr n ASP 268 Ca -0.08 -1.07 -0.02 0.00 -0.01 0.00 0.00 54.79 53.61 1yqr n ASP 268 Cb 0.43 0.01 0.12 0.00 -1.03 0.00 0.00 41.12 40.65 1yqr n ASP 268 CO 0.00 0.00 0.00 0.58 -0.11 0.00 0.00 177.20 177.67 1yqr h VAL 269 N 0.98 1.25 0.19 2.12 2.07 -1.99 -1.82 116.25 119.05 1yqr h VAL 269 Ca -0.01 -0.46 0.00 0.00 0.82 0.00 0.00 66.70 67.05 1yqr h VAL 269 Cb 0.04 -0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 29.58 1yqr h VAL 269 CO 0.02 0.25 -0.19 0.45 0.02 0.00 0.00 177.57 178.12 1yqr h HIS 270 N 1.35 -0.50 0.00 1.57 3.86 -1.99 -1.45 115.15 117.98 1yqr h HIS 270 Ca 0.37 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.56 1yqr h HIS 270 Cb -0.15 0.20 -0.00 0.00 1.06 0.00 0.00 27.41 28.52 1yqr h HIS 270 CO -0.00 -0.29 -0.08 0.52 0.86 0.00 0.00 177.93 178.94 1yqr h MET 271 N -0.41 0.00 -0.19 2.45 2.86 -1.83 -0.33 114.93 117.47 1yqr h MET 271 Ca 0.00 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.55 1yqr h MET 271 Cb 0.39 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.05 1yqr h MET 271 CO -0.05 0.08 -0.23 -1.49 1.06 0.00 0.00 176.91 176.28 1yqr h TRP 272 N 0.00 0.61 -0.76 -0.22 4.06 -0.78 0.23 115.95 119.08 1yqr h TRP 272 Ca -0.00 -0.19 -0.05 0.00 2.06 0.00 0.00 58.89 60.70 1yqr h TRP 272 Cb 0.17 -0.12 -0.03 0.00 -1.00 0.00 0.00 29.16 28.17 1yqr h TRP 272 CO 0.00 0.88 0.27 1.25 -3.56 0.00 0.00 178.44 177.28 1yqr h HIS 273 N 0.16 1.20 -0.46 0.49 2.76 -0.68 -1.34 115.15 117.29 1yqr h HIS 273 Ca 0.03 -0.11 -0.03 0.00 -2.20 0.00 0.00 60.37 58.06 1yqr h HIS 273 Cb 0.79 -0.35 -0.02 0.00 1.55 0.00 0.00 27.41 29.38 1yqr h HIS 273 CO 0.08 0.92 0.17 0.82 -1.30 0.00 0.00 177.93 178.63 1yqr h ILE 274 N 1.12 1.21 -0.19 6.26 2.04 -0.99 0.63 117.51 127.60 1yqr h ILE 274 Ca 0.25 -0.68 0.00 0.00 1.00 0.00 0.00 64.86 65.43 1yqr h ILE 274 Cb 0.26 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 1yqr h ILE 274 CO -0.01 0.25 0.12 0.00 0.00 0.00 0.00 178.15 178.50 1yqr h ALA 275 N 1.02 0.24 0.28 1.87 0.00 -0.53 0.11 119.26 122.25 1yqr h ALA 275 Ca 0.15 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1yqr h ALA 275 Cb 0.22 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1yqr h ALA 275 CO -0.01 -0.27 -0.14 1.96 0.00 0.00 0.00 179.25 180.80 1yqr h GLN 276 N 0.24 -0.37 -0.83 0.00 4.20 -1.19 -1.28 115.11 115.88 1yqr h GLN 276 Ca 0.07 0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.78 1yqr h GLN 276 Cb -0.00 0.08 -0.04 0.00 0.30 0.00 0.00 27.48 27.82 1yqr h GLN 276 CO -0.01 -0.03 0.42 -0.09 -0.67 0.00 0.00 178.83 178.45 1yqr h ARG 277 N -0.93 1.18 0.00 1.46 2.43 -0.92 0.85 114.38 118.45 1yqr h ARG 277 Ca -0.04 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 