#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dqn s ILE 2 N 0.00 0.91 0.05 1.12 -4.36 -1.26 -0.83 121.20 116.82 1dqn s ILE 2 Ca 0.00 -1.99 -0.31 0.00 -0.26 0.00 0.00 60.65 58.09 1dqn s ILE 2 Cb 0.00 -1.77 -0.06 0.00 1.25 0.00 0.00 42.46 41.88 1dqn s ILE 2 CO 0.00 -0.81 1.39 0.00 0.24 0.00 0.00 174.94 175.76 1dqn n SER 4 N 4.79 0.00 -0.09 0.00 3.41 -1.26 -0.59 113.62 119.88 1dqn n SER 4 Ca 0.12 -0.20 -0.14 0.00 -0.26 0.00 0.00 58.87 58.39 1dqn n SER 4 Cb 0.43 -0.19 -0.05 0.00 -0.26 0.00 0.00 64.21 64.14 1dqn n SER 4 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1dqn n VAL 5 N -1.19 1.40 0.12 -3.33 0.31 -1.26 -4.70 118.33 109.68 1dqn n VAL 5 Ca 0.11 -0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.48 1dqn n VAL 5 Cb 0.13 -2.09 0.02 0.00 -0.91 0.00 0.00 33.84 30.98 1dqn n VAL 5 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 1dqn h THR 6 N -0.85 0.52 0.00 2.52 1.35 -1.96 -3.48 112.91 111.02 1dqn h THR 6 Ca -0.22 -1.81 0.00 0.00 -0.55 0.00 0.00 66.41 63.83 1dqn h THR 6 Cb 1.09 2.14 0.00 0.00 -1.73 0.00 0.00 68.15 69.65 1dqn h THR 6 CO -0.13 0.30 0.00 0.61 -0.25 0.00 0.00 175.52 176.05 1dqn n GLY 7 N 1.24 0.83 3.75 5.82 0.00 0.24 -4.99 105.19 112.08 1dqn n GLY 7 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 1dqn n GLY 7 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1dqn s LYS 8 N -0.17 4.77 0.19 1.61 2.20 -1.26 -4.66 119.74 122.43 1dqn s LYS 8 Ca 0.00 1.43 -0.33 0.00 -0.36 0.00 0.00 55.97 56.71 1dqn s LYS 8 Cb 0.00 -3.31 -0.13 0.00 -1.51 0.00 0.00 37.83 32.88 1dqn s LYS 8 CO 0.00 0.43 1.60 -2.30 -0.36 0.00 0.00 175.35 174.72 1dqn n PRO 9 N 1.93 2.37 0.01 4.03 -0.02 -1.26 -0.49 135.00 141.56 1dqn n PRO 9 Ca -0.01 0.85 0.11 0.00 -2.02 0.00 0.00 63.50 62.43 1dqn n PRO 9 Cb 0.48 -2.63 0.54 0.00 -0.02 0.00 0.00 33.50 31.87 1dqn n PRO 9 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1dqn h VAL 10 N 3.59 0.93 -0.98 -1.45 2.07 -1.29 -0.58 116.25 118.53 1dqn h VAL 10 Ca -0.45 -0.10 0.08 0.00 0.82 0.00 0.00 66.70 67.05 1dqn h VAL 10 Cb 1.24 0.61 -0.07 0.00 -1.52 0.00 0.00 31.29 31.55 1dqn h VAL 10 CO 0.89 0.05 0.62 0.07 0.02 0.00 0.00 177.57 179.23 1dqn h LYS 11 N 0.29 1.06 0.05 1.57 2.10 -1.89 0.39 116.57 120.14 1dqn h LYS 11 Ca 0.20 -0.06 -0.23 0.00 -2.00 0.00 0.00 60.65 58.55 1dqn h LYS 11 Cb 0.41 -0.24 -0.01 0.00 -0.90 0.00 0.00 32.23 31.49 1dqn h LYS 11 CO -0.04 0.70 -1.03 -0.44 -2.00 0.00 0.00 179.45 176.64 1dqn h ASP 12 N 1.09 0.34 -0.49 7.07 3.45 -1.50 -1.48 116.42 124.89 1dqn h ASP 12 Ca 0.44 -0.31 -0.01 0.00 0.43 0.00 0.00 57.03 57.59 1dqn h ASP 12 Cb 0.26 -0.11 -0.02 0.00 -0.56 0.00 0.00 39.33 38.90 1dqn h ASP 12 CO -0.20 1.17 0.28 0.58 -1.57 0.00 0.00 179.24 179.50 1dqn h VAL 13 N 0.11 1.16 -0.35 -1.35 2.07 -0.62 -1.47 116.25 115.80 1dqn h VAL 13 Ca -0.08 -0.39 -0.16 0.00 0.82 0.00 0.00 66.70 66.89 1dqn h VAL 13 Cb 1.71 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 32.01 