#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qyh s ARG 3 N 0.00 2.82 0.07 1.61 1.81 -1.26 -5.04 118.95 118.96 2qyh s ARG 3 Ca 0.00 1.64 0.06 0.00 -1.72 0.00 0.00 55.73 55.72 2qyh s ARG 3 Cb 0.00 -1.93 -0.04 0.00 -0.45 0.00 0.00 34.95 32.53 2qyh s ARG 3 CO 0.00 -1.28 -0.11 0.15 -0.68 0.00 0.00 175.30 173.38 2qyh s LYS 4 N -3.66 2.22 0.01 3.54 1.02 -1.26 -4.73 119.74 116.87 2qyh s LYS 4 Ca 0.73 -0.94 0.02 0.00 0.02 0.00 0.00 55.97 55.79 2qyh s LYS 4 Cb -0.26 -2.33 -0.01 0.00 -0.52 0.00 0.00 37.83 34.71 2qyh s LYS 4 CO 0.37 0.54 -0.06 -1.50 -0.92 0.00 0.00 175.35 173.78 2qyh s ILE 5 N -1.11 0.44 -0.11 2.17 2.07 -0.95 -0.90 121.20 122.82 2qyh s ILE 5 Ca 0.19 -0.46 0.03 0.00 -1.41 0.00 0.00 60.65 59.00 2qyh s ILE 5 Cb -0.11 -0.41 0.01 0.00 0.13 0.00 0.00 42.46 42.07 2qyh s ILE 5 CO 0.11 -0.03 -0.21 -0.69 -1.91 0.00 0.00 174.94 172.21 2qyh s VAL 6 N -0.48 1.86 -0.15 4.00 1.01 -0.02 -1.10 120.40 125.52 2qyh s VAL 6 Ca -0.02 -0.89 -0.05 0.00 0.00 0.00 0.00 61.98 61.03 2qyh s VAL 6 Cb -0.04 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 2qyh s VAL 6 CO -0.00 0.51 0.02 -0.36 0.00 0.00 0.00 175.10 175.28 2qyh s PHE 7 N 0.60 3.18 0.07 5.22 0.08 -0.29 -1.21 117.98 125.64 2qyh s PHE 7 Ca -0.13 0.01 0.09 0.00 0.12 0.00 0.00 56.93 57.01 2qyh s PHE 7 Cb -0.17 -1.98 -0.03 0.00 -0.57 0.00 0.00 43.02 40.27 2qyh s PHE 7 CO 0.04 0.18 -0.23 -0.06 -0.10 0.00 0.00 175.22 175.05 2qyh s PHE 8 N 0.07 2.42 0.44 0.36 0.08 -0.20 -1.36 117.98 119.78 2qyh s PHE 8 Ca 0.03 -0.34 0.08 0.00 0.12 0.00 0.00 56.93 56.82 2qyh s PHE 8 Cb -0.13 -1.37 0.01 0.00 -0.57 0.00 0.00 43.02 40.96 2qyh s PHE 8 CO 0.01 0.25 0.56 0.34 -0.10 0.00 0.00 175.22 176.29 2qyh s ASP 9 N -1.62 5.52 0.00 1.36 -1.08 -1.00 -0.72 116.67 119.13 2qyh s ASP 9 Ca 0.14 -0.51 0.00 0.00 -0.52 0.00 0.00 52.55 51.66 2qyh s ASP 9 Cb -0.10 -0.55 0.00 0.00 -1.46 0.00 0.00 42.92 40.81 2qyh s ASP 9 CO 0.05 -0.80 0.00 -0.38 0.52 0.00 0.00 175.17 174.56 2qyh n ILE 10 N -1.85 0.00 -1.69 4.11 -0.00 -1.26 -3.15 119.36 115.52 2qyh n ILE 10 Ca 0.08 0.29 -0.54 0.00 -0.00 0.00 0.00 62.75 62.59 2qyh n ILE 10 Cb 0.60 -1.03 -0.06 0.00 -0.00 0.00 0.00 39.64 39.15 2qyh n ILE 10 CO 0.00 0.00 0.00 0.47 -0.00 0.00 0.00 176.55 177.02 2qyh n ASP 11 N -1.63 2.73 0.00 4.38 8.00 -1.26 -1.03 116.55 127.74 2qyh n ASP 11 Ca 0.00 1.04 0.00 0.00 0.71 0.00 0.00 54.79 56.54 2qyh n ASP 11 Cb 0.00 -1.23 0.00 0.00 -0.02 0.00 0.00 41.12 39.87 2qyh n ASP 11 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qyh n GLY 12 N 4.15 0.55 0.43 0.44 0.00 -0.89 -4.48 105.19 105.38 2qyh n GLY 12 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2qyh n GLY 12 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2qyh n THR 13 N -2.02 0.00 0.06 2.61 -1.04 -0.20 -4.27 114.28 109.43 2qyh n THR 13 Ca 0.00 0.11 -0.21 0.00 -2.04 0.00 0.00 64.05 61.91 2qyh n THR 13 Cb 0.01 -0.99 -0.14 0.00 -1.82 0.00 0.00 70.33 67.39 2qyh n THR 13 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2qyh h LEU 14 N 0.00 0.55 -9.67 -4.42 3.38 -1.05 -3.45 115.31 100.65 2qyh h LEU 14 Ca 0.00 -0.93 -0.66 0.00 0.09 0.00 0.00 57.88 56.38 2qyh h LEU 14 Cb 0.00 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.51 2qyh h LEU 14 CO 0.00 1.43 -0.46 -0.76 0.09 0.00 0.00 178.44 178.74 2qyh s LEU 15 N -7.89 4.39 0.00 1.67 1.43 -1.04 -4.24 118.68 113.00 2qyh s LEU 15 Ca -0.13 0.50 0.00 0.00 -1.03 0.00 0.00 54.13 53.47 2qyh s LEU 15 Cb 0.02 -2.19 0.00 0.00 0.03 0.00 0.00 46.19 44.05 2qyh s LEU 15 CO 0.85 0.38 0.00 -0.90 0.23 0.00 0.00 176.35 176.91 2qyh n ASP 16 N 1.82 -0.19 0.00 2.29 3.85 -0.31 -2.10 116.55 121.92 2qyh n ASP 16 Ca -0.18 -0.88 0.09 0.00 -0.71 0.00 0.00 54.79 53.11 2qyh n ASP 16 Cb 0.54 0.00 0.43 0.00 -1.35 0.00 0.00 41.12 40.74 2qyh n ASP 16 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 2qyh n GLU 17 N -1.07 0.11 -0.07 0.11 4.71 -1.26 -1.78 120.64 121.39 2qyh n GLU 17 Ca 0.00 0.15 0.12 0.00 -0.01 0.00 0.00 57.16 57.42 2qyh n GLU 17 Cb 0.00 -1.50 0.21 0.00 -1.01 0.00 0.00 31.44 29.14 2qyh n GLU 17 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 2qyh n GLN 18 N -1.41 2.27 -1.13 3.49 3.00 -1.26 -4.92 117.38 117.41 2qyh n GLN 18 Ca 0.06 -1.87 -0.05 0.00 -0.01 0.00 0.00 57.00 55.14 2qyh n GLN 18 Cb 0.19 -1.48 -0.02 0.00 0.00 0.00 0.00 30.24 28.93 2qyh n GLN 18 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 2qyh n LYS 19 N 1.18 -0.43 -3.83 -1.09 4.76 -0.73 -5.03 118.16 112.99 2qyh n LYS 19 Ca 0.17 0.59 -0.27 0.00 -2.87 0.00 0.00 58.31 55.93 2qyh n LYS 19 Cb 0.55 -4.26 -0.03 0.00 -1.84 0.00 0.00 35.03 29.45 2qyh n LYS 19 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 2qyh s GLN 20 N -2.09 3.48 -0.29 1.97 -1.52 -1.26 -4.79 119.66 115.15 2qyh s GLN 20 Ca 0.00 -0.48 -0.16 0.00 -1.95 0.00 0.00 55.36 52.77 2qyh s GLN 20 Cb 0.00 -2.91 -0.03 0.00 -0.22 0.00 0.00 33.01 29.86 2qyh s GLN 20 CO 0.00 0.46 0.41 -1.17 -0.25 0.00 0.00 175.29 174.74 2qyh s LEU 21 N -3.29 4.13 0.49 2.90 2.96 -1.26 -1.16 118.68 123.45 2qyh s LEU 21 Ca 0.36 0.21 -0.23 0.00 -0.22 0.00 0.00 54.13 54.25 2qyh s LEU 21 Cb -0.11 -2.47 -0.06 0.00 0.50 0.00 0.00 46.19 44.05 2qyh s LEU 21 CO 0.29 -0.26 1.28 -2.84 -1.32 0.00 0.00 176.35 173.49 2qyh s PRO 22 N 2.14 3.50 0.19 0.98 0.02 -1.26 -4.94 135.00 135.63 2qyh s PRO 22 Ca 0.16 2.05 -0.13 0.00 0.02 0.00 0.00 61.00 63.10 2qyh s PRO 22 Cb -0.16 -2.39 0.11 0.00 0.02 0.00 0.00 34.50 32.08 2qyh s PRO 22 CO 0.11 -0.84 1.85 -0.07 -0.33 0.00 0.00 177.00 177.71 2qyh h LEU 23 N 1.86 0.69 -1.98 -5.54 4.07 -1.98 -2.22 115.31 110.20 2qyh h LEU 23 Ca -0.50 -0.01 -0.02 0.00 0.08 0.00 0.00 57.88 57.42 2qyh h LEU 23 Cb 1.27 -0.17 -0.00 0.00 1.08 0.00 0.00 40.66 42.84 2qyh h LEU 23 CO 0.59 0.49 -0.09 0.77 -1.08 0.00 0.00 178.44 179.12 2qyh h SER 24 N 0.81 0.00 -0.23 -0.43 4.64 -1.99 -2.13 113.55 114.22 2qyh h SER 24 Ca 0.23 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.40 2qyh h SER 24 Cb -0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.02 2qyh h SER 24 CO -0.06 0.09 -0.45 0.74 -0.87 0.00 0.00 176.83 176.29 2qyh h THR 25 N 0.00 1.31 -0.88 2.95 2.02 -1.78 0.14 112.91 116.67 2qyh h THR 25 Ca -0.00 -1.65 0.04 0.00 0.77 0.00 0.00 66.41 65.56 2qyh h THR 25 Cb 0.20 1.77 -0.05 0.00 -1.74 0.00 0.00 68.15 68.33 2qyh h THR 25 CO 0.01 0.52 0.57 0.40 0.37 0.00 0.00 175.52 177.39 2qyh h ILE 26 N 0.44 1.14 -0.09 3.11 2.04 -1.19 0.06 117.51 123.01 2qyh h ILE 26 Ca 0.01 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.49 2qyh h ILE 26 Cb 1.05 -0.05 -0.00 0.00 -0.74 0.00 0.00 36.82 37.07 2qyh h ILE 26 CO 0.10 0.20 0.04 -0.33 0.00 0.00 0.00 178.15 178.16 2qyh h GLU 27 N 1.09 0.14 -0.12 2.37 4.39 -1.22 -0.94 114.58 120.29 2qyh h GLU 27 Ca 0.35 -0.03 0.05 0.00 0.34 0.00 0.00 59.36 60.07 2qyh h GLU 27 Cb 0.01 -0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 28.59 2qyh h GLU 27 CO -0.12 0.25 -0.22 0.00 -1.16 0.00 0.00 179.01 177.76 2qyh h ALA 28 N 0.88 -0.18 -0.90 3.43 0.00 -0.26 0.78 119.26 123.00 2qyh h ALA 28 Ca 0.03 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.01 2qyh h ALA 28 Cb 0.16 0.42 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 2qyh h ALA 28 CO -0.00 -0.68 0.59 0.28 0.00 0.00 0.00 179.25 179.44 2qyh h VAL 29 N -0.28 1.17 0.92 0.00 2.07 -0.93 0.66 116.25 119.87 2qyh h VAL 29 Ca 0.10 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 67.18 2qyh h VAL 29 Cb 0.43 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.12 2qyh h VAL 29 CO -0.29 0.21 -0.49 -0.09 0.02 0.00 0.00 177.57 176.93 2qyh h ARG 30 N 1.15 -1.25 -0.77 1.57 2.43 0.20 -0.93 114.38 116.77 2qyh h ARG 30 Ca 0.35 0.09 0.09 0.00 -0.81 0.00 0.00 59.98 59.70 2qyh h ARG 30 Cb -0.02 0.29 -0.07 0.00 -0.42 0.00 0.00 29.97 29.75 2qyh h ARG 30 CO -0.10 -0.84 0.42 0.00 -1.51 0.00 0.00 179.97 177.94 2qyh h ARG 31 N -1.30 0.69 -0.89 0.20 2.47 -0.70 -1.37 114.38 113.48 2qyh h ARG 31 Ca -0.13 -0.04 0.07 0.00 -1.26 0.00 0.00 59.98 58.63 2qyh h ARG 31 Cb 1.02 -0.16 -0.07 0.00 -1.65 0.00 0.00 29.97 29.11 2qyh h ARG 31 CO 0.18 0.46 0.55 1.25 0.56 0.00 0.00 179.97 182.96 2qyh h LEU 32 N 0.71 0.85 -0.28 3.04 5.85 -0.68 -1.50 115.31 123.30 2qyh h LEU 32 Ca 0.37 0.02 -0.19 0.00 0.84 0.00 0.00 57.88 58.92 2qyh h LEU 32 Cb 0.35 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.23 2qyh h LEU 32 CO -0.25 0.52 -0.61 0.11 -0.34 0.00 0.00 178.44 177.88 2qyh h LYS 33 N 0.97 0.83 0.00 1.25 1.57 -0.08 -1.27 116.57 119.84 2qyh h LYS 33 Ca 0.40 -0.56 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 2qyh h LYS 33 Cb 0.24 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.63 2qyh h LYS 33 CO -0.20 1.19 0.00 -0.56 -0.57 0.00 0.00 179.45 179.32 2qyh h GLN 34 N 0.62 0.00 -0.03 3.15 3.07 -1.08 -2.07 115.11 118.77 2qyh h GLN 34 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2qyh h GLN 34 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.78 2qyh h GLN 34 CO 0.13 0.00 0.00 0.43 0.09 0.00 0.00 178.83 179.48 2qyh n SER 35 N -2.94 0.79 0.00 0.06 7.64 -0.59 -4.90 113.62 113.68 2qyh n SER 35 Ca 0.02 -1.35 0.00 0.00 1.01 0.00 0.00 58.87 58.55 2qyh n SER 35 Cb 0.35 -0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.54 2qyh n SER 35 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qyh n GLY 36 N 1.05 0.49 3.65 0.23 0.00 -0.78 -5.02 105.19 104.82 2qyh n GLY 36 Ca 0.20 -0.