58.97 1yqr h ARG 277 Cb 0.50 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.83 1yqr h ARG 277 CO 0.06 0.89 -0.99 -0.25 -1.51 0.00 0.00 179.97 178.17 1yqr n ASP 278 N -4.32 0.84 0.00 -3.80 10.43 0.37 -4.54 116.55 115.54 1yqr n ASP 278 Ca 0.08 -0.82 0.00 0.00 2.57 0.00 0.00 54.79 56.63 1yqr n ASP 278 Cb 0.12 1.11 0.00 0.00 1.84 0.00 0.00 41.12 44.19 1yqr n ASP 278 CO 0.00 0.00 0.00 -1.22 -1.07 0.00 0.00 177.20 174.91 1yqr n TYR 279 N -1.53 0.00 -3.41 1.24 4.02 -0.64 -4.97 117.16 111.87 1yqr n TYR 279 Ca 0.03 -0.07 -0.24 0.00 -0.01 0.00 0.00 57.90 57.61 1yqr n TYR 279 Cb 0.31 -0.01 -0.01 0.00 -0.02 0.00 0.00 39.34 39.62 1yqr n TYR 279 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1yqr n SER 280 N -0.07 -3.42 -4.78 7.72 7.64 0.29 -4.88 113.62 116.13 1yqr n SER 280 Ca 0.00 -0.41 -0.37 0.00 1.01 0.00 0.00 58.87 59.10 1yqr n SER 280 Cb 0.28 -2.84 -0.03 0.00 -1.01 0.00 0.00 64.21 60.62 1yqr n SER 280 CO 0.00 0.00 0.00 0.86 -3.01 0.00 0.00 175.04 172.89 1yqr s TRP 281 N -2.91 3.09 -0.02 1.43 -0.00 -0.58 -4.94 118.94 115.02 1yqr s TRP 281 Ca 0.41 1.59 -0.07 0.00 -0.00 0.00 0.00 56.10 58.03 1yqr s TRP 281 Cb -0.22 -3.27 0.01 0.00 -0.00 0.00 0.00 33.47 29.98 1yqr s TRP 281 CO 0.51 -1.07 0.15 -1.01 -0.00 0.00 0.00 176.95 175.52 1yqr s HIS 282 N -1.56 -0.02 0.34 5.86 3.76 -1.26 -4.41 115.29 117.99 1yqr s HIS 282 Ca 0.59 0.03 -0.29 0.00 -0.15 0.00 0.00 55.06 55.24 1yqr s HIS 282 Cb -0.26 -0.02 -0.11 0.00 1.11 0.00 0.00 32.58 33.30 1yqr s HIS 282 CO 0.32 -0.23 1.41 -2.14 -0.85 0.00 0.00 174.74 173.25 1yqr s PRO 283 N -0.98 4.24 -0.02 8.40 0.02 -1.26 -4.96 135.00 140.43 1yqr s PRO 283 Ca -0.11 2.38 -0.03 0.00 0.02 0.00 0.00 61.00 63.27 1yqr s PRO 283 Cb -0.06 -3.03 -0.01 0.00 0.02 0.00 0.00 34.50 31.42 1yqr s PRO 283 CO 0.01 -0.37 -0.05 2.41 -0.33 0.00 0.00 177.00 178.67 1yqr n THR 284 N 0.92 0.25 0.29 0.99 -1.04 -1.26 -4.69 114.28 109.74 1yqr n THR 284 Ca 0.02 0.38 0.13 0.00 -2.04 0.00 0.00 64.05 62.54 1yqr n THR 284 Cb 0.40 -1.56 0.33 0.00 -1.82 0.00 0.00 70.33 67.69 1yqr n THR 284 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 1yqr h THR 285 N -0.15 0.00 -4.12 12.58 1.35 -1.98 -3.46 112.91 117.14 1yqr h THR 285 Ca 0.00 -0.79 -0.49 0.00 -0.55 0.00 0.00 66.41 64.57 1yqr h THR 285 Cb 0.15 1.78 0.06 0.00 -1.73 0.00 0.00 68.15 68.41 1yqr h THR 285 CO 0.00 0.00 0.40 -0.44 -0.25 0.00 0.00 175.52 175.23 1yqr s SER 286 N -5.82 5.80 -0.14 5.36 0.01 -1.26 -4.99 113.70 112.66 1yqr s SER 286 Ca 0.06 2.01 -0.26 0.00 1.31 0.00 0.00 55.95 59.07 1yqr s SER 286 Cb 0.07 -2.56 -0.25 0.00 0.21 0.00 0.00 66.02 63.48 1yqr s SER 286 CO 0.62 -1.16 0.66 1.56 0.41 0.00 0.00 173.24 175.34 1yqr h