1dqn h VAL 13 CO 0.16 0.17 -0.42 -0.07 0.02 0.00 0.00 177.57 177.44 1dqn h LEU 14 N 0.65 0.95 -0.87 2.57 3.38 -0.92 -0.74 115.31 120.34 1dqn h LEU 14 Ca 0.17 -0.45 -0.07 0.00 0.09 0.00 0.00 57.88 57.62 1dqn h LEU 14 Cb 0.02 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 1dqn h LEU 14 CO -0.03 1.23 0.03 0.77 0.09 0.00 0.00 178.44 180.53 1dqn h SER 15 N 0.71 0.83 -0.49 -0.43 4.64 -1.13 -0.44 113.55 117.25 1dqn h SER 15 Ca 0.05 -0.20 -0.08 0.00 -0.47 0.00 0.00 61.79 61.10 1dqn h SER 15 Cb 1.00 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.86 1dqn h SER 15 CO 0.10 0.88 0.00 0.74 -0.87 0.00 0.00 176.83 177.68 1dqn h THR 16 N 0.81 1.26 -0.59 2.95 2.02 -1.16 -2.21 112.91 116.00 1dqn h THR 16 Ca 0.16 -1.06 -0.01 0.00 0.77 0.00 0.00 66.41 66.27 1dqn h THR 16 Cb 0.44 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 67.81 1dqn h THR 16 CO 0.02 0.37 0.33 0.15 0.37 0.00 0.00 175.52 176.76 1dqn h PHE 17 N 0.71 0.80 -0.01 3.16 3.04 -0.52 -3.19 116.94 120.93 1dqn h PHE 17 Ca 0.14 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.07 1dqn h PHE 17 Cb 0.51 -0.26 0.00 0.00 2.56 0.00 0.00 35.95 38.76 1dqn h PHE 17 CO 0.04 0.57 -0.11 1.19 -2.02 0.00 0.00 178.31 177.97 1dqn n PHE 18 N -4.60 0.00 -2.06 0.41 3.01 -0.23 -4.86 117.46 109.14 1dqn n PHE 18 Ca 0.04 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.07 1dqn n PHE 18 Cb 0.08 -0.07 -0.03 0.00 -0.01 0.00 0.00 39.48 39.45 1dqn n PHE 18 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 1dqn s LYS 19 N -2.25 4.21 -1.35 -1.08 2.20 -0.84 -3.63 119.74 117.00 1dqn s LYS 19 Ca 0.32 2.15 -0.05 0.00 -0.36 0.00 0.00 55.97 58.03 1dqn s LYS 19 Cb 0.20 -3.77 -0.00 0.00 -1.51 0.00 0.00 37.83 32.75 1dqn s LYS 19 CO 0.42 -0.74 0.50 -0.25 -0.36 0.00 0.00 175.35 174.92 1dqn n ASP 20 N 6.26 -1.37 -4.94 1.43 8.00 -1.26 -4.99 116.55 119.67 1dqn n ASP 20 Ca 0.16 -1.01 -0.24 0.00 0.71 0.00 0.00 54.79 54.40 1dqn n ASP 20 Cb 0.42 -3.10 0.01 0.00 -0.02 0.00 0.00 41.12 38.43 1dqn n ASP 20 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1dqn s ARG 21 N -6.46 3.19 -0.11 -1.24 0.52 -1.24 -5.01 118.95 108.60 1dqn s ARG 21 Ca 0.10 -0.32 0.14 0.00 -0.52 0.00 0.00 55.73 55.14 1dqn s ARG 21 Cb -0.04 -2.52 0.28 0.00 0.52 0.00 0.00 34.95 33.19 1dqn s ARG 21 CO 0.88 -0.23 1.14 0.09 0.02 0.00 0.00 175.30 177.21 1dqn n ASN 22 N -2.10 1.64 -0.48 0.23 3.02 -1.26 -4.72 115.26 111.59 1dqn n ASN 22 Ca 0.00 -3.00 0.05 0.00 -0.03 0.00 0.00 54.58 51.60 1dqn n ASN 22 Cb 0.57 -0.40 0.08 0.00 -0.61 0.00 0.00 39.78 39.41 1dqn n ASN 22 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1dqn n ASP 23 N -0.92 1.16 -3.63 6.41 3.85 -1.26 -5.03 116.55 117.13 1dqn n ASP 23 Ca 0.13 -2.60 -0.10 0.00 -0.71 0.00 0.00 54.79 51.51 1dqn n ASP 23 Cb 0.71 -0.33 -0.07 0.00 -1.35 0.00 0.00 41.12 40.08 1dqn n ASP 23 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 1dqn s VAL 24 N -1.39 0.00 0.40 2.12 0.11 -1.26 -4.98 120.40 