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 2qyh n GLY 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qyh s VAL 37 N -2.00 4.92 0.29 1.61 1.01 -0.49 -4.65 120.40 121.08 2qyh s VAL 37 Ca 0.00 1.43 -0.29 0.00 0.00 0.00 0.00 61.98 63.11 2qyh s VAL 37 Cb 0.00 -4.05 -0.10 0.00 0.00 0.00 0.00 36.38 32.23 2qyh s VAL 37 CO 0.00 0.02 1.38 -0.47 0.00 0.00 0.00 175.10 176.03 2qyh s TYR 38 N 2.34 3.02 -0.09 5.22 5.04 -0.07 -4.21 117.35 128.60 2qyh s TYR 38 Ca 0.33 1.20 0.04 0.00 -2.44 0.00 0.00 57.07 56.20 2qyh s TYR 38 Cb -0.16 -3.76 -0.01 0.00 0.35 0.00 0.00 41.96 38.39 2qyh s TYR 38 CO 0.10 -2.30 -0.22 0.08 -1.34 0.00 0.00 175.55 171.87 2qyh s VAL 39 N -0.51 2.30 0.28 3.14 1.01 -1.26 -0.84 120.40 124.52 2qyh s VAL 39 Ca 0.55 -0.95 -0.08 0.00 0.00 0.00 0.00 61.98 61.50 2qyh s VAL 39 Cb -0.41 -1.89 -0.00 0.00 0.00 0.00 0.00 36.38 34.08 2qyh s VAL 39 CO 0.48 0.56 0.44 0.00 0.00 0.00 0.00 175.10 176.58 2qyh s ALA 40 N 0.19 0.30 0.09 5.51 0.00 -0.35 -4.73 121.76 122.76 2qyh s ALA 40 Ca -0.13 -1.22 0.10 0.00 0.00 0.00 0.00 51.96 50.71 2qyh s ALA 40 Cb -0.16 1.13 -0.03 0.00 0.00 0.00 0.00 23.12 24.05 2qyh s ALA 40 CO 0.07 -0.80 -0.26 0.42 0.00 0.00 0.00 175.76 175.19 2qyh s ILE 41 N -3.63 2.14 -0.10 0.00 1.01 -1.07 -1.03 121.20 118.52 2qyh s ILE 41 Ca 0.27 -1.56 -0.03 0.00 0.00 0.00 0.00 60.65 59.34 2qyh s ILE 41 Cb 0.00 -1.87 0.04 0.00 0.01 0.00 0.00 42.46 40.65 2qyh s ILE 41 CO 0.14 0.20 0.05 0.00 0.00 0.00 0.00 174.94 175.33 2qyh s ALA 42 N -0.94 0.45 0.20 9.38 0.00 0.10 0.90 121.76 131.86 2qyh s ALA 42 Ca 0.12 -0.09 -0.12 0.00 0.00 0.00 0.00 51.96 51.87 2qyh s ALA 42 Cb -0.10 -0.81 0.00 0.00 0.00 0.00 0.00 23.12 22.21 2qyh s ALA 42 CO 0.04 -0.73 0.40 -0.08 0.00 0.00 0.00 175.76 175.39 2qyh s THR 43 N 2.09 0.03 -0.29 0.00 -1.32 0.14 -3.82 115.64 112.47 2qyh s THR 43 Ca 0.04 -1.27 0.22 0.00 -1.21 0.00 0.00 61.69 59.47 2qyh s THR 43 Cb -0.14 -1.92 0.10 0.00 -1.51 0.00 0.00 72.50 69.03 2qyh s THR 43 CO -0.06 -0.15 1.22 1.23 -2.21 0.00 0.00 174.62 174.66 2qyh h GLY 44 N 2.37 0.00 -1.76 6.08 0.00 -1.92 -1.92 103.07 105.93 2qyh h GLY 44 Ca -0.29 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.50 2qyh h GLY 44 CO 0.41 0.00 0.25 0.54 0.00 0.00 0.00 176.54 177.74 2qyh n ARG 45 N -2.83 0.24 -2.90 4.80 1.74 -1.26 -3.31 116.66 113.14 2qyh n ARG 45 Ca 0.01 0.15 -0.34 0.00 -0.77 0.00 0.00 57.85 56.90 2qyh n ARG 45 Cb 0.56 -2.37 -0.07 0.00 -1.02 0.00 0.00 32.46 29.56 2qyh n ARG 45 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qyh s ALA 46 N -2.06 3.16 0.19 7.54 0.00 -1.26 -1.66 121.76 127.67 2qyh s ALA 46 Ca 0.73 0.33 -0.19 0.00 0.00 0.00 0.00 51.96 52.83 2qyh s ALA 46 Cb -0.30 -3.06 0.15 0.00 0.00 0.00 0.00 23.12 19.92 2qyh s ALA 46 CO 0.51 0.19 1.60 -1.35 0.00 0.00 0.00 175.76 176.72 2qyh h PRO 47 N 2.33 -0.12 -2.97 0.00 0.11 -1.87 -3.29 132.00 126.18 2qyh h PRO 47 Ca -0.48 0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 2qyh h PRO 47 Cb 1.18 0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2qyh h PRO 47 CO 0.63 -0.08 0.50 1.97 -0.21 0.00 0.00 178.00 180.81 2qyh n PHE 48 N -5.43 0.05 0.00 0.65 -1.74 -1.22 -2.93 117.46 106.84 2qyh n PHE 48 Ca 0.05 -0.32 0.00 0.00 -0.56 0.00 0.00 57.45 56.61 2qyh n PHE 48 Cb 0.35 -0.63 0.00 0.00 1.52 0.00 0.00 39.48 40.72 2qyh n PHE 48 CO 0.00 0.00 0.00 1.97 -0.56 0.00 0.00 176.76 178.17 2qyh n PHE 50 N 3.16 0.00 -0.02 2.97 1.16 -1.24 -4.84 117.46 118.64 2qyh n PHE 50 Ca 0.08 0.00 -0.00 0.00 -1.87 0.00 0.00 57.45 55.66 2qyh n PHE 50 Cb 0.13 0.00 0.30 0.00 -1.61 0.00 0.00 39.48 38.30 2qyh n PHE 50 CO 0.00 0.00 0.00 1.49 -1.87 0.00 0.00 176.76 176.38 2qyh h GLU 51 N 0.18 0.57 -0.55 3.97 4.22 -1.86 -2.15 114.58 118.96 2qyh h GLU 51 Ca 0.00 -0.11 -0.04 0.00 0.08 0.00 0.00 59.36 59.29 2qyh h GLU 51 Cb 0.00 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 2qyh h GLU 51 CO 0.00 0.56 0.19 1.12 -2.18 0.00 0.00 179.01 178.69 2qyh h HIS 52 N 0.56 0.87 -0.76 0.92 2.07 -1.91 -0.45 115.15 116.45 2qyh h HIS 52 Ca 0.12 -0.08 -0.06 0.00 -2.85 0.00 0.00 60.37 57.51 2qyh h HIS 52 Cb 0.28 -0.25 -0.03 0.00 2.57 0.00 0.00 27.41 29.97 2qyh h HIS 52 CO 0.01 0.73 0.26 0.28 -3.07 0.00 0.00 177.93 176.14 2qyh h VAL 53 N 0.76 1.26 -0.48 6.12 2.07 -1.87 -0.14 116.25 123.97 2qyh h VAL 53 Ca 0.18 -0.89 -0.02 0.00 0.82 0.00 0.00 66.70 66.79 2qyh h VAL 53 Cb 0.26 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 2qyh h VAL 53 CO -0.01 0.35 0.23 0.03 0.02 0.00 0.00 177.57 178.19 2qyh h ARG 54 N 1.13 0.69 -0.56 1.57 3.08 -1.12 -1.40 114.38 117.77 2qyh h ARG 54 Ca 0.25 -0.11 -0.09 0.00 0.07 0.00 0.00 59.98 60.10 2qyh h ARG 54 Cb 0.28 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 2qyh h ARG 54 CO -0.01 0.59 -0.01 -0.22 -1.07 0.00 0.00 179.97 179.25 2qyh h LYS 55 N 0.63 0.98 -0.49 0.04 1.63 -0.72 0.39 116.57 119.03 2qyh h LYS 55 Ca 0.16 -0.30 -0.08 0.00 -0.85 0.00 0.00 60.65 59.58 2qyh h LYS 55 Cb 0.13 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 31.65 2qyh h LYS 55 CO -0.02 0.97 -0.01 1.96 -3.45 0.00 0.00 179.45 178.89 2qyh h GLN 56 N 0.90 0.87 -0.01 1.90 4.20 -0.73 -3.22 115.11 119.02 2qyh h GLN 56 Ca 0.16 -0.28 0.00 0.00 0.06 0.00 0.00 58.65 58.59 2qyh h GLN 56 Cb 0.54 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.24 2qyh h GLN 56 CO 0.03 0.91 -0.59 1.28 -0.67 0.00 0.00 178.83 179.80 2qyh n LEU 57 N -4.32 1.29 -2.92 1.46 4.77 -0.55 -4.99 117.00 111.74 2qyh n LEU 57 Ca 0.01 -0.46 -0.13 0.00 -0.03 0.00 0.00 56.01 55.40 2qyh n LEU 57 Cb 0.32 -0.06 0.06 0.00 -2.33 0.00 0.00 43.42 41.41 2qyh n LEU 57 CO 0.42 0.26 0.05 0.61 -1.33 0.00 0.00 177.39 177.41 2qyh n GLY 58 N 1.44 -0.51 3.16 -0.72 0.00 0.13 -5.01 105.19 103.68 2qyh n GLY 58 Ca 0.08 0.23 -0.34 0.00 0.00 0.00 0.00 46.02 45.99 2qyh n GLY 58 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qyh s ILE 59 N -3.30 2.46 -0.16 -0.61 1.01 -0.68 -4.99 121.20 114.94 2qyh s ILE 59 Ca 0.21 -0.96 0.16 0.00 0.00 0.00 0.00 60.65 60.06 2qyh s ILE 59 Cb -0.03 -2.14 0.34 0.00 0.01 0.00 0.00 42.46 40.64 2qyh s ILE 59 CO 0.59 0.39 1.18 -0.90 0.00 0.00 0.00 174.94 176.20 2qyh n ASP 60 N 4.64 2.20 -3.89 3.58 5.75 -1.26 -4.73 116.55 122.83 2qyh n ASP 60 Ca -0.19 -3.35 -0.23 0.00 -0.01 0.00 0.00 54.79 51.01 2qyh n ASP 60 Cb 0.49 -0.47 -0.17 0.00 -1.03 0.00 0.00 41.12 39.94 2qyh n ASP 60 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 2qyh s SER 61 N -2.96 1.49 0.06 -1.12 0.01 -1.26 -1.19 113.70 108.73 2qyh s SER 61 Ca 0.34 -0.19 -0.26 0.00 1.31 0.00 0.00 55.95 57.15 2qyh s SER 61 Cb 0.31 -0.60 0.08 0.00 0.21 0.00 0.00 66.02 66.03 2qyh s SER 61 CO 0.00 -0.08 0.72 0.72 0.41 0.00 0.00 173.24 175.01 2qyh s PHE 62 N 1.26 -0.49 -0.30 2.43 -0.71 0.07 -2.61 117.98 117.64 2qyh s PHE 62 Ca -0.05 0.43 -0.05 0.00 -1.04 0.00 0.00 56.93 56.22 2qyh s PHE 62 Cb -0.14 0.52 0.02 0.00 -1.21 0.00 0.00 43.02 42.22 2qyh s PHE 62 CO -0.02 -0.69 0.05 0.08 -1.34 0.00 0.00 175.22 173.30 2qyh s VAL 63 N -3.02 3.64 0.40 -2.49 1.01 0.26 -0.96 120.40 119.24 2qyh s VAL 63 Ca 0.00 -0.91 0.07 0.00 0.00 0.00 0.00 61.98 61.15 2qyh s VAL 63 Cb -0.01 -2.93 -0.07 0.00 0.00 0.00 0.00 36.38 33.37 2qyh s VAL 63 CO -0.08 0.03 0.03 -0.94 0.00 0.00 0.00 175.10 174.14 2qyh s SER 64 N 1.43 3.98 -1.50 3.32 1.04 0.27 0.26 113.70 122.49 2qyh s SER 64 Ca 0.01 -1.27 -0.12 0.00 0.48 0.00 0.00 55.95 55.04 2qyh s SER 64 Cb -0.18 -0.42 0.07 0.00 0.10 0.00 0.00 66.02 65.60 2qyh s SER 64 CO 0.01 -0.42 0.98 0.49 0.98 0.00 0.00 173.24 175.28 2qyh n PHE 65 N -0.99 -2.33 -3.77 5.02 3.72 -0.66 -1.47 117.46 116.98 2qyh n PHE 65 Ca -0.04 0.91 -0.29 0.00 -0.05 0.00 0.00 57.45 57.98 2qyh n