GLN 287 N 0.95 0.05 -7.30 12.44 7.50 -1.94 -3.48 115.11 123.34 1yqr h GLN 287 Ca -0.49 -0.08 -0.45 0.00 0.50 0.00 0.00 58.65 58.13 1yqr h GLN 287 Cb 1.24 0.03 0.17 0.00 0.05 0.00 0.00 27.48 28.97 1yqr h GLN 287 CO 0.57 1.04 0.14 0.00 -1.50 0.00 0.00 178.83 179.08 1yqr s ALA 288 N -2.29 0.55 -0.04 3.87 0.00 -1.26 -4.99 121.76 117.61 1yqr s ALA 288 Ca -0.20 -0.28 0.14 0.00 0.00 0.00 0.00 51.96 51.62 1yqr s ALA 288 Cb -0.00 -3.16 -0.21 0.00 0.00 0.00 0.00 23.12 19.74 1yqr s ALA 288 CO 0.69 -3.13 0.31 1.63 0.00 0.00 0.00 175.76 175.27 1yqr n LYS 289 N -4.39 0.48 -0.80 0.00 4.01 -1.26 -4.82 118.16 111.38 1yqr n LYS 289 Ca 0.05 -0.12 0.00 0.00 -0.51 0.00 0.00 58.31 57.72 1yqr n LYS 289 Cb 0.56 -1.32 0.00 0.00 -0.51 0.00 0.00 35.03 33.76 1yqr n LYS 289 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1yqr n GLY 290 N 1.70 6.25 3.67 0.72 0.00 -1.26 -4.80 105.19 111.47 1yqr n GLY 290 Ca -0.02 -2.04 -0.46 0.00 0.00 0.00 0.00 46.02 43.49 1yqr n GLY 290 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1yqr n PRO 291 N 0.00 2.19 -3.49 1.61 -0.02 -1.26 -4.72 135.00 129.31 1yqr n PRO 291 Ca 0.00 0.79 -0.09 0.00 -2.02 0.00 0.00 63.50 62.18 1yqr n PRO 291 Cb 0.00 -2.57 -0.02 0.00 -0.02 0.00 0.00 33.50 30.89 1yqr n PRO 291 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1yqr s SER 292 N 0.96 -0.42 0.55 2.55 1.04 -1.26 -4.98 113.70 112.13 1yqr s SER 292 Ca 0.79 -0.01 0.26 0.00 0.48 0.00 0.00 55.95 57.47 1yqr s SER 292 Cb -0.67 0.45 1.45 0.00 0.10 0.00 0.00 66.02 67.36 1yqr s SER 292 CO 0.38 -0.74 2.00 1.55 0.98 0.00 0.00 173.24 177.40 1yqr h PRO 293 N 2.00 0.00 0.17 4.02 0.13 -1.99 0.11 132.00 136.44 1yqr h PRO 293 Ca -0.26 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.54 1yqr h PRO 293 Cb 1.26 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.40 1yqr h PRO 293 CO 0.33 0.00 -1.65 1.96 -0.23 0.00 0.00 178.00 178.41 1yqr h GLN 294 N 0.00 0.35 -0.08 0.86 7.50 -1.96 -3.09 115.11 118.70 1yqr h GLN 294 Ca 0.22 -0.60 -0.20 0.00 0.50 0.00 0.00 58.65 58.57 1yqr h GLN 294 Cb 0.96 0.22 0.00 0.00 0.05 0.00 0.00 27.48 28.72 1yqr h GLN 294 CO -0.00 1.25 -0.79 1.79 -1.50 0.00 0.00 178.83 179.58 1yqr h THR 295 N 0.10 1.36 -0.61 -0.54 1.35 -1.70 -2.26 112.91 110.62 1yqr h THR 295 Ca -0.30 -2.17 -0.08 0.00 -0.55 0.00 0.00 66.41 63.31 1yqr h THR 295 Cb 2.08 2.15 -0.02 0.00 -1.73 0.00 0.00 68.15 70.62 1yqr h THR 295 CO 0.18 0.66 0.07 0.78 -0.25 0.00 0.00 175.52 176.96 1yqr h ASN 296 N 0.32 0.96 -0.33 5.36 2.35 -0.94 0.66 115.58 123.96 1yqr h ASN 296 Ca -0.05 -0.23 -0.04 0.00 -0.55 0.00 0.00 56.30 55.43 1yqr h ASN 296 Cb 1.39 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 39.49 1yqr