115.40 1dqn s VAL 24 Ca 0.20 0.00 -0.12 0.00 -2.93 0.00 0.00 61.98 59.13 1dqn s VAL 24 Cb 0.19 -1.00 -0.07 0.00 -1.53 0.00 0.00 36.38 33.97 1dqn s VAL 24 CO -0.02 0.00 0.79 -0.76 -3.33 0.00 0.00 175.10 171.79 1dqn s LEU 25 N 0.10 3.85 0.27 2.54 1.43 -1.26 -4.91 118.68 120.70 1dqn s LEU 25 Ca 0.02 1.23 -0.01 0.00 -1.03 0.00 0.00 54.13 54.35 1dqn s LEU 25 Cb -0.05 -4.10 0.51 0.00 0.03 0.00 0.00 46.19 42.58 1dqn s LEU 25 CO -0.05 -0.38 1.81 1.05 0.23 0.00 0.00 176.35 179.01 1dqn h GLU 26 N 1.43 0.83 0.00 1.70 -0.00 -2.00 0.44 114.58 116.99 1dqn h GLU 26 Ca -0.47 -0.05 0.00 0.00 -0.00 0.00 0.00 59.36 58.84 1dqn h GLU 26 Cb 1.18 -0.19 0.00 0.00 -0.00 0.00 0.00 28.75 29.75 1dqn h GLU 26 CO 0.64 0.55 0.00 0.66 -0.00 0.00 0.00 179.01 180.86 1dqn h SER 27 N 0.86 0.00 0.93 3.06 4.64 -2.06 -2.81 113.55 118.16 1dqn h SER 27 Ca 0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.79 1dqn h SER 27 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1dqn h SER 27 CO -0.28 0.00 -0.79 -0.33 -0.87 0.00 0.00 176.83 174.56 1dqn h GLU 28 N 0.00 0.00 -0.97 4.77 5.08 -1.29 -3.39 114.58 118.78 1dqn h GLU 28 Ca 0.00 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.50 1dqn h GLU 28 Cb 0.38 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.54 1dqn h GLU 28 CO 0.00 0.00 0.59 0.28 -1.00 0.00 0.00 179.01 178.88 1dqn h VAL 29 N 0.00 0.84 0.00 3.13 2.07 -1.21 -0.43 116.25 120.65 1dqn h VAL 29 Ca 0.00 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.22 1dqn h VAL 29 Cb 0.86 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 1dqn h VAL 29 CO 0.00 0.16 0.00 2.29 0.02 0.00 0.00 177.57 180.04 1dqn n LYS 30 N -4.70 0.02 0.23 1.57 2.85 -1.26 -2.48 118.16 114.39 1dqn n LYS 30 Ca 0.19 0.30 0.11 0.00 -1.05 0.00 0.00 58.31 57.86 1dqn n LYS 30 Cb 0.41 -1.53 0.48 0.00 -0.65 0.00 0.00 35.03 33.74 1dqn n LYS 30 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 1dqn h LYS 31 N 0.00 0.00 -4.97 -1.58 3.64 -1.34 -3.43 116.57 108.89 1dqn h LYS 31 Ca 0.00 0.00 -0.64 0.00 -1.27 0.00 0.00 60.65 58.74 1dqn h LYS 31 Cb 0.22 0.00 -0.16 0.00 -0.41 0.00 0.00 32.23 31.87 1dqn h LYS 31 CO 0.00 0.20 -0.41 -0.06 -2.27 0.00 0.00 179.45 176.92 1dqn s PHE 32 N -3.66 3.23 -0.26 1.91 0.40 -1.03 -4.45 117.98 114.12 1dqn s PHE 32 Ca 0.01 0.17 -0.09 0.00 -0.60 0.00 0.00 56.93 56.42 1dqn s PHE 32 Cb 0.10 -2.48 -0.04 0.00 0.51 0.00 0.00 43.02 41.12 1dqn s PHE 32 CO 0.63 -0.22 0.12 -1.01 0.70 0.00 0.00 175.22 175.43 1dqn s HIS 33 N 1.88 3.15 -0.10 0.36 3.76 0.03 -4.93 115.29 119.45 1dqn s HIS 33 Ca 0.10 -0.17 -0.30 0.00 -0.15 0.00 0.00 55.06 54.54 1dqn s HIS 33 Cb -0.16 -2.29 -0.03 0.00 1.11 0.00 0.00 32.58 31.21 1dqn s HIS 33 CO 0.11 -0.25 1.31 -1.17 -0.85 0.00 0.00 174.74 173.89 1dqn s LEU 34 N 1.62 4.24 -0.26 0.89 0.20 -1.26 -0.44 118.68 123.66 1dqn s LEU 34 Ca 0.06 1.85 -0.03 0.00 0.69 0.00 0.00 54.13 56.70 1dqn s LEU 34 Cb -0.15 -3.55 -0.15 0.00 -0.43 0.00 0.00 46.19 41.91 