PHE 65 Cb 0.66 -4.11 0.01 0.00 -0.94 0.00 0.00 39.48 35.10 2qyh n PHE 65 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2qyh n ASN 66 N -2.87 -4.27 0.00 4.37 3.02 -0.74 -1.59 115.26 113.18 2qyh n ASN 66 Ca 0.01 -0.68 0.00 0.00 -0.03 0.00 0.00 54.58 53.88 2qyh n ASN 66 Cb 0.54 -3.46 0.00 0.00 -0.61 0.00 0.00 39.78 36.25 2qyh n ASN 66 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qyh n GLY 67 N -1.46 0.22 0.00 7.41 0.00 -0.54 -2.29 105.19 108.53 2qyh n GLY 67 Ca 0.03 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.19 2qyh n GLY 67 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qyh n GLN 68 N -2.00 0.23 -3.40 1.61 1.13 -0.62 -4.56 117.38 109.76 2qyh n GLN 68 Ca 0.00 -0.00 -0.13 0.00 -1.94 0.00 0.00 57.00 54.92 2qyh n GLN 68 Cb 0.00 -1.50 -0.10 0.00 0.11 0.00 0.00 30.24 28.75 2qyh n GLN 68 CO 0.00 0.00 0.00 -0.47 -1.44 0.00 0.00 177.06 175.15 2qyh s TYR 69 N -2.77 -0.59 -0.11 1.08 5.04 -0.91 -0.59 117.35 118.50 2qyh s TYR 69 Ca 0.22 0.45 0.03 0.00 -2.44 0.00 0.00 57.07 55.32 2qyh s TYR 69 Cb 0.20 -0.19 -0.00 0.00 0.35 0.00 0.00 41.96 42.31 2qyh s TYR 69 CO 0.50 -0.72 -0.20 0.08 -1.34 0.00 0.00 175.55 173.86 2qyh s VAL 70 N 2.44 2.37 -0.13 3.14 1.01 0.55 -0.56 120.40 129.22 2qyh s VAL 70 Ca 0.10 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.20 2qyh s VAL 70 Cb -0.15 -1.94 0.00 0.00 0.00 0.00 0.00 36.38 34.29 2qyh s VAL 70 CO -0.18 0.55 -0.21 -0.69 0.00 0.00 0.00 175.10 174.57 2qyh s VAL 71 N 0.37 2.19 -0.27 2.92 1.01 -0.14 0.08 120.40 126.57 2qyh s VAL 71 Ca -0.16 -0.95 -0.05 0.00 0.00 0.00 0.00 61.98 60.82 2qyh s VAL 71 Cb -0.17 -1.87 0.01 0.00 0.00 0.00 0.00 36.38 34.34 2qyh s VAL 71 CO 0.07 0.55 0.02 0.12 0.00 0.00 0.00 175.10 175.86 2qyh s PHE 72 N 0.66 3.09 -1.38 5.22 5.36 0.18 -0.75 117.98 130.36 2qyh s PHE 72 Ca -0.10 -1.07 -0.13 0.00 -0.96 0.00 0.00 56.93 54.66 2qyh s PHE 72 Cb -0.16 -2.18 0.01 0.00 -0.34 0.00 0.00 43.02 40.36 2qyh s PHE 72 CO 0.02 -0.59 0.36 0.39 -1.46 0.00 0.00 175.22 173.94 2qyh n GLU 73 N 4.81 -1.16 -0.19 10.12 1.02 -0.87 -1.05 120.64 133.32 2qyh n GLU 73 Ca -0.16 0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 2qyh n GLU 73 Cb 0.48 -3.46 0.00 0.00 -0.02 0.00 0.00 31.44 28.45 2qyh n GLU 73 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qyh n GLY 74 N -2.25 1.62 3.46 0.62 0.00 -0.33 -5.01 105.19 103.30 2qyh n GLY 74 Ca -0.24 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.50 2qyh n GLY 74 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qyh s ASN 75 N -3.22 3.66 -0.30 1.61 0.01 -0.22 -5.08 114.94 111.40 2qyh s ASN 75 Ca 0.00 -0.71 -0.29 0.00 -0.71 0.00 0.00 52.86 51.15 2qyh s ASN 75 Cb 0.00 -0.40 0.00 0.00 0.41 0.00 0.00 41.25 41.27 2qyh s ASN 75 CO 0.00 0.15 1.24 -0.69 -1.51 0.00 0.00 177.10 176.29 2qyh s VAL 76 N -1.37 4.25 -0.11 1.60 1.01 -1.26 0.51 120.40 125.03 2qyh s VAL 76 Ca 0.19 1.42 -0.15 0.00 0.00 0.00 0.00 61.98 63.44 2qyh s VAL 76 Cb -0.09 -4.22 -0.27 0.00 0.00 0.00 0.00 36.38 31.80 2qyh s VAL 76 CO 0.10 -0.46 0.52 0.25 0.00 0.00 0.00 175.10 175.51 2qyh h LEU 77 N 10.59 0.37 -7.44 3.92 5.85 -0.69 -3.46 115.31 124.45 2qyh h LEU 77 Ca -0.25 -0.85 -0.13 0.00 0.84 0.00 0.00 57.88 57.50 2qyh h LEU 77 Cb 1.09 -0.12 -0.22 0.00 0.37 0.00 0.00 40.66 41.77 2qyh h LEU 77 CO 1.03 1.64 -0.29 -0.47 -0.34 0.00 0.00 178.44 180.02 2qyh s TYR 78 N -2.48 -0.28 -0.17 1.25 6.14 -0.91 -5.00 117.35 115.90 2qyh s TYR 78 Ca -0.20 0.60 -0.09 0.00 0.64 0.00 0.00 57.07 58.03 2qyh s TYR 78 Cb 0.05 0.12 0.06 0.00 0.42 0.00 0.00 41.96 42.61 2qyh s TYR 78 CO 0.76 -0.29 0.40 -1.59 0.64 0.00 0.00 175.55 175.47 2qyh s LYS 79 N -0.58 0.36 -0.41 4.97 -2.85 -1.26 -0.33 119.74 119.65 2qyh s LYS 79 Ca -0.07 0.81 0.01 0.00 -1.00 0.00 0.00 55.97 55.72 2qyh s LYS 79 Cb -0.04 0.02 0.14 0.00 -2.06 0.00 0.00 37.83 35.89 2qyh s LYS 79 CO 0.02 -0.18 0.24 -1.14 0.10 0.00 0.00 175.35 174.40 2qyh s GLN 80 N 1.60 1.01 0.71 1.78 2.00 0.24 -5.01 119.66 122.00 2qyh s GLN 80 Ca -0.08 -1.78 -0.11 0.00 -2.00 0.00 0.00 55.36 51.38 2qyh s GLN 80 Cb -0.09 -1.91 0.02 0.00 0.80 0.00 0.00 33.01 31.82 2qyh s GLN 80 CO -0.12 -1.20 1.08 -1.25 -0.50 0.00 0.00 175.29 173.30 2qyh s PRO 81 N 0.57 2.84 0.73 1.67 0.04 -1.26 -4.84 135.00 134.74 2qyh s PRO 81 Ca 0.19 0.58 -0.15 0.00 0.04 0.00 0.00 61.00 61.66 2qyh s PRO 81 Cb -0.22 -2.01 0.04 0.00 0.04 0.00 0.00 34.50 32.35 2qyh s PRO 81 CO -0.01 -1.08 1.19 -0.51 0.04 0.00 0.00 177.00 176.63 2qyh s LEU 82 N -5.43 3.31 0.07 -3.56 1.02 -0.29 -4.92 118.68 108.88 2qyh s LEU 82 Ca 0.58 2.30 -0.31 0.00 0.02 0.00 0.00 54.13 56.73 2qyh s LEU 82 Cb -0.12 -4.58 -0.07 0.00 0.02 0.00 0.00 46.19 41.43 2qyh s LEU 82 CO 0.53 -2.20 1.47 -0.13 0.02 0.00 0.00 176.35 176.04 2qyh s ARG 83 N -3.95 4.27 0.18 1.70 0.52 -1.26 -4.75 118.95 115.66 2qyh s ARG 83 Ca 0.73 2.12 -0.21 0.00 -0.52 0.00 0.00 55.73 57.85 2qyh s ARG 83 Cb -0.28 -3.43 0.11 0.00 0.52 0.00 0.00 34.95 31.87 2qyh s ARG 83 CO 0.45 -0.57 1.60 -0.09 0.02 0.00 0.00 175.30 176.71 2qyh h ARG 84 N 7.50 -0.17 -0.56 3.54 2.43 -1.95 -1.15 114.38 124.02 2qyh h ARG 84 Ca -0.41 0.01 0.11 0.00 -0.81 0.00 0.00 59.98 58.88 2qyh h ARG 84 Cb 1.20 0.04 -0.11 0.00 -0.42 0.00 0.00 29.97 30.67 2qyh h ARG 84 CO 0.90 -0.11 -0.27 1.49 -1.51 0.00 0.00 179.97 180.47 2qyh h GLU 85 N -0.18 -0.12 -0.61 0.20 4.81 -1.99 -0.58 114.58 116.11 2qyh h GLU 85 Ca 0.22 0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.39 2qyh h GLU 85 Cb 0.54 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.92 2qyh h GLU 85 CO -0.62 -0.08 0.13 0.87 -0.73 0.00 0.00 179.01 178.57 2qyh h LYS 86 N -0.13 0.96 -0.67 1.92 1.79 -1.65 -1.59 116.57 117.20 2qyh h LYS 86 Ca 0.24 -0.22 -0.05 0.00 -2.18 0.00 0.00 60.65 58.45 2qyh h LYS 86 Cb 0.52 -0.13 -0.03 0.00 -1.58 0.00 0.00 32.23 31.01 2qyh h LYS 86 CO -0.64 0.86 0.21 0.28 -1.08 0.00 0.00 179.45 179.09 2qyh h VAL 87 N 0.91 1.25 0.34 0.50 2.07 -0.20 -1.28 116.25 119.84 2qyh h VAL 87 Ca 0.19 -0.85 -0.01 0.00 0.82 0.00 0.00 66.70 66.84 2qyh h VAL 87 Cb 0.35 0.55 -0.00 0.00 -1.52 0.00 0.00 31.29 30.66 2qyh h VAL 87 CO 0.00 0.33 -0.19 -0.09 0.02 0.00 0.00 177.57 177.64 2qyh h ARG 88 N 0.97 -0.49 -0.84 1.57 2.43 -0.78 -0.18 114.38 117.06 2qyh h ARG 88 Ca 0.22 0.03 0.13 0.00 -0.81 0.00 0.00 59.98 59.54 2qyh h ARG 88 Cb 0.29 0.11 -0.09 0.00 -0.42 0.00 0.00 29.97 29.86 2qyh h ARG 88 CO -0.01 -0.32 0.45 0.00 -1.51 0.00 0.00 179.97 178.58 2qyh h ALA 89 N 0.14 1.24 -0.47 2.80 0.00 -1.12 0.88 119.26 122.73 2qyh h ALA 89 Ca -0.04 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 2qyh h ALA 89 Cb 0.41 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2qyh h ALA 89 CO 0.05 -0.01 0.04 1.25 0.00 0.00 0.00 179.25 180.58 2qyh h LEU 90 N 0.69 0.78 0.43 0.00 5.85 -0.94 0.59 115.31 122.71 2qyh h LEU 90 Ca 0.44 -0.28 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 2qyh h LEU 90 Cb 0.54 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 2qyh h LEU 90 CO -0.32 0.87 -0.29 0.74 -0.34 0.00 0.00 178.44 179.11 2qyh h THR 91 N 0.67 0.41 -0.80 1.05 2.02 0.46 0.31 112.91 117.02 2qyh h THR 91 Ca 0.14 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.36 2qyh h THR 91 Cb 0.44 0.41 -0.05 0.00 -1.74 0.00 0.00 68.15 67.21 2qyh h THR 91 CO 0.02 0.00 0.51 -0.33 0.37 0.00 0.00 175.52 176.08 2qyh h GLU 92 N -0.69 0.95 -0.44 6.66 5.08 -0.81 0.33 114.58 125.66 2qyh h GLU 92 Ca -0.04 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.16 2qyh h GLU 92 Cb 0.58 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 2qyh h GLU 92 CO 0.03 0.63 -0.11 1.49 -1.00 0.00 0.00 179.01 180.05 2qyh h GLU 93 N 0.98 0.85 -0.77 2.33 4.81 -0.59 -1.01 114.58 121.18 2qyh h GLU 93 Ca 0.33 -0.33 -0.05 0.00 -0.13 0.00 0.00 59.36 59.17 2qyh h GLU 93 Cb 0.04 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 2qyh h GLU 93 CO -0.12 0.96 0.27 0.00 -0.73 0.00 0.00 179.01 179.39 2qyh h ALA 94 N 0.86 1.00 0.23 2.92 0.00 0.18 -2.63 119.26 121.82 2qyh h ALA 94 Ca 0.11 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2qyh h ALA 94 Cb 0.65 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2qyh h ALA 94 CO 0.04 0.67 -0.16 1.25 0.00 0.00 0.00 179.25 181.05 2qyh h HIS 95 N 1.13 -0.41 -1.03 0.00 -0.00 -0.08 0.79 115.15 115.56 2qyh h HIS 95 Ca 0.25 -0.00 0.27 0.00 -0.00 0.00 0.00 60.37 60.89 2qyh h HIS 95 Cb 0.27 0.15 -0.11 0.00 -0.00 0.00 0.00 27.41 27.72 2qyh h HIS 95 CO 0.02 -0.24 0.64 -0.22 -0.00 0.00 0.00 177.93 178.13 2qyh h LYS 96 N -0.38 0.45 -0.01 5.26 3.64 -0.94 0.39 116.57 124.99 2qyh h LYS 96 Ca -0.02 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2qyh h LYS 96 Cb 0.33 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 2qyh h LYS 96 CO 0.01 0.30 -0.12 0.09 -2.27 0.00 0.00 179.45 177.45 2qyh n ASN 97 N -4.78 0.97 -0.20 4.20 3.02 -0.83 -4.92 115.26 112.72 2qyh n ASN 97 Ca 0.27 -1.01 -0.03 0.00 -0.03 0.00 0.00 54.58 53.78 2qyh n ASN 97 Cb 0.85 0.03 -0.01 0.00 -0.61 0.00 0.00 39.78 40.04 2qyh n ASN 97 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qyh n GLY 98 N 1.25 0.59 3.66 7.41 0.00 0.14 -5.01 105.19 113.23 2qyh n GLY 98 Ca 0.16 -0.55 -0.39 0.00 0.00 0.00 0.00 46.02 45.24 2qyh n GLY 98 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qyh s HIS 99 N -2.02 3.36 0.70 1.61 3.76 0.16 -5.00 115.29 117.85 2qyh s HIS 99 Ca 0.00 0.66 -0.11 0.00 -0.15 0.00 0.00 55.06 55.46 2qyh s HIS 99 Cb 0.00 -2.59 0.01 0.00 1.11 0.00 0.00 32.58 31.11 2qyh s HIS 99 CO 0.00 -0.06 1.08 -1.25 -0.85 0.00 0.00 174.74 173.66 2qyh s PRO 100 N 1.51 2.95 0.12 8.40 0.04 -1.26 -4.02 135.00 142.74 2qyh s PRO 100 Ca 0.21 0.56 0.04 0.00 0.04 0.00 0.00 61.00 61.85 2qyh s PRO 100 Cb -0.15 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 2qyh s PRO 100 CO 0.09 -0.99 -0.10 -0.51 0.04 0.00 0.00 177.00 175.52 2qyh s LEU 101 N -5.37 2.47 -0.09 -3.56 1.43 -1.26 -1.64 118.68 110.66 2qyh s LEU 101 Ca 0.58 -0.91 0.01 0.00 -1.03 0.00 0.00 54.13 52.78 2qyh s LEU 101 Cb -0.11 -0.32 0.02 0.00 0.03 0.00 0.00 46.19 45.81 2qyh s LEU 101 CO 0.53 -0.30 -0.11 -0.69 0.23 0.00 0.00 176.35 176.00 2qyh s VAL 102 N -2.89 1.14 0.12 -1.59 1.01 -0.54 -0.93 120.40 116.72 2qyh s VAL 102 Ca 0.11 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 61.66 2qyh s VAL 102 Cb -0.00 -1.07 0.02 0.00 0.00 0.00 0.00 36.38 35.33 2qyh s VAL 102 CO -0.00 0.37 0.17 0.49 0.00 0.00 0.00 175.10 176.13 2qyh n PHE 103 N 4.21 -3.02 -3.02 5.22 3.72 0.18 -1.39 117.46 123.37 2qyh n PHE 103 Ca -0.19 -0.39 0.00 0.00 -0.05 0.00 0.00 57.45 56.82 2qyh n PHE 103 Cb 0.51 -0.12 0.00 0.00 -0.94 0.00 0.00 39.48 38.93 2qyh n PHE 103 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2qyh n ASP 105 N -2.91 0.00 0.12 4.37 5.68 -0.72 -0.90 116.55 122.20 2qyh n ASP 105 Ca 0.03 -0.43 0.12 0.00 -0.50 0.00 0.00 54.79 54.01 2qyh n ASP 105 Cb 0.12 0.00 0.46 0.00 -1.14 0.00 0.00 41.12 40.55 2qyh n ASP 105 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2qyh n ALA 106 N -3.00 1.92 -0.03 2.12 0.00 -1.26 -4.04 120.51 116.22 2qyh n ALA 106 Ca 0.00 0.04 -0.02 0.00 0.00 0.00 0.00 53.44 53.46 2qyh n ALA 106 Cb 0.00 -1.43 -0.07 0.00 0.00 0.00 0.00 19.45 17.96 2qyh n ALA 106 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2qyh n GLU 107 N -2.28 2.12 0.00 0.00 1.02 -1.26 -3.37 120.64 116.88 2qyh n GLU 107 Ca 0.04 -0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 2qyh n GLU 107 Cb 0.32 -1.21 0.00 0.00 -0.02 0.00 0.00 31.44 30.52 2qyh n GLU 107 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 2qyh n LYS 108 N -2.20 0.00 -3.64 3.49 2.85 -1.26 -4.71 118.16 112.68 2qyh n LYS 108 Ca -0.11 0.00 -0.03 0.00 -1.05 0.00 0.00 58.31 57.12 2qyh n LYS 108 Cb 0.66 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 34.98 2qyh n LYS 108 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 2qyh s ARG 110 N 4.57 0.08 0.10 -1.58 1.81 -0.07 -1.75 118.95 122.10 2qyh s ARG 110 Ca 0.00 0.05 -0.04 0.00 -1.72 0.00 0.00 55.73 54.02 2qyh s ARG 110 Cb 0.00 0.04 -0.05 0.00 -0.45 0.00 0.00 34.95 34.49 2qyh s ARG 110 CO 0.00 -0.02 0.33 0.00 -0.68 0.00 0.00 175.30 174.93 2qyh s ALA 111 N -0.48 3.84 -0.70 2.13 0.00 -0.44 0.51 121.76 126.62 2qyh s ALA 111 Ca 0.08 -0.61 0.25 0.00 0.00 0.00 0.00 51.96 51.68 2qyh s ALA 111 Cb -0.03 -2.07 0.54 0.00 0.00 0.00 0.00 23.12 21.56 2qyh s ALA 111 CO -0.11 0.69 1.49 -1.13 0.00 0.00 0.00 175.76 176.70 2qyh n SER 112 N 0.33 0.70 -3.76 0.00 3.41 -0.10 0.14 113.62 114.34 2qyh n SER 112 Ca -0.04 0.26 -0.16 0.00 -0.26 0.00 0.00 58.87 58.67 2qyh n SER 112 Cb 0.52 -0.17 -0.16 0.00 -0.26 0.00 0.00 64.21 64.14 2qyh n SER 112 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2qyh s ILE 113 N -3.13 -0.07 0.52 -1.33 1.01 -1.26 -4.41 121.20 112.53 2qyh s ILE 113 Ca 0.08 0.24 -0.06 0.00 0.00 0.00 0.00 60.65 60.91 2qyh s ILE 113 Cb 0.13 -0.10 -0.03 0.00 0.01 0.00 0.00 42.46 42.47 2qyh s ILE 113 CO 0.67 0.10 0.85 -0.83 0.00 0.00 0.00 174.94 175.73 2qyh s GLY 114 N 1.23 1.54 -1.43 6.18 0.00 -1.26 -4.39 107.32 109.19 2qyh s GLY 114 Ca -0.07 -0.45 -0.09 0.00 0.00 0.00 0.00 44.72 44.11 2qyh s GLY 114 CO -0.03 -0.25 0.27 1.34 0.00 0.00 0.00 173.10 174.43 2qyh n ASP 115 N -2.40 -0.75 -4.66 1.64 2.03 -1.26 -4.94 116.55 106.21 2qyh n ASP 115 Ca 0.02 -1.22 -0.35 0.00 0.52 0.00 0.00 54.79 53.76 2qyh n ASP 115 Cb 0.55 -1.98 -0.09 0.00 -0.72 0.00 0.00 41.12 38.88 2qyh n ASP 115 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 2qyh s HIS 116 N -4.07 3.30 0.27 -0.67 2.46 -1.26 -5.02 115.29 110.30 2qyh s HIS 116 Ca 0.14 0.15 -0.01 0.00 0.47 0.00 0.00 55.06 55.81 2qyh s HIS 116 Cb -0.07 -2.12 0.58 0.00 -0.13 0.00 0.00 32.58 30.84 2qyh s HIS 116 CO 0.97 0.18 1.69 -1.35 -2.47 0.00 0.00 174.74 173.76 2qyh h PRO 117 N 6.77 0.34 -0.46 2.88 0.11 -1.98 -0.82 132.00 138.84 2qyh h PRO 117 Ca -0.38 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 65.59 2qyh h PRO 117 Cb 1.16 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 2qyh h PRO 117 CO 0.72 0.22 -0.19 0.45 -0.21 0.00 0.00 178.00 178.99 2qyh h HIS 118 N 0.35 1.04 -0.22 0.65 3.86 -1.95 -2.38 115.15 116.49 2qyh h HIS 118 Ca 0.48 -0.24 -0.04 0.00 -1.16 0.00 0.00 60.37 59.42 2qyh h HIS 118 Cb 0.85 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 29.06 2qyh h HIS 118 CO -0.20 1.02 -0.00 0.82 0.86 0.00 0.00 177.93 180.43 2qyh h ILE 119 N 0.80 1.25 0.08 2.45 2.04 -1.67 -2.35 117.51 120.12 2qyh h ILE 119 Ca 0.11 -0.88 0.01 0.00 1.00 0.00 0.00 64.86 65.09 2qyh h ILE 119 Cb 0.74 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 38.20 2qyh h ILE 119 CO 0.06 0.27 -0.29 0.45 0.00 0.00 0.00 178.15 178.65 2qyh h HIS 120 N 0.16 -0.83 -0.03 1.37 3.86 -1.05 -3.22 115.15 115.42 2qyh h HIS 120 Ca 0.06 0.02 0.04 0.00 -1.16 0.00 0.00 60.37 59.33 2qyh h HIS 120 Cb 0.40 0.35 -0.05 0.00 1.06 0.00 0.00 27.41 29.17 2qyh h HIS 120 CO 0.03 -0.33 -0.29 0.28 0.86 0.00 0.00 177.93 178.48 2qyh h VAL 121 N -0.42 0.34 0.00 2.45 2.07 -1.50 0.97 116.25 120.17 2qyh h VAL 121 Ca -0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.51 2qyh h VAL 121 Cb 0.41 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 2qyh h VAL 121 CO -0.15 0.00 0.00 -1.54 0.02 0.00 0.00 177.57 175.90 2qyh n SER 122 N -5.40 0.48 0.00 0.57 3.41 -0.88 -1.88 113.62 109.92 2qyh n SER 122 Ca -0.04 -0.48 0.00 0.00 -0.26 0.00 0.00 58.87 58.08 2qyh n SER 122 Cb 0.31 -0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 2qyh n SER 122 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qyh n ALA 124 N 0.63 0.00 0.24 7.33 0.00 0.34 -2.84 120.51 126.20 2qyh n ALA 124 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 2qyh n ALA 124 Cb 0.09 0.00 0.61 0.00 0.00 0.00 0.00 19.45 20.15 2qyh n ALA 124 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2qyh h SER 125 N 0.00 0.00 0.12 0.00 4.64 -1.62 0.19 113.55 116.88 2qyh h SER 125 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qyh h SER 125 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2qyh h SER 125 CO 0.00 0.17 -0.15 0.18 -0.87 0.00 0.00 176.83 176.16 2qyh n LEU 126 N -3.53 1.32 -1.33 5.97 4.32 -1.13 -4.92 117.00 117.69 2qyh n LEU 126 Ca -0.01 -0.40 -0.09 0.00 -0.02 0.00 0.00 56.01 55.49 2qyh n LEU 126 Cb 0.32 -0.06 0.01 0.00 -1.62 0.00 0.00 43.42 42.07 2qyh n LEU 126 CO 0.31 0.23 -0.02 0.29 -1.22 0.00 0.00 177.39 176.98 2qyh n LYS 127 N -0.22 -1.79 -4.66 3.23 4.76 0.65 -5.04 118.16 115.09 2qyh n LYS 127 Ca 0.15 0.40 -0.28 0.00 -2.87 0.00 0.00 58.31 55.71 2qyh n LYS 127 Cb 0.36 -4.22 -0.14 0.00 -1.84 0.00 0.00 35.03 29.19 2qyh n LYS 127 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2qyh s PHE 128 N -2.72 2.12 0.77 2.13 0.40 -1.26 -4.98 117.98 114.43 2qyh s PHE 128 Ca 0.10 -0.40 -0.12 0.00 -0.60 0.00 0.00 56.93 55.92 2qyh s PHE 128 Cb -0.04 -1.23 0.05 0.00 0.51 0.00 0.00 43.02 42.31 2qyh s PHE 128 CO 0.13 0.17 1.12 0.00 0.70 0.00 0.00 175.22 177.34 2qyh s ALA 129 N -0.89 2.63 0.09 5.36 0.00 -1.26 -3.05 121.76 124.65 2qyh s ALA 129 Ca 0.10 -0.43 -0.31 0.00 0.00 0.00 0.00 51.96 51.33 2qyh s ALA 129 