h ASN 296 CO 0.14 0.97 0.04 0.50 -1.65 0.00 0.00 177.43 177.43 1yqr h LYS 297 N 0.94 0.56 -0.48 0.81 3.64 -1.48 -2.00 116.57 118.55 1yqr h LYS 297 Ca 0.18 -0.16 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 1yqr h LYS 297 Cb 0.44 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 1yqr h LYS 297 CO 0.01 0.66 0.22 1.49 -2.27 0.00 0.00 179.45 179.56 1yqr h GLU 298 N 0.38 0.70 -0.49 1.90 4.81 -1.07 -2.04 114.58 118.77 1yqr h GLU 298 Ca 0.10 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1yqr h GLU 298 Cb 0.38 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 1yqr h GLU 298 CO 0.01 0.60 0.25 1.25 -0.73 0.00 0.00 179.01 180.39 1yqr h LEU 299 N 0.63 0.60 -0.68 1.64 5.85 -0.79 -0.19 115.31 122.38 1yqr h LEU 299 Ca 0.16 -0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.76 1yqr h LEU 299 Cb 0.14 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 1yqr h LEU 299 CO -0.02 0.50 0.13 1.23 -0.34 0.00 0.00 178.44 179.95 1yqr h GLY 300 N 0.77 1.19 2.00 3.75 0.00 -0.77 -1.35 103.07 108.68 1yqr h GLY 300 Ca 0.17 -0.78 -0.11 0.00 0.00 0.00 0.00 47.33 46.62 1yqr h GLY 300 CO -0.03 0.72 -0.51 3.43 0.00 0.00 0.00 176.54 180.16 1yqr h ASN 301 N 1.04 0.00 0.06 0.19 -0.26 -0.69 -1.84 115.58 114.07 1yqr h ASN 301 Ca 0.21 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.95 1yqr h ASN 301 Cb 0.42 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.68 1yqr h ASN 301 CO 0.01 0.51 -0.03 0.15 -1.06 0.00 0.00 177.43 177.01 1yqr h PHE 302 N 0.00 -0.07 -0.41 1.19 3.57 -0.45 -0.10 116.94 120.67 1yqr h PHE 302 Ca -0.01 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 1yqr h PHE 302 Cb 0.93 0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.67 1yqr h PHE 302 CO 0.00 0.12 0.16 0.74 -2.23 0.00 0.00 178.31 177.10 1yqr h PHE 303 N -0.25 0.58 -0.29 0.41 0.05 -1.10 -0.77 116.94 115.56 1yqr h PHE 303 Ca -0.01 -0.02 -0.06 0.00 3.82 0.00 0.00 57.97 61.70 1yqr h PHE 303 Cb 0.23 -0.18 -0.01 0.00 2.00 0.00 0.00 35.95 37.98 1yqr h PHE 303 CO -0.01 0.47 -0.04 0.00 -0.18 0.00 0.00 178.31 178.55 1yqr h ARG 304 N 0.58 0.54 0.00 1.51 3.08 -1.04 0.18 114.38 119.24 1yqr h ARG 304 Ca 0.14 -0.19 -0.06 0.00 0.07 0.00 0.00 59.98 59.94 1yqr h ARG 304 Cb 0.13 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 1yqr h ARG 304 CO -0.01 0.71 -0.29 0.66 -1.07 0.00 0.00 179.97 179.97 1yqr h SER 305 N 0.31 0.00 0.10 7.04 4.64 -0.64 0.10 113.55 125.11 1yqr h SER 305 Ca 0.08 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.21 1yqr h SER 305 Cb 0.49 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.60 1yqr h SER 305 CO 0.02 0.29 -0.80 0.25 -0.87 0.00 0.00 176.83 175.73 1yqr h LEU 306 N 0.00 