1dqn s LEU 34 CO 0.07 -0.72 -0.26 0.18 -0.29 0.00 0.00 176.35 175.32 1dqn n LEU 35 N 6.07 2.64 -3.73 -0.68 4.77 0.10 -4.93 117.00 121.24 1dqn n LEU 35 Ca 0.13 0.02 -0.12 0.00 -0.03 0.00 0.00 56.01 56.01 1dqn n LEU 35 Cb 0.45 -0.88 -0.13 0.00 -2.33 0.00 0.00 43.42 40.53 1dqn n LEU 35 CO 0.57 0.82 -0.10 0.00 -1.33 0.00 0.00 177.39 177.34 1dqn s ALA 36 N -2.52 -0.61 0.75 -1.18 0.00 -0.91 -4.72 121.76 112.58 1dqn s ALA 36 Ca -0.36 1.00 -0.11 0.00 0.00 0.00 0.00 51.96 52.50 1dqn s ALA 36 Cb 0.11 -0.63 0.04 0.00 0.00 0.00 0.00 23.12 22.64 1dqn s ALA 36 CO 0.57 -0.19 1.08 0.95 0.00 0.00 0.00 175.76 178.16 1dqn s THR 37 N 1.12 3.56 0.24 0.00 -4.23 -1.26 -0.53 115.64 114.54 1dqn s THR 37 Ca -0.08 0.51 -0.05 0.00 -1.18 0.00 0.00 61.69 60.88 1dqn s THR 37 Cb -0.09 -3.10 0.20 0.00 1.34 0.00 0.00 72.50 70.86 1dqn s THR 37 CO -0.08 -0.66 1.83 0.15 -0.54 0.00 0.00 174.62 175.32 1dqn h PHE 38 N -0.99 0.88 -0.88 3.99 3.57 -1.92 0.49 116.94 122.09 1dqn h PHE 38 Ca -0.44 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.08 1dqn h PHE 38 Cb 1.23 -0.28 -0.04 0.00 2.79 0.00 0.00 35.95 39.65 1dqn h PHE 38 CO 0.58 0.41 0.53 0.93 -2.23 0.00 0.00 178.31 178.53 1dqn h GLU 39 N 0.85 1.19 -0.62 1.11 4.39 -1.92 0.12 114.58 119.70 1dqn h GLU 39 Ca 0.38 -0.11 -0.08 0.00 0.34 0.00 0.00 59.36 59.89 1dqn h GLU 39 Cb 0.26 -0.25 -0.03 0.00 -0.10 0.00 0.00 28.75 28.64 1dqn h GLU 39 CO -0.21 0.83 0.08 0.93 -1.16 0.00 0.00 179.01 179.48 1dqn h GLU 40 N 1.21 1.03 -0.70 2.33 5.08 -1.54 -1.32 114.58 120.67 1dqn h GLU 40 Ca 0.32 -0.28 -0.05 0.00 -1.00 0.00 0.00 59.36 58.35 1dqn h GLU 40 Cb -0.05 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.05 1dqn h GLU 40 CO -0.06 0.96 0.22 0.00 -1.00 0.00 0.00 179.01 179.14 1dqn h LYS 42 N 1.03 0.33 -0.34 0.00 1.57 -0.34 -0.57 116.57 118.25 1dqn h LYS 42 Ca 0.23 -0.09 -0.10 0.00 -1.87 0.00 0.00 60.65 58.82 1dqn h LYS 42 Cb 0.28 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1dqn h LYS 42 CO -0.01 0.49 -0.19 0.00 -0.57 0.00 0.00 179.45 179.17 1dqn h ALA 43 N 1.54 0.48 -0.74 3.86 0.00 -0.67 -0.54 119.26 123.19 1dqn h ALA 43 Ca 0.06 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.56 1dqn h ALA 43 Cb 0.46 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1dqn h ALA 43 CO 0.03 0.42 0.25 -0.07 0.00 0.00 0.00 179.25 179.88 1dqn h LEU 44 N 0.50 1.05 -0.60 0.00 3.38 -0.89 -0.83 115.31 117.92 1dqn h LEU 44 Ca 0.07 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.76 1dqn h LEU 44 Cb 0.74 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 1dqn h LEU 44 CO 0.06 0.97 0.05 0.00 0.09 0.00 0.00 178.44 179.60 1dqn h ALA 45 N 1.12 0.81 -0.42 1.53 0.00 -1.01 -1.82 119.26 119.47 1dqn h ALA 45 Ca 0.24 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1dqn h ALA 45 Cb 0.28 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1dqn h ALA 45 CO -0.01 0.60 0.08 0.00 0.00 0.00 0.00 179.25 179.93 1dqn h ALA 46 N 1.00 1.36 -0.55 0.00 0.00 -0.69 -0.62 119.26 119.76 1dqn h ALA 46 Ca 0.18 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1dqn h ALA 46 Cb 0.49 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1dqn h ALA 46 CO 0.02 0.45 -0.07 0.22 0.00 0.00 0.00 179.25 179.87 1dqn h ASP 47 N 0.62 1.00 0.41 0.00 -0.00 -0.62 0.03 116.42 117.86 1dqn h ASP 47 Ca 0.14 -0.31 -0.11 0.00 -0.00 0.00 0.00 57.03 56.75 1dqn h ASP 47 Cb 0.26 -0.27 -0.01 0.00 -0.00 0.00 0.00 39.33 39.31 1dqn h ASP 47 CO -0.00 1.09 -0.48 0.71 -0.00 0.00 0.00 179.24 180.56 1dqn h THR 48 N 0.91 1.34 -0.23 2.25 1.35 -0.64 -1.67 112.91 116.22 1dqn h THR 48 Ca 0.15 -1.66 -0.05 0.00 -0.55 0.00 0.00 66.41 64.29 1dqn h THR 48 Cb 0.63 1.86 -0.01 0.00 -1.73 0.00 0.00 68.15 68.89 1dqn h THR 48 CO 0.04 0.48 -0.07 0.00 -0.25 0.00 0.00 175.52 175.73 1dqn h ALA 49 N 1.45 0.31 -0.45 6.62 0.00 -0.71 -0.82 119.26 125.67 1dqn h ALA 49 Ca 0.00 -0.27 0.07 0.00 0.00 0.00 0.00 54.91 54.71 1dqn h ALA 49 Cb 0.87 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.53 1dqn h ALA 49 CO 0.07 0.12 0.12 -0.09 0.00 0.00 0.00 179.25 179.46 1dqn h ARG 50 N 0.17 0.26 -0.44 0.00 2.43 -0.74 0.33 114.38 116.39 1dqn h ARG 50 Ca 0.06 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.10 1dqn h ARG 50 Cb 0.53 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.01 1dqn h ARG 50 CO 0.02 0.17 -0.15 0.00 -1.51 0.00 0.00 179.97 178.50 1dqn h ARG 51 N 0.27 0.83 -0.38 0.20 3.08 -1.17 -2.18 114.38 115.02 1dqn h ARG 51 Ca 0.22 -0.30 -0.13 0.00 0.07 0.00 0.00 59.98 59.84 1dqn h ARG 51 Cb 0.25 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1dqn h ARG 51 CO -0.26 0.93 -0.28 0.52 -1.07 0.00 0.00 179.97 179.81 1dqn h MET 52 N 0.74 0.80 -0.90 0.04 2.86 -0.48 -1.79 114.93 116.20 1dqn h MET 52 Ca 0.11 -0.35 -0.01 0.00 -2.06 0.00 0.00 59.70 57.40 1dqn h MET 52 Cb 0.66 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.26 1dqn h MET 52 CO 0.05 0.98 0.54 -0.91 1.06 0.00 0.00 176.91 178.62 1dqn h ASN 53 N 0.68 1.08 -0.22 1.22 2.35 -0.11 -0.61 115.58 119.97 1dqn h ASN 53 Ca 0.08 -0.07 -0.16 0.00 -0.55 0.00 0.00 56.30 55.61 1dqn h ASN 53 Cb 0.81 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.91 1dqn h ASN 53 CO 0.07 0.83 -0.49 -0.33 -1.65 0.00 0.00 177.43 175.86 1dqn h GLU 54 N 1.24 0.72 -0.78 0.81 4.39 -1.25 -1.58 114.58 118.13 1dqn h GLU 54 Ca 0.32 -0.48 -0.03 0.00 0.34 0.00 0.00 59.36 59.51 1dqn h GLU 54 Cb -0.05 0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.63 1dqn h GLU 54 CO -0.06 1.10 0.37 -0.92 -1.16 0.00 0.00 179.01 178.35 1dqn h TYR 55 N 0.44 1.13 -0.54 4.33 3.20 -0.94 -3.18 116.97 121.41 1dqn h TYR 55 Ca 0.00 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.81 1dqn h TYR 55 Cb 1.10 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 39.02 1dqn h TYR 55 CO 0.09 0.83 0.00 0.66 -1.64 0.00 0.00 178.16 178.09 1dqn n TYR 56 N -4.36 1.09 -0.09 -3.82 0.53 -0.27 -4.63 117.16 105.60 1dqn n TYR 56 Ca 