Cb -0.10 -3.02 -0.09 0.00 0.00 0.00 0.00 23.12 19.92 2qyh s ALA 129 CO 0.03 -1.48 1.66 -1.58 0.00 0.00 0.00 175.76 174.39 2qyh s HIS 130 N -3.39 2.50 0.70 0.00 2.46 -1.26 -4.91 115.29 111.39 2qyh s HIS 130 Ca 0.60 0.32 -0.17 0.00 0.47 0.00 0.00 55.06 56.29 2qyh s HIS 130 Cb -0.12 -3.99 0.02 0.00 -0.13 0.00 0.00 32.58 28.36 2qyh s HIS 130 CO 0.51 -3.93 1.26 -2.14 -2.47 0.00 0.00 174.74 167.98 2qyh s PRO 131 N 2.39 2.27 0.63 2.88 0.02 -1.26 -4.92 135.00 137.00 2qyh s PRO 131 Ca 0.74 1.96 -0.18 0.00 0.02 0.00 0.00 61.00 63.54 2qyh s PRO 131 Cb -0.41 -1.82 -0.02 0.00 0.02 0.00 0.00 34.50 32.26 2qyh s PRO 131 CO 0.33 -1.79 1.27 -2.30 -0.33 0.00 0.00 177.00 174.18 2qyh n PRO 132 N -2.35 1.15 -2.96 5.54 -0.02 -1.26 -4.40 135.00 130.71 2qyh n PRO 132 Ca 0.15 0.45 -0.40 0.00 -2.02 0.00 0.00 63.50 61.68 2qyh n PRO 132 Cb 0.49 -2.50 -0.06 0.00 -0.02 0.00 0.00 33.50 31.41 2qyh n PRO 132 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2qyh s VAL 133 N -1.38 4.51 -0.43 -1.45 0.11 -1.26 -1.33 120.40 119.16 2qyh s VAL 133 Ca 0.81 1.71 0.01 0.00 -2.93 0.00 0.00 61.98 61.58 2qyh s VAL 133 Cb -0.39 -4.15 0.20 0.00 -1.53 0.00 0.00 36.38 30.51 2qyh s VAL 133 CO 0.42 0.45 0.88 -0.62 -3.33 0.00 0.00 175.10 172.90 2qyh s ASP 134 N -0.66 -0.95 0.60 3.54 -1.08 0.12 -4.85 116.67 113.40 2qyh s ASP 134 Ca 0.38 -1.03 0.29 0.00 -0.52 0.00 0.00 52.55 51.66 2qyh s ASP 134 Cb -0.22 1.24 1.56 0.00 -1.46 0.00 0.00 42.92 44.03 2qyh s ASP 134 CO 0.25 -0.04 1.95 -0.65 0.52 0.00 0.00 175.17 177.20 2qyh h PRO 135 N 4.90 0.00 -0.19 4.34 0.11 -1.77 -1.88 132.00 137.51 2qyh h PRO 135 Ca 0.03 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.10 2qyh h PRO 135 Cb 1.15 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 2qyh h PRO 135 CO -0.03 0.00 -0.05 1.28 -0.21 0.00 0.00 178.00 178.99 2qyh n LEU 136 N -3.58 3.45 -0.12 2.35 4.77 -1.26 -4.70 117.00 117.91 2qyh n LEU 136 Ca 0.05 -3.25 0.10 0.00 -0.03 0.00 0.00 56.01 52.87 2qyh n LEU 136 Cb 0.52 -0.53 0.45 0.00 -2.33 0.00 0.00 43.42 41.53 2qyh n LEU 136 CO 0.25 0.85 1.20 0.22 -1.33 0.00 0.00 177.39 178.58 2qyh h TYR 137 N 1.09 0.55 0.00 -1.77 5.03 -1.73 -1.92 116.97 118.23 2qyh h TYR 137 Ca 0.05 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.37 2qyh h TYR 137 Cb 1.34 -0.18 0.00 0.00 1.55 0.00 0.00 36.73 39.44 2qyh h TYR 137 CO 0.49 0.27 0.00 0.10 -1.32 0.00 0.00 178.16 177.70 2qyh h TYR 138 N 0.53 0.00 -0.48 -3.82 -0.00 -1.84 -3.32 116.97 108.04 2qyh h TYR 138 Ca 0.29 0.00 0.05 0.00 -0.00 0.00 0.00 58.73 59.07 2qyh h TYR 138 Cb 0.45 0.00 -0.05 0.00 -0.00 0.00 0.00 36.73 37.13 2qyh h TYR 138 CO -0.00 0.00 0.21 0.93 -0.00 0.00 0.00 178.16 179.30 2qyh h GLU 139 N 0.00 0.41 -0.59 0.10 5.08 -1.72 -3.23 114.58 114.63 2qyh h GLU 139 Ca 0.00 -0.02 -0.42 0.00 -1.00 0.00 0.00 59.36 57.91 2qyh h GLU 139 Cb 0.40 -0.09 -0.39 0.00 0.50 0.00 0.00 28.75 29.17 2qyh h GLU 139 CO 0.00 0.27 -0.86 0.09 -1.00 0.00 0.00 179.01 177.51 2qyh n ASN 140 N -4.94 3.81 -4.03 1.42 4.13 -1.25 -5.04 115.26 109.36 2qyh n ASN 140 Ca 0.04 -3.34 -0.08 0.00 1.68 0.00 0.00 54.58 52.88 2qyh n ASN 140 Cb 0.15 -0.39 -0.10 0.00 -1.54 0.00 0.00 39.78 37.90 2qyh n ASN 140 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2qyh s LYS 141 N -3.51 0.49 -0.64 3.52 -0.14 -1.22 -5.10 119.74 113.14 2qyh s LYS 141 Ca 0.44 -0.95 -0.22 0.00 -1.36 0.00 0.00 55.97 53.88 2qyh s LYS 141 Cb 0.39 0.17 0.07 0.00 -1.68 0.00 0.00 37.83 36.78 2qyh s LYS 141 CO 0.01 -0.09 0.91 -0.51 -0.76 0.00 0.00 175.35 174.91 2qyh s ASP 142 N -2.30 6.19 -0.39 2.83 1.01 -1.26 -4.86 116.67 117.89 2qyh s ASP 142 Ca -0.03 -1.01 -0.21 0.00 0.71 0.00 0.00 52.55 52.00 2qyh s ASP 142 Cb 0.00 -2.40 0.01 0.00 1.01 0.00 0.00 42.92 41.55 2qyh s ASP 142 CO -0.06 -1.36 0.68 -0.63 0.21 0.00 0.00 175.17 174.01 2qyh s ILE 143 N 3.79 4.81 -0.16 0.77 -1.09 -1.26 -4.28 121.20 123.79 2qyh s ILE 143 Ca 0.21 0.50 0.18 0.00 -2.23 0.00 0.00 60.65 59.31 2qyh s ILE 143 Cb -0.18 -4.17 -0.08 0.00 -1.58 0.00 0.00 42.46 36.46 2qyh s ILE 143 CO 0.10 -0.46 0.95 1.88 -1.23 0.00 0.00 174.94 176.18 2qyh h TYR 144 N 8.64 0.00 -3.29 3.97 -1.99 -1.92 -0.76 116.97 121.62 2qyh h TYR 144 Ca -0.26 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.44 2qyh h TYR 144 Cb 1.10 0.00 -0.12 0.00 2.00 0.00 0.00 36.73 39.71 2qyh h TYR 144 CO 0.76 0.42 0.01 -1.14 -0.00 0.00 0.00 178.16 178.21 2qyh s GLN 145 N -3.04 1.20 0.04 4.88 0.74 -1.26 -4.61 119.66 117.62 2qyh s GLN 145 Ca -0.02 -0.71 -0.01 0.00 0.05 0.00 0.00 55.36 54.68 2qyh s GLN 145 Cb 0.09 0.51 -0.03 0.00 1.10 0.00 0.00 33.01 34.67 2qyh s GLN 145 CO 0.80 -0.49 -0.02 0.00 -0.55 0.00 0.00 175.29 175.02 2qyh s ALA 146 N -3.81 0.38 -0.13 1.58 0.00 -1.08 -4.59 121.76 114.09 2qyh s ALA 146 Ca 0.04 -1.02 0.02 0.00 0.00 0.00 0.00 51.96 51.00 2qyh s ALA 146 Cb 0.00 0.24 0.00 0.00 0.00 0.00 0.00 23.12 23.37 2qyh s ALA 146 CO -0.10 -0.32 -0.20 -0.51 0.00 0.00 0.00 175.76 174.64 2qyh s LEU 147 N -2.52 2.24 -0.25 0.00 1.43 -0.48 -0.04 118.68 119.05 2qyh s LEU 147 Ca 0.01 -0.54 -0.08 0.00 -1.03 0.00 0.00 54.13 52.48 2qyh s LEU 147 Cb 0.03 -1.48 -0.04 0.00 0.03 0.00 0.00 46.19 44.74 2qyh s LEU 147 CO -0.08 0.10 0.10 -0.22 0.23 0.00 0.00 176.35 176.49 2qyh s LEU 148 N 0.68 3.63 -0.72 1.79 2.96 -0.27 -1.47 118.68 125.27 2qyh s LEU 148 Ca -0.10 -0.12 -0.15 0.00 -0.22 0.00 0.00 54.13 53.54 2qyh s LEU 148 Cb -0.16 -1.97 0.18 0.00 0.50 0.00 0.00 46.19 44.73 2qyh s LEU 148 CO 0.01 -0.01 0.69 -0.36 -1.32 0.00 0.00 176.35 175.37 2qyh s PHE 149 N 1.48 3.51 0.21 5.38 0.40 -0.65 -1.22 117.98 127.08 2qyh s PHE 149 Ca 0.06 -1.66 -0.21 0.00 -0.60 0.00 0.00 56.93 54.52 2qyh s PHE 149 Cb -0.15 -3.85 0.04 0.00 0.51 0.00 0.00 43.02 39.57 2qyh s PHE 149 CO 0.05 -1.04 0.61 0.00 0.70 0.00 0.00 175.22 175.54 2qyh s ARG 151 N -3.84 3.65 0.27 0.00 0.52 -1.26 -3.64 118.95 114.65 2qyh s ARG 151 Ca 0.06 0.67 -0.01 0.00 -0.52 0.00 0.00 55.73 55.93 2qyh s ARG 151 Cb -0.02 -2.15 0.46 0.00 0.52 0.00 0.00 34.95 33.76 2qyh s ARG 151 CO -0.04 -0.44 1.84 0.00 0.02 0.00 0.00 175.30 176.68 2qyh h ALA 152 N 0.01 1.38 0.00 2.13 0.00 -1.93 0.80 119.26 121.65 2qyh h ALA 152 Ca -0.45 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2qyh h ALA 152 Cb 1.19 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2qyh h ALA 152 CO 0.62 0.24 0.00 0.39 0.00 0.00 0.00 179.25 180.50 2qyh n GLU 153 N -4.63 0.08 -0.00 0.00 4.71 -1.26 -2.26 120.64 117.29 2qyh n GLU 153 Ca 0.16 0.23 0.04 0.00 -0.01 0.00 0.00 57.16 57.58 2qyh n GLU 153 Cb 0.28 -1.50 -0.06 0.00 -1.01 0.00 0.00 31.44 29.16 2qyh n GLU 153 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 2qyh n GLU 154 N -1.28 2.46 0.22 3.49 1.02 0.26 -4.72 120.64 122.10 2qyh n GLU 154 Ca 0.03 -0.04 0.06 0.00 -0.02 0.00 0.00 57.16 57.20 2qyh n GLU 154 Cb 0.04 -1.03 0.51 0.00 -0.02 0.00 0.00 31.44 30.94 2qyh n GLU 154 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 2qyh h GLU 155 N 0.00 0.00 -0.43 3.49 4.11 -1.25 -3.37 114.58 117.13 2qyh h GLU 155 Ca 0.00 0.00 0.04 0.00 0.07 0.00 0.00 59.36 59.47 2qyh h GLU 155 Cb 0.28 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.48 2qyh h GLU 155 CO 0.00 0.23 -0.25 0.39 0.07 0.00 0.00 179.01 179.45 2qyh n GLU 156 N -4.02 -0.19 -0.31 1.06 1.02 -1.26 -0.27 120.64 116.68 2qyh n GLU 156 Ca -0.02 0.74 0.02 0.00 -0.02 0.00 0.00 57.16 57.88 2qyh n GLU 156 Cb 0.31 -1.09 0.16 0.00 -0.02 0.00 0.00 31.44 30.80 2qyh n GLU 156 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2qyh h PRO 157 N 0.00 0.87 0.05 3.49 0.11 -1.97 -0.31 132.00 134.24 2qyh h PRO 157 Ca 0.07 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.12 2qyh h PRO 157 Cb 0.17 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.09 2qyh h PRO 157 CO -0.40 0.57 -0.02 1.88 -0.21 0.00 0.00 178.00 179.82 2qyh h TYR 158 N 0.89 -0.06 -0.21 0.65 0.05 -0.89 0.18 116.97 117.58 2qyh h TYR 158 Ca 0.39 -0.00 0.05 0.00 0.05 0.00 0.00 58.73 59.22 2qyh h TYR 158 Cb 0.28 0.02 -0.04 0.00 1.01 0.00 0.00 36.73 38.00 2qyh h TYR 158 CO -0.04 0.10 -0.08 0.28 -1.05 0.00 0.00 178.16 177.37 2qyh h VAL 159 N -0.22 0.73 -0.53 -2.88 2.07 -0.99 -1.56 116.25 112.87 2qyh h VAL 159 Ca -0.01 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.56 2qyh h VAL 159 Cb 0.20 0.73 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 2qyh h VAL 159 CO 0.01 0.00 0.26 -0.09 0.02 0.00 0.00 177.57 177.77 2qyh h ARG 160 N -0.04 0.49 -0.00 1.57 2.43 -0.83 -3.00 114.38 115.00 2qyh h ARG 160 Ca 0.11 