0.53 0.00 5.97 5.85 -0.87 -3.40 115.31 123.39 1yqr h LEU 306 Ca -0.00 -0.88 -0.10 0.00 0.84 0.00 0.00 57.88 57.74 1yqr h LEU 306 Cb 0.60 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 1yqr h LEU 306 CO 0.04 1.36 -2.05 0.79 -0.34 0.00 0.00 178.44 178.24 1yqr n TRP 307 N -4.12 0.00 0.00 1.25 8.01 0.03 -4.85 117.44 117.76 1yqr n TRP 307 Ca -0.13 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.06 1yqr n TRP 307 Cb 0.79 -0.60 0.00 0.00 -2.01 0.00 0.00 31.31 29.49 1yqr n TRP 307 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1yqr n GLY 308 N 1.46 -1.58 0.38 6.99 0.00 0.02 -4.57 105.19 107.90 1yqr n GLY 308 Ca -0.11 -2.06 0.20 0.00 0.00 0.00 0.00 46.02 44.04 1yqr n GLY 308 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1yqr h PRO 309 N 0.44 0.00 -0.38 1.61 0.11 -1.93 -1.42 132.00 130.44 1yqr h PRO 309 Ca 0.00 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.90 1yqr h PRO 309 Cb 0.00 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 30.98 1yqr h PRO 309 CO 0.00 0.00 -0.15 0.66 -0.21 0.00 0.00 178.00 178.30 1yqr n TYR 310 N -3.59 1.20 -0.28 0.65 4.02 -1.26 -1.83 117.16 116.08 1yqr n TYR 310 Ca 0.07 -1.71 0.11 0.00 -0.01 0.00 0.00 57.90 56.35 1yqr n TYR 310 Cb 0.62 -0.50 0.36 0.00 -0.02 0.00 0.00 39.34 39.80 1yqr n TYR 310 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1yqr h ALA 311 N 1.13 1.79 -0.80 -0.72 0.00 -1.18 0.02 119.26 119.50 1yqr h ALA 311 Ca 0.23 0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.22 1yqr h ALA 311 Cb 1.56 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 19.16 1yqr h ALA 311 CO 0.43 -0.02 0.52 0.78 0.00 0.00 0.00 179.25 180.96 1yqr h GLY 312 N 0.73 1.11 0.96 0.00 0.00 -1.00 0.33 103.07 105.21 1yqr h GLY 312 Ca 0.45 -0.35 -0.14 0.00 0.00 0.00 0.00 47.33 47.28 1yqr h GLY 312 CO -0.21 0.26 -0.43 1.49 0.00 0.00 0.00 176.54 177.65 1yqr h TRP 313 N 0.87 0.82 -0.80 5.60 4.06 -1.09 -2.09 115.95 123.33 1yqr h TRP 313 Ca 0.34 -0.30 0.03 0.00 2.06 0.00 0.00 58.89 61.02 1yqr h TRP 313 Cb 0.23 -0.15 -0.05 0.00 -1.00 0.00 0.00 29.16 28.19 1yqr h TRP 313 CO -0.00 1.07 0.51 0.00 -3.56 0.00 0.00 178.44 176.46 1yqr h ALA 314 N 0.60 1.05 -0.92 1.49 0.00 -0.81 -0.22 119.26 120.45 1yqr h ALA 314 Ca 0.00 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 54.99 1yqr h ALA 314 Cb 1.04 -0.27 -0.08 0.00 0.00 0.00 0.00 17.79 18.48 1yqr h ALA 314 CO 0.10 0.32 0.55 0.37 0.00 0.00 0.00 179.25 180.59 1yqr h GLN 315 N 0.99 0.86 -0.42 0.00 -0.00 -0.14 -1.26 115.11 115.14 1yqr h GLN 315 Ca 0.32 -0.05 -0.01 0.00 -0.00 0.00 0.00 58.65 58.90 1yqr h GLN 315 Cb 0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 27.48 27.28 1yqr h GLN 315 CO -0.11 0.57 0.20 0.00 0.00 0.00 0.00 178.83 179.48 1yqr h ALA 316 N 1.50 1.57 0.50 3.38 0.00 -0.34 -0.63 119.26 125.25 1yqr h ALA 316 Ca 0.45 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.25 1yqr h ALA 316 Cb 0.44 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1yqr h ALA 316 CO -0.26 0.35 -0.24 0.28 0.00 0.00 0.00 179.25 179.38 1yqr h VAL 317 N 0.58 0.39 -0.63 0.00 2.07 -0.89 -1.94 116.25 115.83 1yqr h VAL 317 Ca 0.15 -0.40 -0.07 0.00 0.82 0.00 0.00 66.70 67.20 1yqr h VAL 317 Cb 0.06 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 1yqr h VAL 317 CO -0.02 0.05 0.13 -0.07 0.02 0.00 0.00 177.57 177.68 1yqr h LEU 318 N -0.96 0.95 0.12 2.57 3.38 -1.42 -0.12 115.31 119.83 1yqr h LEU 318 Ca -0.07 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1yqr h LEU 318 Cb 0.61 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1yqr h LEU 318 CO 0.11 0.93 -0.06 0.15 0.09 0.00 0.00 178.44 179.67 1yqr h PHE 319 N 0.95 -0.14 -0.93 1.13 3.57 -1.17 0.35 116.94 120.70 1yqr h PHE 319 Ca 0.20 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.71 1yqr h PHE 319 Cb 0.38 0.05 -0.05 0.00 2.79 0.00 0.00 35.95 39.11 1yqr h PHE 319 CO 0.03 -0.07 0.61 1.03 -2.23 0.00 0.00 178.31 177.68 1yqr h SER 320 N -0.18 1.05 0.26 0.41 0.87 -1.18 -1.36 113.55 113.43 1yqr h SER 320 Ca -0.02 -0.02 -0.12 0.00 -1.23 0.00 0.00 61.79 60.40 1yqr h SER 320 Cb 0.14 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.83 1yqr h SER 320 CO 0.03 0.75 -0.48 0.00 -0.53 0.00 0.00 176.83 176.59 1yqr h ALA 321 N 1.43 1.00 0.00 6.23 0.00 -0.60 -2.88 119.26 124.43 1yqr h ALA 321 Ca 0.35 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1yqr h ALA 321 Cb -0.10 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1yqr h ALA 321 CO -0.08 0.64 0.00 0.22 0.00 0.00 0.00 179.25 180.03 1yqr h ASP 322 N 0.21 0.00 0.97 0.00 3.58 0.81 -2.73 116.42 119.27 1yqr h ASP 322 Ca 0.01 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 57.29 1yqr h ASP 322 Cb 0.93 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.95 1yqr h ASP 322 CO 0.08 0.00 -0.82 -0.07 -2.88 0.00 0.00 179.24 175.55 1yqr h LEU 323 N 0.00 0.00 0.00 2.28 3.38 -1.23 -3.16 115.31 116.58 1yqr h LEU 323 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1yqr h LEU 323 Cb 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1yqr h LEU 323 CO 0.00 0.82 0.00 0.54 0.09 0.00 0.00 178.44 179.89 1yqr n ARG 324 N -3.44 0.59 0.00 1.13 3.00 -1.03 -5.15 116.66 111.76 1yqr n ARG 324 Ca -0.00 0.00 0.15 0.00 -0.01 0.00 0.00 57.85 57.99 1yqr n ARG 324 Cb 0.82 -1.36 0.76 0.00 0.00 0.00 0.00 32.46 32.67 1yqr n ARG 324 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67