0.07 -0.60 0.23 0.00 -1.02 0.00 0.00 57.90 56.58 1dqn n TYR 56 Cb 0.14 -0.16 0.68 0.00 -1.03 0.00 0.00 39.34 38.97 1dqn n TYR 56 CO 0.00 0.00 0.00 1.57 -1.02 0.00 0.00 176.86 177.41 1dqn h LYS 57 N 3.33 0.04 -0.30 -0.72 2.10 -1.26 -1.29 116.57 118.47 1dqn h LYS 57 Ca 0.00 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1dqn h LYS 57 Cb 1.20 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1dqn h LYS 57 CO 0.14 0.03 0.00 -0.25 -2.00 0.00 0.00 179.45 177.37 1dqn n ASP 58 N -4.35 3.69 -4.72 7.07 10.43 -1.26 -5.03 116.55 122.37 1dqn n ASP 58 Ca 0.14 -2.71 -0.43 0.00 2.57 0.00 0.00 54.79 54.36 1dqn n ASP 58 Cb 0.74 -0.46 -0.02 0.00 1.84 0.00 0.00 41.12 43.22 1dqn n ASP 58 CO 0.00 0.00 0.00 0.55 -1.07 0.00 0.00 177.20 176.68 1dqn n VAL 59 N -0.15 1.20 0.64 2.53 3.14 -0.49 -4.90 118.33 120.30 1dqn n VAL 59 Ca 0.19 -0.30 0.12 0.00 -2.96 0.00 0.00 64.34 61.39 1dqn n VAL 59 Cb 0.77 -1.79 0.16 0.00 -1.06 0.00 0.00 33.84 31.93 1dqn n VAL 59 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1dqn n ALA 60 N 1.73 3.08 -2.55 1.55 0.00 -1.26 -4.92 120.51 118.14 1dqn n ALA 60 Ca 0.08 -0.29 -0.09 0.00 0.00 0.00 0.00 53.44 53.15 1dqn n ALA 60 Cb 0.35 -1.14 -0.09 0.00 0.00 0.00 0.00 19.45 18.57 1dqn n ALA 60 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1dqn s GLU 61 N -3.15 0.59 0.28 0.00 -1.05 -1.26 -5.13 118.70 108.99 1dqn s GLU 61 Ca 0.07 -0.90 -0.30 0.00 -0.15 0.00 0.00 54.97 53.69 1dqn s GLU 61 Cb 0.14 0.22 -0.12 0.00 -0.44 0.00 0.00 34.13 33.94 1dqn s GLU 61 CO 0.73 -0.14 1.54 -2.30 0.95 0.00 0.00 175.26 176.04 1dqn n PRO 62 N 0.57 2.50 -2.73 -4.83 -0.02 -1.26 -4.90 135.00 124.33 1dqn n PRO 62 Ca -0.18 0.89 -0.37 0.00 -2.02 0.00 0.00 63.50 61.83 1dqn n PRO 62 Cb 0.59 -2.64 -0.06 0.00 -0.02 0.00 0.00 33.50 31.38 1dqn n PRO 62 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1dqn s VAL 63 N 0.01 4.10 -0.44 -1.45 1.01 -0.24 -4.83 120.40 118.56 1dqn s VAL 63 Ca 0.65 1.71 -0.17 0.00 0.00 0.00 0.00 61.98 64.17 1dqn s VAL 63 Cb -0.54 -3.93 0.03 0.00 0.00 0.00 0.00 36.38 31.94 1dqn s VAL 63 CO 0.48 0.11 0.45 -0.89 0.00 0.00 0.00 175.10 175.25 1dqn s THR 64 N -1.63 5.09 -0.16 3.92 2.01 -0.12 -1.43 115.64 123.31 1dqn s THR 64 Ca 0.52 -0.48 -0.13 0.00 0.31 0.00 0.00 61.69 61.91 1dqn s THR 64 Cb -0.19 -4.08 -0.05 0.00 0.01 0.00 0.00 72.50 68.19 1dqn s THR 64 CO 0.25 -0.49 0.26 -0.76 -0.69 0.00 0.00 174.62 173.18 1dqn s LEU 65 N 2.12 4.24 -0.23 4.42 1.43 -0.30 -1.12 118.68 129.25 1dqn s LEU 65 Ca 0.11 0.46 0.01 0.00 -1.03 0.00 0.00 54.13 53.68 1dqn s LEU 65 Cb -0.18 -2.32 0.06 0.00 0.03 0.00 0.00 46.19 43.78 1dqn s LEU 65 CO 0.12 0.12 -0.05 -0.69 0.23 0.00 0.00 176.35 176.08 1dqn s VAL 66 N 0.39 1.49 -0.02 -1.59 1.01 -0.23 -0.92 120.40 120.53 1dqn s VAL 66 Ca 0.15 -1.16 -0.12 0.00 0.00 0.00 0.00 61.98 60.85 1dqn s VAL 66 Cb -0.13 -1.75 -0.05 0.00 0.00 0.00 0.00 36.38 34.46 1dqn s VAL 66 CO 0.03 -0.08 0.32 0.00 0.00 0.00 0.00 175.10 