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 2qyh h ARG 160 Cb 0.20 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 2qyh h ARG 160 CO -0.24 0.33 -0.15 0.09 -1.51 0.00 0.00 179.97 178.49 2qyh n ASN 161 N -4.89 0.50 -3.22 -3.80 3.02 0.61 -4.35 115.26 103.14 2qyh n ASN 161 Ca 0.05 -0.49 -0.24 0.00 -0.03 0.00 0.00 54.58 53.87 2qyh n ASN 161 Cb 0.15 -0.06 -0.06 0.00 -0.61 0.00 0.00 39.78 39.20 2qyh n ASN 161 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2qyh n TYR 162 N -1.01 1.11 0.30 3.10 4.01 -0.62 -4.91 117.16 119.14 2qyh n TYR 162 Ca 0.13 -3.80 0.17 0.00 -0.16 0.00 0.00 57.90 54.24 2qyh n TYR 162 Cb 0.29 -0.43 0.93 0.00 -0.31 0.00 0.00 39.34 39.83 2qyh n TYR 162 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2qyh h PRO 163 N 3.73 0.00 0.00 -0.72 0.13 -1.76 0.59 132.00 133.97 2qyh h PRO 163 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 2qyh h PRO 163 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 2qyh h PRO 163 CO 0.59 0.04 0.00 -0.85 -0.23 0.00 0.00 178.00 177.55 2qyh n GLU 164 N -3.46 0.77 -4.40 0.86 0.00 -1.26 -4.76 120.64 108.39 2qyh n GLU 164 Ca -0.02 0.01 -0.24 0.00 0.00 0.00 0.00 57.16 56.90 2qyh n GLU 164 Cb 0.15 -1.50 -0.09 0.00 0.00 0.00 0.00 31.44 30.00 2qyh n GLU 164 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.13 177.07 2qyh s PHE 165 N -2.13 2.43 -0.03 -1.84 0.08 0.20 -1.93 117.98 114.77 2qyh s PHE 165 Ca 0.39 -0.29 0.05 0.00 0.12 0.00 0.00 56.93 57.20 2qyh s PHE 165 Cb 0.19 -1.08 -0.01 0.00 -0.57 0.00 0.00 43.02 41.55 2qyh s PHE 165 CO 0.35 0.67 -0.18 1.03 -0.10 0.00 0.00 175.22 176.98 2qyh s ARG 166 N -3.47 1.64 -0.16 0.44 1.81 0.14 -4.76 118.95 114.58 2qyh s ARG 166 Ca 0.30 -0.65 -0.01 0.00 -1.72 0.00 0.00 55.73 53.65 2qyh s ARG 166 Cb -0.06 -1.51 -0.01 0.00 -0.45 0.00 0.00 34.95 32.92 2qyh s ARG 166 CO 0.16 0.34 -0.12 -0.06 -0.68 0.00 0.00 175.30 174.94 2qyh s PHE 167 N -0.24 2.84 -0.29 -0.53 0.40 -1.26 -0.43 117.98 118.46 2qyh s PHE 167 Ca 0.03 -0.90 0.01 0.00 -0.60 0.00 0.00 56.93 55.47 2qyh s PHE 167 Cb -0.09 -1.93 0.09 0.00 0.51 0.00 0.00 43.02 41.60 2qyh s PHE 167 CO 0.01 -0.41 0.04 0.08 0.70 0.00 0.00 175.22 175.63 2qyh s VAL 168 N 0.84 1.51 0.24 -0.44 1.01 -0.71 -4.95 120.40 117.89 2qyh s VAL 168 Ca -0.04 -1.63 -0.30 0.00 0.00 0.00 0.00 61.98 60.02 2qyh s VAL 168 Cb -0.15 -2.02 -0.09 0.00 0.00 0.00 0.00 36.38 34.12 2qyh s VAL 168 CO 0.00 -0.47 1.36 -0.60 0.00 0.00 0.00 175.10 175.40 2qyh s ARG 169 N 1.33 4.34 0.00 2.72 3.52 -1.26 -1.37 118.95 128.22 2qyh s ARG 169 Ca 0.05 2.18 0.00 0.00 -0.13 0.00 0.00 55.73 57.83 2qyh s ARG 169 Cb -0.18 -3.14 0.00 0.00 -1.56 0.00 0.00 34.95 30.06 2qyh s ARG 169 CO -0.14 -0.31 0.43 -2.67 -0.81 0.00 0.00 175.30 171.80 2qyh n TRP 170 N 2.29 0.00 -3.49 5.12 4.27 -1.06 -4.92 117.44 119.65 2qyh n TRP 170 Ca 0.06 -0.06 -0.12 0.00 -3.89 0.00 0.00 57.50 53.49 2qyh n TRP 170 Cb 0.42 -0.01 -0.03 0.00 -1.36 0.00 0.00 31.31 30.33 2qyh n TRP 170 CO 0.00 0.00 0.00 -1.58 -2.29 0.00 0.00 177.69 173.82 2qyh s HIS 171 N -0.12 -0.48 0.25 -2.67 5.04 -0.95 -4.99 115.29 111.37 2qyh s HIS 171 Ca 0.00 0.48 -0.03 0.00 -1.54 0.00 0.00 55.06 53.97 2qyh s HIS 171 Cb 0.00 0.51 0.50 0.00 0.04 0.00 0.00 32.58 33.63 2qyh s HIS 171 CO 0.00 -0.64 1.71 -0.44 -2.34 0.00 0.00 174.74 173.03 2qyh h ASP 172 N 2.26 0.20 -0.34 9.88 3.45 -1.97 -2.66 116.42 127.24 2qyh h ASP 172 Ca -0.27 0.13 -0.10 0.00 0.43 0.00 0.00 57.03 57.23 2qyh h ASP 172 Cb 1.24 0.13 -0.06 0.00 -0.56 0.00 0.00 39.33 40.08 2qyh h ASP 172 CO 0.35 0.04 0.01 1.33 -1.57 0.00 0.00 179.24 179.40 2qyh n VAL 173 N -5.06 2.44 -3.67 -1.35 0.24 -1.26 -4.18 118.33 105.49 2qyh n VAL 173 Ca 0.16 -2.19 -0.14 0.00 -2.04 0.00 0.00 64.34 60.12 2qyh n VAL 173 Cb 0.47 -0.29 -0.08 0.00 -1.47 0.00 0.00 33.84 32.46 2qyh n VAL 173 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2qyh s SER 174 N -2.11 -0.56 0.01 -1.34 0.15 -1.01 -2.22 113.70 106.63 2qyh s SER 174 Ca 0.44 0.99 0.00 0.00 0.70 0.00 0.00 55.95 58.08 2qyh s SER 174 Cb 0.37 1.00 -0.01 0.00 -1.71 0.00 0.00 66.02 65.67 2qyh s SER 174 CO 0.06 -0.27 -0.02 0.28 1.20 0.00 0.00 173.24 174.48 2qyh s THR 175 N -0.04 0.10 0.20 6.45 -1.32 -0.36 -2.25 115.64 118.43 2qyh s THR 175 Ca -0.03 -0.52 -0.30 0.00 -1.21 0.00 0.00 61.69 59.63 2qyh s THR 175 Cb -0.04 -0.18 -0.08 0.00 -1.51 0.00 0.00 72.50 70.69 2qyh s THR 175 CO 0.02 -0.26 0.95 -1.81 -2.21 0.00 0.00 174.62 171.31 2qyh s ASP 176 N -0.82 7.59 -0.42 8.08 1.01 -0.47 -1.11 116.67 130.53 2qyh s ASP 176 Ca -0.08 1.92 -0.06 0.00 0.71 0.00 0.00 52.55 55.04 2qyh s ASP 176 Cb -0.06 -2.60 0.10 0.00 1.01 0.00 0.00 42.92 41.37 2qyh s ASP 176 CO -0.00 0.08 0.24 -0.69 0.21 0.00 0.00 175.17 175.01 2qyh s VAL 177 N -0.84 3.75 0.23 -1.27 1.01 0.94 -1.74 120.40 122.48 2qyh s VAL 177 Ca 0.43 -1.78 0.08 0.00 0.00 0.00 0.00 61.98 60.71 2qyh s VAL 177 Cb -0.26 -3.44 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 2qyh s VAL 177 CO 0.32 -0.63 0.10 -0.76 0.00 0.00 0.00 175.10 174.13 2qyh s LEU 178 N 1.28 3.56 0.31 3.92 1.43 0.42 -2.65 118.68 126.95 2qyh s LEU 178 Ca 0.05 -0.37 -0.27 0.00 -1.03 0.00 0.00 54.13 52.51 2qyh s LEU 178 Cb -0.24 -2.12 -0.09 0.00 0.03 0.00 0.00 46.19 43.77 2qyh s LEU 178 CO -0.02 0.01 1.01 -2.16 0.23 0.00 0.00 176.35 175.42 2qyh s PRO 179 N -3.56 4.57 0.12 1.29 0.04 -1.26 0.24 135.00 136.45 2qyh s PRO 179 Ca 0.31 1.53 -0.16 0.00 0.04 0.00 0.00 61.00 62.72 2qyh s PRO 179 Cb -0.08 -2.96 -0.02 0.00 0.04 0.00 0.00 34.50 31.48 2qyh s PRO 179 CO 0.22 0.23 1.66 0.00 0.04 0.00 0.00 177.00 179.15 2qyh h ALA 180 N 3.42 0.48 -2.37 8.56 0.00 -1.68 -3.43 119.26 124.23 2qyh h ALA 180 Ca -0.47 -0.15 -0.48 0.00 0.00 0.00 0.00 54.91 53.82 2qyh h ALA 180 Cb 1.20 -0.14 0.07 0.00 0.00 0.00 0.00 17.79 18.92 2qyh h ALA 180 CO 0.66 0.10 0.28 0.20 0.00 0.00 0.00 179.25 180.48 2qyh s GLY 181 N -2.94 1.62 0.00 0.00 0.00 -1.26 -4.99 107.32 99.75 2qyh s GLY 181 Ca -0.13 -0.56 0.00 0.00 0.00 0.00 0.00 44.72 44.03 2qyh s GLY 181 CO 0.75 -0.24 0.00 0.61 0.00 0.00 0.00 173.10 174.22 2qyh n GLY 182 N -2.78 2.19 3.57 0.20 0.00 -1.26 -5.00 105.19 102.10 2qyh n GLY 182 Ca 0.06 -1.85 -0.05 0.00 0.00 0.00 0.00 46.02 44.17 2qyh n GLY 182 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qyh s SER 183 N -0.03 -0.22 0.26 1.61 1.04 -0.97 -5.00 113.70 110.40 2qyh s SER 183 Ca 0.00 -0.03 -0.00 0.00 0.48 0.00 0.00 55.95 56.40 2qyh s SER 183 Cb 0.00 0.26 0.35 0.00 0.10 0.00 0.00 66.02 66.73 2qyh s SER 183 CO 0.00 -0.42 1.72 0.11 0.98 0.00 0.00 173.24 175.63 2qyh h LYS 184 N 2.00 0.64 -0.80 4.02 1.57 -1.87 -1.68 116.57 120.45 2qyh h LYS 184 Ca -0.16 -0.21 -0.04 0.00 -1.87 0.00 0.00 60.65 58.36 2qyh h LYS 184 Cb 1.20 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 33.42 2qyh h LYS 184 CO 0.26 0.76 0.33 0.00 -0.57 0.00 0.00 179.45 180.24 2qyh h ALA 185 N 1.26 1.09 -0.06 3.86 0.00 -1.89 0.54 119.26 124.05 2qyh h ALA 185 Ca 0.10 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 2qyh h ALA 185 Cb 0.60 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2qyh h ALA 185 CO 0.04 0.66 -0.40 1.49 0.00 0.00 0.00 179.25 181.04 2qyh h GLU 186 N 1.15 0.14 -0.17 0.00 4.57 -1.87 0.34 114.58 118.73 2qyh h GLU 186 Ca 0.27 -0.06 -0.11 0.00 -1.18 0.00 0.00 59.36 58.28 2qyh h GLU 186 Cb 0.19 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.78 2qyh h GLU 186 CO -0.03 0.51 -0.31 0.78 -1.18 0.00 0.00 179.01 178.78 2qyh h GLY 187 N 1.21 0.57 0.97 1.92 0.00 -0.20 -3.17 103.07 104.36 2qyh h GLY 187 Ca 0.01 -0.66 -0.06 0.00 0.00 0.00 0.00 47.33 46.62 2qyh h GLY 187 CO 0.06 0.59 0.06 -2.22 0.00 0.00 0.00 176.54 175.03 2qyh h ILE 188 N 0.17 1.25 -0.01 2.60 2.04 0.32 -3.44 117.51 120.43 2qyh h ILE 188 Ca 0.01 -0.93 -0.35 0.00 1.00 0.00 0.00 64.86 64.58 2qyh h ILE 188 Cb 0.90 0.97 0.09 0.00 -0.74 0.00 0.00 36.82 38.04 2qyh h ILE 188 CO 0.07 0.33 1.01 -1.14 0.00 0.00 0.00 178.15 178.41 2qyh n ARG 189 N -4.44 0.01 0.00 2.37 0.63 0.12 -4.57 116.66 110.77 2qyh n ARG 189 Ca 0.00 -0.71 0.00 0.00 -0.92 0.00 0.00 57.85 56.22 2qyh n ARG 189 Cb 0.26 -2.09 0.00 0.00 0.45 0.00 0.00 32.46 31.07 2qyh n ARG 189 CO 0.00 0.00 0.00 0.44 -2.51 0.00 0.00 177.63 175.56 2qyh n ILE 192 N 6.00 0.00 -0.07 5.15 -5.35 -1.26 -4.72 119.36 119.12 2qyh n ILE 192 Ca 0.31 0.00 -0.11 0.00 -0.27 0.00 0.00 62.75 62.67 2qyh n ILE 192 Cb 0.37 0.00 -0.05 0.00 -1.74 0.00 0.00 39.64 38.22 2qyh n ILE 192 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 2qyh h GLU 193 N 0.09 0.35 -0.00 6.28 4.81 -1.81 0.49 114.58 124.80 2qyh h GLU 193 Ca 0.00 -0.11 -0.05 0.00 -0.13 0.00 0.00 59.36 59.07 2qyh h GLU 193 Cb 0.00 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 2qyh h GLU 193 CO 0.00 0.55 -0.25 -0.22 -0.73 0.00 0.00 179.01 178.35 2qyh h LYS 194 N 0.11 0.01 0.00 1.92 1.63 -1.94 -2.43 116.57 115.86 2qyh h LYS 194 Ca 0.06 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.86 2qyh h LYS 194 Cb 0.38 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.01 2qyh h LYS 194 CO 0.01 0.26 -0.62 -0.11 -3.45 0.00 0.00 179.45 175.54 2qyh n LEU 195 N -4.23 0.71 -0.21 5.20 7.94 -1.03 -4.95 117.00 120.42 2qyh n LEU 195 Ca -0.02 0.24 -0.02 0.00 -1.11 0.00 0.00 56.01 55.09 2qyh n LEU 195 Cb 0.31 -0.18 -0.00 0.00 0.53 0.00 0.00 43.42 44.07 2qyh n LEU 195 CO 0.37 -0.06 -0.02 0.61 -1.11 0.00 0.00 177.39 177.18 2qyh n GLY 196 N 1.33 0.40 3.92 -3.96 0.00 0.12 -5.03 105.19 101.97 2qyh n GLY 196 Ca 0.03 -0.88 -0.24 0.00 0.00 0.00 0.00 46.02 44.93 2qyh n GLY 196 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qyh s ILE 197 N -2.10 5.08 -0.00 -0.61 1.01 0.13 -4.86 121.20 119.85 2qyh s ILE 197 Ca 0.00 -0.92 0.03 0.00 0.00 0.00 0.00 60.65 59.76 2qyh s ILE 197 Cb 0.00 -3.68 -0.03 0.00 0.01 0.00 0.00 42.46 38.76 2qyh s ILE 197 CO 0.00 -0.20 -0.07 -0.62 0.00 0.00 0.00 174.94 174.05 2qyh s ASP 198 N -3.52 4.61 0.24 3.58 -1.08 -1.26 -4.42 116.67 114.82 2qyh s ASP 198 Ca 0.34 -0.14 0.00 0.00 -0.52 0.00 0.00 52.55 52.23 2qyh s ASP 198 Cb -0.10 -1.08 0.56 0.00 -1.46 0.00 0.00 42.92 40.84 2qyh s ASP 198 CO 0.27 0.29 1.22 0.29 0.52 0.00 0.00 175.17 177.77 2qyh n LYS 199 N 1.63 -0.06 0.08 4.34 5.02 -1.26 0.68 118.16 128.59 2qyh n LYS 199 Ca -0.16 1.17 0.14 0.00 -2.02 0.00 0.00 58.31 57.45 2qyh n LYS 199 Cb 0.53 -1.85 0.64 0.00 -0.02 0.00 0.00 35.03 34.33 2qyh n LYS 199 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 2qyh h LYS 200 N 0.00 0.07 -0.34 1.97 2.10 -1.94 -0.93 116.57 117.50 2qyh h LYS 200 Ca 0.46 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.10 2qyh h LYS 200 Cb 0.92 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.23 2qyh h LYS 200 CO -0.74 0.04 0.00 -0.25 -2.00 0.00 0.00 179.45 176.50 2qyh n ASP 201 N -4.45 2.19 -4.79 7.07 10.43 0.21 -4.62 116.55 122.59 2qyh n ASP 201 Ca 0.05 -1.90 -0.36 0.00 2.57 0.00 0.00 54.79 55.15 2qyh n ASP 201 Cb 0.38 -0.22 -0.07 0.00 1.84 0.00 0.00 41.12 43.04 2qyh n ASP 201 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2qyh s VAL 202 N -1.55 5.14 0.24 2.53 1.01 -0.51 -2.23 120.40 125.03 2qyh s VAL 202 Ca 0.31 0.08 0.11 0.00 0.00 0.00 0.00 61.98 62.47 2qyh s VAL 202 Cb 0.16 -3.25 -0.05 0.00 0.00 0.00 0.00 36.38 33.25 2qyh s VAL 202 CO 0.23 0.58 -0.20 -0.31 0.00 0.00 0.00 175.10 175.40 2qyh s TYR 203 N -0.67 2.15 -0.22 5.22 2.02 -0.26 -1.58 117.35 124.00 2qyh s TYR 203 Ca 0.12 -0.39 -0.19 0.00 -0.37 0.00 0.00 57.07 56.25 2qyh s TYR 203 Cb -0.12 -0.98 0.06 0.00 -0.40 0.00 0.00 41.96 40.52 2qyh s TYR 203 CO 0.02 0.57 0.58 0.00 -1.57 0.00 0.00 175.55 175.16 2qyh s ALA 204 N -2.35 -1.46 -0.10 3.71 0.00 -0.65 -1.14 121.76 119.78 2qyh s ALA 204 Ca 0.25 1.74 0.02 0.00 0.00 0.00 0.00 51.96 53.97 2qyh s ALA 204 Cb -0.05 -1.02 -0.02 0.00 0.00 0.00 0.00 23.12 22.04 2qyh s ALA 204 CO 0.12 -0.29 -0.16 -0.06 0.00 0.00 0.00 175.76 175.37 2qyh s PHE 205 N 0.60 2.72 0.20 0.00 0.08 -0.47 0.12 117.98 121.23 2qyh s PHE 205 Ca -0.02 -0.57 -0.09 0.00 0.12 0.00 0.00 56.93 56.37 2qyh s PHE 205 Cb -0.05 -1.75 -0.01 0.00 -0.57 0.00 0.00 43.02 40.64 2qyh s PHE 205 CO -0.03 -0.13 0.32 0.20 -0.10 0.00 0.00 175.22 175.47 2qyh s GLY 206 N 0.02 0.68 0.00 4.36 0.00 -0.73 -2.38 107.32 109.26 2qyh s GLY 206 Ca -0.05 -1.03 0.00 0.00 0.00 0.00 0.00 44.72 43.63 2qyh s GLY 206 CO 0.05 -0.87 0.00 1.34 0.00 0.00 0.00 173.10 173.62 2qyh n ASP 207 N -0.28 1.94 -4.83 1.64 2.03 -1.26 -4.46 116.55 111.32 2qyh n ASP 207 Ca -0.04 0.00 -0.22 0.00 0.52 0.00 0.00 54.79 55.06 2qyh n ASP 207 Cb 0.63 0.23 -0.04 0.00 -0.72 0.00 0.00 41.12 41.22 2qyh n ASP 207 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2qyh s GLY 208 N -1.59 2.01 0.43 0.27 0.00 -1.26 -3.68 107.32 103.49 2qyh s GLY 208 Ca 0.00 -1.82 0.24 0.00 0.00 0.00 0.00 44.72 43.14 2qyh s GLY 208 CO 0.00 -1.69 1.73 1.41 0.00 0.00 0.00 173.10 174.55 2qyh h LEU 209 N 1.23 0.33 -0.86 0.66 4.07 -1.98 0.55 115.31 119.30 2qyh h LEU 209 Ca -0.43 0.09 0.00 0.00 0.08 0.00 0.00 57.88 57.62 2qyh h LEU 209 Cb 1.26 0.04 0.00 0.00 1.08 0.00 0.00 40.66 43.04 2qyh h LEU 209 CO 0.60 -0.00 0.00 -3.20 -1.08 0.00 0.00 178.44 174.76 2qyh n ASN 210 N -4.58 0.58 -0.36 -0.43 5.15 -1.26 -2.53 115.26 111.82 2qyh n ASN 210 Ca 0.29 0.68 0.12 0.00 -0.60 0.00 0.00 54.58 55.07 2qyh n ASN 210 Cb 1.09 -0.79 0.28 0.00 -0.53 0.00 0.00 39.78 39.83 2qyh n ASN 210 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 2qyh n ASP 211 N -2.18 1.40 0.20 1.20 8.00 0.19 -4.45 116.55 120.91 2qyh n ASP 211 Ca 0.01 -1.15 -0.15 0.00 0.71 0.00 0.00 54.79 54.21 2qyh n ASP 211 Cb 0.16 0.21 -0.07 0.00 -0.02 0.00 0.00 41.12 41.40 2qyh n ASP 211 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2qyh h ILE 212 N 1.75 0.36 0.00 0.53 2.04 -1.59 0.79 117.51 121.40 2qyh h ILE 212 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 2qyh h ILE 212 Cb 0.59 0.36 0.00 0.00 -0.74 0.00 0.00 36.82 37.03 2qyh h ILE 212 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 178.15 176.31 2qyh n GLU 213 N -5.42 0.00 0.00 2.37 0.28 -1.26 -0.62 120.64 115.99 2qyh n GLU 213 Ca -0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.91 2qyh n GLU 213 Cb 0.32 -0.87 0.00 0.00 1.43 0.00 0.00 31.44 32.32 2qyh n GLU 213 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2qyh n LEU 215 N -0.03 0.00 0.11 -1.84 4.32 0.27 -1.89 117.00 117.94 2qyh n LEU 215 Ca 0.00 0.00 -0.23 0.00 -0.02 0.00 0.00 56.01 55.76 2qyh n LEU 215 Cb 0.00 0.00 -0.14 0.00 -1.62 0.00 0.00 43.42 41.66 2qyh n LEU 215 CO 0.00 0.00 -0.13 -1.28 -1.22 0.00 0.00 177.39 174.76 2qyh h SER 216 N 0.00 0.84 0.14 -1.43 0.87 -1.10 -3.33 113.55 109.53 2qyh h SER 216 Ca 0.00 -0.82 -0.24 0.00 -1.23 0.00 0.00 61.79 59.49 2qyh h SER 216 Cb 0.00 -0.27 0.01 0.00 -0.44 0.00 0.00 62.40 61.70 2qyh h SER 216 CO 0.00 1.63 -0.97 0.15 -0.53 0.00 0.00 176.83 177.11 2qyh h PHE 217 N 0.22 0.85 -4.30 2.24 3.04 -1.62 -3.46 116.94 113.90 2qyh h PHE 217 Ca -0.21 -0.45 -0.51 0.00 3.98 0.00 0.00 57.97 60.78 2qyh h PHE 217 Cb 2.02 -0.10 0.12 0.00 2.56 0.00 0.00 35.95 40.55 2qyh h PHE 217 CO 0.12 1.28 0.33 0.14 -2.02 0.00 0.00 178.31 178.15 2qyh s VAL 218 N -3.35 3.46 0.34 1.41 -7.23 -1.26 -4.94 120.40 108.83 2qyh s VAL 218 Ca -0.08 0.47 0.03 0.00 -1.81 0.00 0.00 61.98 60.60 2qyh s VAL 218 Cb 0.08 -3.04 0.19 0.00 0.56 0.00 0.00 36.38 34.17 2qyh s VAL 218 CO 0.89 -0.62 1.92 1.23 -0.31 0.00 0.00 175.10 178.21 2qyh h GLY 219 N -1.05 0.69 -6.92 2.32 0.00 -0.87 -3.38 103.07 93.86 2qyh h GLY 219 Ca -0.44 -0.35 -0.55 0.00 0.00 0.00 0.00 47.33 45.99 2qyh h GLY 219 CO 0.53 0.33 -0.77 -1.59 0.00 0.00 0.00 176.54 175.05 2qyh s THR 220 N -5.24 0.25 -0.09 4.70 2.01 -0.62 -4.98 115.64 111.69 2qyh s THR 220 Ca -0.09 -0.96 -0.17 0.00 0.31 0.00 0.00 61.69 60.79 2qyh s THR 220 Cb 0.16 -1.20 -0.05 0.00 0.01 0.00 0.00 72.50 71.42 2qyh s THR 220 CO 0.77 -0.70 0.43 -0.83 -0.69 0.00 0.00 174.62 173.60 2qyh s GLY 221 N 1.94 2.40 -0.13 4.40 0.00 -1.25 -1.63 107.32 113.04 2qyh s GLY 221 Ca 0.09 -0.23 0.02 0.00 0.00 0.00 0.00 44.72 44.59 2qyh s GLY 221 CO -0.32 0.53 -0.18 0.14 0.00 0.00 0.00 173.10 173.27 2qyh s VAL 222 N 0.08 2.51 0.00 1.40 1.01 0.32 -0.62 120.40 125.09 2qyh s VAL 222 Ca 0.24 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.38 2qyh s VAL 222 Cb -0.15 -2.03 0.00 0.00 0.00 0.00 0.00 36.38 34.20 2qyh s VAL 222 CO 0.10 0.53 0.00 0.00 0.00 0.00 0.00 175.10 175.74 2qyh n ALA 223 N 3.78 0.00 -0.06 5.51 0.00 -0.01 -1.78 120.51 127.95 2qyh n ALA 223 Ca -0.19 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.13 2qyh n ALA 223 Cb 0.52 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.86 2qyh n ALA 223 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2qyh h GLY 225 N 0.00 -0.01 -3.00 0.00 0.00 -0.54 -0.64 103.07 98.88 2qyh h GLY 225 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 2qyh h GLY 225 CO 0.00 -0.00 0.03 0.70 0.00 0.00 0.00 176.54 177.27 2qyh n ASN 226 N -4.66 5.07 -4.65 0.19 3.02 -1.26 -4.83 115.26 108.13 2qyh n ASN 226 Ca -0.08 -3.01 -0.31 0.00 -0.03 0.00 0.00 54.58 51.14 2qyh n ASN 226 Cb 0.39 -0.65 0.17 0.00 -0.61 0.00 0.00 39.78 39.08 2qyh n ASN 226 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qyh n ALA 227 N 0.17 -0.98 -1.72 5.41 0.00 -1.26 -4.91 120.51 117.22 2qyh n ALA 227 Ca 0.28 -0.60 -0.39 0.00 0.00 0.00 0.00 53.44 52.73 2qyh n ALA 227 Cb 1.14 -2.18 0.04 0.00 0.00 0.00 0.00 19.45 18.45 2qyh n ALA 227 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2qyh n HIS 228 N -4.30 2.08 -0.32 0.00 -0.00 -1.24 -4.78 115.22 106.66 2qyh n HIS 228 Ca 0.11 0.45 0.14 0.00 0.46 0.00 0.00 57.72 58.88 2qyh n HIS 228 Cb 0.52 -2.34 0.38 0.00 -0.12 0.00 0.00 29.99 28.43 2qyh n HIS 228 CO 0.00 0.00 0.00 0.93 0.46 0.00 0.00 176.34 177.73 2qyh h GLU 229 N 1.44 0.65 0.00 1.57 4.39 -1.97 0.23 114.58 120.89 2qyh h GLU 229 Ca -0.50 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.16 2qyh h GLU 229 Cb 1.31 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.81 2qyh h GLU 229 CO 0.57 0.43 0.00 0.39 -1.16 0.00 0.00 179.01 179.24 2qyh n GLU 230 N -4.66 0.08 0.07 2.33 -0.58 -1.26 -1.59 120.64 115.03 2qyh n GLU 230 Ca 0.22 0.25 -0.23 0.00 -0.42 0.00 0.00 57.16 56.97 2qyh n GLU 230 Cb 0.59 -1.64 -0.15 0.00 -0.57 0.00 0.00 31.44 29.68 2qyh n GLU 230 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2qyh h VAL 231 N 0.00 0.93 -0.50 2.62 2.07 -0.90 -3.32 116.25 117.14 2qyh h VAL 231 Ca 0.00 -2.51 -0.10 0.00 0.82 0.00 0.00 66.70 64.91 2qyh h VAL 231 Cb 0.38 2.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.89 2qyh h VAL 231 CO 0.00 0.86 -0.09 0.11 0.02 0.00 0.00 177.57 178.47 2qyh h LYS 232 N 0.11 0.92 -0.92 1.57 1.57 -1.10 -3.03 116.57 115.68 2qyh h LYS 232 Ca -0.35 -0.32 0.12 0.00 -1.87 0.00 0.00 60.65 58.23 2qyh h LYS 232 Cb 2.10 -0.07 -0.08 0.00 0.08 0.00 0.00 32.23 34.26 2qyh h LYS 232 CO 0.18 0.97 0.55 -0.09 -0.57 0.00 0.00 179.45 180.48 2qyh h ARG 233 N 0.83 0.84 -0.01 3.15 2.43 -1.40 -0.80 114.38 119.42 2qyh h ARG 233 Ca 0.14 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2qyh h ARG 233 Cb 0.62 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 2qyh h ARG 233 CO 0.04 0.56 -0.07 1.33 -1.51 0.00 0.00 179.97 180.32 2qyh n VAL 234 N -4.70 0.00 -2.85 0.20 0.24 -1.18 -4.91 118.33 105.13 2qyh n VAL 234 Ca 0.17 -0.17 -0.36 0.00 -2.04 0.00 0.00 64.34 61.94 2qyh n VAL 234 Cb 0.35 0.29 -0.06 0.00 -1.47 0.00 0.00 33.84 32.94 2qyh n VAL 234 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2qyh s ALA 235 N -2.17 3.21 -0.92 2.33 0.00 -0.31 -4.53 121.76 119.38 2qyh s ALA 235 Ca 0.35 0.43 0.27 0.00 0.00 0.00 0.00 51.96 53.01 2qyh s ALA 235 Cb 0.21 -3.11 0.82 0.00 0.00 0.00 0.00 23.12 21.04 2qyh s ALA 235 CO 0.40 0.20 1.66 -0.25 0.00 0.00 0.00 175.76 177.76 2qyh n ASP 236 N 0.34 0.36 -3.64 0.00 8.00 0.21 -4.84 116.55 116.99 2qyh n ASP 236 Ca 0.02 0.21 -0.10 0.00 0.71 0.00 0.00 54.79 55.63 2qyh n ASP 236 Cb 0.51 -0.20 -0.07 0.00 -0.02 0.00 0.00 41.12 41.34 2qyh n ASP 236 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2qyh s PHE 237 N -3.04 -0.67 -0.25 1.24 2.19 -1.01 -4.96 117.98 111.49 2qyh s PHE 237 Ca 0.12 1.56 -0.05 0.00 0.33 0.00 0.00 56.93 58.89 2qyh s PHE 237 Cb 0.17 0.35 -0.00 0.00 -1.31 0.00 0.00 43.02 42.23 2qyh s PHE 237 CO 0.62 -0.32 -0.00 0.08 1.83 0.00 0.00 175.22 177.43 2qyh s VAL 238 N 0.52 3.54 0.26 3.12 1.01 -1.26 -0.83 120.40 126.76 2qyh s VAL 238 Ca -0.00 -0.60 0.04 0.00 0.00 0.00 0.00 61.98 61.42 2qyh s VAL 238 Cb -0.05 -2.70 0.04 0.00 0.00 0.00 0.00 36.38 33.67 2qyh s VAL 238 CO -0.05 0.29 0.36 1.07 0.00 0.00 0.00 175.10 176.77 2qyh n THR 239 N 4.81 0.00 -1.52 3.92 5.66 -0.25 -4.94 114.28 121.97 2qyh n THR 239 Ca -0.17 -0.84 -0.29 0.00 -3.05 0.00 0.00 64.05 59.70 2qyh n THR 239 Cb 0.49 -0.82 0.14 0.00 -1.55 0.00 0.00 70.33 68.60 2qyh n THR 239 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 2qyh s LYS 240 N -3.20 1.08 0.80 1.09 1.02 -1.26 -1.25 119.74 118.02 2qyh s LYS 240 Ca 0.27 0.29 -0.11 0.00 0.02 0.00 0.00 55.97 56.45 2qyh s LYS 240 Cb -0.02 -1.83 0.07 0.00 -0.52 0.00 0.00 37.83 35.53 2qyh s LYS 240 CO 0.17 -2.24 1.10 -2.14 -0.92 0.00 0.00 175.35 171.32 2qyh s PRO 241 N -5.27 2.02 0.54 -1.68 0.02 -1.26 -2.01 135.00 127.36 2qyh s PRO 241 Ca 0.64 1.19 0.22 0.00 0.02 0.00 0.00 61.00 63.07 2qyh s PRO 241 Cb -0.15 -1.87 1.43 0.00 0.02 0.00 0.00 34.50 33.93 2qyh s PRO 241 CO 0.54 -1.82 2.11 -0.24 -0.33 0.00 0.00 177.00 177.26 2qyh h VAL 242 N -1.26 0.79 0.00 3.83 3.04 -1.89 0.22 116.25 120.99 2qyh h VAL 242 Ca -0.44 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.24 2qyh h VAL 242 Cb 1.24 0.91 -0.00 0.00 -2.01 0.00 0.00 31.29 31.42 2qyh h VAL 242 CO 0.50 0.00 -0.05 -0.78 -1.01 0.00 0.00 177.57 176.24 2qyh h ASP 243 N 0.00 0.00 -1.14 3.17 3.58 -1.91 -3.28 116.42 116.84 2qyh h ASP 243 Ca 0.08 0.00 -0.53 0.00 0.42 0.00 0.00 57.03 57.00 2qyh h ASP 243 Cb 0.34 0.00 -0.42 0.00 1.72 0.00 0.00 39.33 40.97 2qyh h ASP 243 CO -0.00 0.05 -0.83 0.29 -2.88 0.00 0.00 179.24 175.86 2qyh n LYS 244 N -3.22 3.15 -2.12 0.28 5.02 0.69 -4.93 118.16 117.04 2qyh n LYS 244 Ca -0.01 -4.21 -0.19 0.00 -2.02 0.00 0.00 58.31 51.89 2qyh n LYS 244 Cb 0.26 -2.12 -0.03 0.00 -0.02 0.00 0.00 35.03 33.12 2qyh n LYS 244 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2qyh n GLU 245 N -0.52 -1.45 -0.25 1.97 1.02 -1.23 -4.71 120.64 115.47 2qyh n GLU 245 Ca 0.36 0.99 0.05 0.00 -0.02 0.00 0.00 57.16 58.54 2qyh n GLU 245 Cb 0.79 -5.46 0.17 0.00 -0.02 0.00 0.00 31.44 26.92 2qyh n GLU 245 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 2qyh h GLY 246 N 0.00 0.96 0.97 0.62 0.00 -1.47 0.30 103.07 104.46 2qyh h GLY 246 Ca -0.43 0.01 -0.02 0.00 0.00 0.00 0.00 47.33 46.89 2qyh h GLY 246 CO 0.54 -0.24 0.22 -2.22 0.00 0.00 0.00 176.54 174.85 2qyh h ILE 247 N 0.20 1.21 0.40 2.60 1.08 -1.83 0.95 117.51 122.12 2qyh h ILE 247 Ca 0.41 -0.62 -0.02 0.00 -0.39 0.00 0.00 64.86 64.25 2qyh h ILE 247 Cb 0.72 0.66 0.00 0.00 -3.07 0.00 0.00 36.82 35.14 2qyh h ILE 247 CO -0.56 0.24 -0.19 -0.25 -0.69 0.00 0.00 178.15 176.69 2qyh h TRP 248 N 0.69 -0.50 -0.38 1.37 2.91 -1.52 -1.88 115.95 116.64 2qyh h TRP 248 Ca 0.17 -0.01 0.07 0.00 1.13 0.00 0.00 58.89 60.25 2qyh h TRP 248 Cb 0.16 0.17 -0.07 0.00 -0.51 0.00 0.00 29.16 28.91 2qyh h TRP 248 CO 0.00 -0.18 -0.04 -0.92 -1.03 0.00 0.00 178.44 176.27 2qyh h TYR 249 N -0.89 -0.10 -0.39 2.65 5.03 -0.45 -1.11 116.97 121.71 2qyh h TYR 249 Ca -0.06 0.03 0.04 0.00 2.58 0.00 0.00 58.73 61.32 2qyh h TYR 249 Cb 0.55 0.10 -0.04 0.00 1.55 0.00 0.00 36.73 38.90 2qyh h TYR 249 CO 0.02 -0.11 0.17 0.78 -1.32 0.00 0.00 178.16 177.69 2qyh h GLY 250 N 0.05 0.52 1.97 1.82 0.00 -0.83 -1.05 103.07 105.56 2qyh h GLY 250 Ca 0.18 -0.11 -0.04 0.00 0.00 0.00 0.00 47.33 47.36 2qyh h GLY 250 CO -0.34 0.07 -0.18 1.41 0.00 0.00 0.00 176.54 177.49 2qyh h LEU 251 N 0.35 0.03 0.17 3.11 3.38 -0.78 -1.25 115.31 120.32 2qyh h LEU 251 Ca 0.17 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 2qyh h LEU 251 Cb 0.12 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2qyh h LEU 251 CO -0.15 0.22 -0.08 0.50 0.09 0.00 0.00 178.44 179.02 2qyh h LYS 252 N 0.03 -0.22 -0.95 1.13 3.64 -0.41 0.19 116.57 119.97 2qyh h LYS 252 Ca 0.01 0.02 0.11 0.00 -1.27 0.00 0.00 60.65 59.51 2qyh h LYS 252 Cb 0.34 0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 32.14 2qyh h LYS 252 CO 0.02 0.18 0.61 1.96 -2.27 0.00 0.00 179.45 179.96 2qyh h GLN 253 N -0.74 0.93 0.00 1.90 1.08 -1.05 0.67 115.11 117.90 2qyh h GLN 253 Ca -0.02 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.12 2qyh h GLN 253 Cb 0.51 -0.21 0.00 0.00 -0.05 0.00 0.00 27.48 27.73 2qyh h GLN 253 CO 0.04 0.61 0.00 1.28 -0.95 0.00 0.00 178.83 179.81 2qyh n LEU 254 N -4.56 0.00 -3.39 1.46 4.77 -0.49 -4.87 117.00 109.92 2qyh n LEU 254 Ca 0.17 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.90 2qyh n LEU 254 Cb 0.32 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.44 2qyh n LEU 254 CO 0.30 0.00 0.03 0.00 -1.33 0.00 0.00 177.39 176.39 2qyh n GLN 255 N -0.88 -4.79 0.06 3.23 6.02 0.23 -4.87 117.38 116.38 2qyh n GLN 255 Ca 0.15 0.68 0.01 0.00 -0.01 0.00 0.00 57.00 57.84 2qyh n GLN 255 Cb 0.07 -5.52 -0.06 0.00 1.02 0.00 0.00 30.24 25.75 2qyh n GLN 255 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2qyh h LEU 256 N -1.51 0.00 -0.30 1.08 3.38 -1.14 -3.49 115.31 113.32 2qyh h LEU 256 Ca -0.51 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.46 2qyh h LEU 256 Cb 1.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.09 2qyh h LEU 256 CO 0.58 0.54 0.00 2.30 0.09 0.00 0.00 178.44 181.95