175.38 1dqn s ALA 67 N 1.42 3.76 -0.39 5.51 0.00 0.63 -0.23 121.76 132.46 1dqn s ALA 67 Ca -0.05 -0.37 -0.21 0.00 0.00 0.00 0.00 51.96 51.33 1dqn s ALA 67 Cb -0.18 -2.24 0.01 0.00 0.00 0.00 0.00 23.12 20.71 1dqn s ALA 67 CO -0.06 0.54 0.66 -0.51 0.00 0.00 0.00 175.76 176.38 1dqn s LEU 68 N -1.19 4.32 0.63 0.00 1.43 -0.60 -1.49 118.68 121.78 1dqn s LEU 68 Ca 0.22 -0.01 -0.17 0.00 -1.03 0.00 0.00 54.13 53.15 1dqn s LEU 68 Cb -0.15 -2.79 -0.01 0.00 0.03 0.00 0.00 46.19 43.26 1dqn s LEU 68 CO 0.11 -0.68 1.15 -0.76 0.23 0.00 0.00 176.35 176.41 1dqn s LEU 69 N 2.81 3.52 -0.21 1.79 1.43 -0.54 -2.85 118.68 124.62 1dqn s LEU 69 Ca 0.25 2.19 0.05 0.00 -1.03 0.00 0.00 54.13 55.58 1dqn s LEU 69 Cb -0.14 -4.57 -0.21 0.00 0.03 0.00 0.00 46.19 41.30 1dqn s LEU 69 CO 0.17 -1.65 -0.01 0.41 0.23 0.00 0.00 176.35 175.50 1dqn n THR 70 N -2.05 1.52 -0.33 5.49 -1.04 -1.26 -4.84 114.28 111.78 1dqn n THR 70 Ca 0.12 -0.67 0.32 0.00 -2.04 0.00 0.00 64.05 61.78 1dqn n THR 70 Cb 0.51 -1.21 0.68 0.00 -1.82 0.00 0.00 70.33 68.49 1dqn n THR 70 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1dqn h GLY 71 N 2.44 0.37 1.48 3.41 0.00 -1.73 -2.26 103.07 106.78 1dqn h GLY 71 Ca -0.53 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 46.74 1dqn h GLY 71 CO -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 176.54 176.46 1dqn n ALA 72 N -2.68 1.97 -0.36 3.60 0.00 -1.13 -3.78 120.51 118.13 1dqn n ALA 72 Ca 0.26 -0.09 -0.00 0.00 0.00 0.00 0.00 53.44 53.61 1dqn n ALA 72 Cb 1.16 -1.28 0.15 0.00 0.00 0.00 0.00 19.45 19.48 1dqn n ALA 72 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 1dqn h TYR 73 N 0.00 1.22 0.21 0.00 -0.00 -1.68 0.67 116.97 117.39 1dqn h TYR 73 Ca 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 58.73 58.75 1dqn h TYR 73 Cb 0.14 -0.41 0.00 0.00 0.00 0.00 0.00 36.73 36.46 1dqn h TYR 73 CO 0.00 0.72 -0.10 1.25 -0.00 0.00 0.00 178.16 180.03 1dqn h LEU 74 N 1.27 -0.24 -0.79 0.10 6.46 -1.85 -2.00 115.31 118.27 1dqn h LEU 74 Ca 0.38 -0.29 0.07 0.00 -0.12 0.00 0.00 57.88 57.92 1dqn h LEU 74 Cb -0.05 0.06 -0.06 0.00 -0.73 0.00 0.00 40.66 39.88 1dqn h LEU 74 CO -0.11 0.24 0.46 0.22 -0.62 0.00 0.00 178.44 178.64 1dqn h TYR 75 N -0.80 0.85 -0.60 1.25 3.20 -1.77 -0.82 116.97 118.29 1dqn h TYR 75 Ca -0.03 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.87 1dqn h TYR 75 Cb 0.51 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.49 1dqn h TYR 75 CO 0.06 0.40 0.40 0.00 -1.64 0.00 0.00 178.16 177.38 1dqn h ALA 76 N 1.41 1.57 -0.14 1.82 0.00 -0.85 0.82 119.26 123.89 1dqn h ALA 76 Ca 0.36 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 55.11 1dqn h ALA 76 Cb 0.24 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1dqn h ALA 76 CO -0.20 0.40 -0.43 0.66 0.00 0.00 0.00 179.25 179.68 1dqn h SER 77 N 0.82 0.36 1.75 0.00 4.64 -0.41 -0.80 113.55 119.90 1dqn h SER 77 Ca 0.22 -0.16 -0.04 0.00 -0.47 0.00 0.00 61.79 61.34 1dqn h SER 77 Cb -0.09 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 61.89 1dqn h SER 77 CO -0.05 0.74 -0.25 -0.07 -0.87 0.00 0.00 176.83 176.34 1dqn h LEU 78 N 0.28 0.00 0.00 5.97 3.38 -0.07 -3.27 115.31 121.60 1dqn h LEU 78 Ca 0.02 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 1dqn h LEU 78 Cb 0.87 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 1dqn h LEU 78 CO 0.07 0.19 -0.61 0.25 0.09 0.00 0.00 178.44 178.43 1dqn h LEU 79 N 0.00 0.00 -1.29 1.67 5.85 -0.71 -3.41 115.31 117.42 1dqn h LEU 79 Ca -0.01 -0.21 0.10 0.00 0.84 0.00 0.00 57.88 58.60 1dqn h LEU 79 Cb 1.15 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.12 1dqn h LEU 79 CO 0.02 0.94 0.54 0.71 -0.34 0.00 0.00 178.44 180.32 1dqn h THR 80 N -1.00 0.95 0.00 1.05 1.35 -1.31 -1.74 112.91 112.21 1dqn h THR 80 Ca -0.10 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 1dqn h THR 80 Cb 0.69 0.09 0.00 0.00 -1.73 0.00 0.00 68.15 67.20 1dqn h THR 80 CO -0.06 0.14 0.00 -0.37 -0.25 0.00 0.00 175.52 174.98 1dqn h VAL 81 N 0.79 0.00 -0.02 6.82 -1.51 -1.78 -2.08 116.25 118.46 1dqn h VAL 81 Ca 0.39 -0.06 0.00 0.00 -1.23 0.00 0.00 66.70 65.80 1dqn h VAL 81 Cb 0.45 0.70 0.00 0.00 -2.13 0.00 0.00 31.29 30.31 1dqn h VAL 81 CO -0.16 0.00 -0.13 1.41 -1.23 0.00 0.00 177.57 177.46 1dqn n HIS 82 N -2.44 0.00 -2.59 5.19 -0.00 -0.66 -4.96 115.22 109.76 1dqn n HIS 82 Ca -0.01 0.00 -0.40 0.00 -0.00 0.00 0.00 57.72 57.31 1dqn n HIS 82 Cb 0.09 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 30.03 1dqn n HIS 82 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1dqn s LEU 83 N -1.63 4.56 -0.02 2.41 1.43 -0.79 -4.85 118.68 119.80 1dqn s LEU 83 Ca 0.17 2.13 0.03 0.00 -1.03 0.00 0.00 54.13 55.43 1dqn s LEU 83 Cb 0.13 -3.67 0.06 0.00 0.03 0.00 0.00 46.19 42.75 1dqn s LEU 83 CO 0.28 -0.05 1.04 0.35 0.23 0.00 0.00 176.35 178.20 1dqn n THR 84 N 1.20 1.13 -4.34 5.49 -2.24 -1.26 -5.02 114.28 109.24 1dqn n THR 84 Ca -0.01 -1.18 -0.24 0.00 -2.27 0.00 0.00 64.05 60.36 1dqn n THR 84 Cb 0.46 0.39 -0.08 0.00 -2.10 0.00 0.00 70.33 69.00 1dqn n THR 84 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 1dqn s PHE 85 N -1.27 2.55 0.30 4.78 -0.71 -1.26 -5.05 117.98 117.32 1dqn s PHE 85 Ca 0.06 -0.32 -0.29 0.00 -1.04 0.00 0.00 56.93 55.34 1dqn s PHE 85 Cb 0.05 -1.25 -0.10 0.00 -1.21 0.00 0.00 43.02 40.51 1dqn s PHE 85 CO 0.02 0.59 1.16 -1.25 -1.34 0.00 0.00 175.22 174.40 1dqn s PRO 86 N -3.65 4.55 0.12 1.99 0.04 -1.26 -4.97 135.00 131.81 1dqn s PRO 86 Ca 0.32 1.93 -0.25 0.00 0.04 0.00 0.00 61.00 63.04 1dqn s PRO 86 Cb -0.04 -3.15 0.07 0.00 0.04 0.00 0.00 34.50 31.43 1dqn s PRO 86 CO 0.19 0.09 0.73 1.52 0.04 0.00 0.00 177.00 179.57 1dqn s TYR 87 N -1.16 -0.40 0.22 0.56 -0.85 -1.26 -1.08 117.35 113.38 1dqn s TYR 87 Ca 0.46 0.18 0.09 0.00 -0.52 0.00 0.00 57.07 57.28 1dqn s TYR 87 Cb -0.34 0.58 -0.04 0.00 0.38 0.00 0.00 41.96 42.53 1dqn s TYR 87 CO 0.45 -0.80 -0.06 0.95 -1.52 0.00 0.00 175.55 174.56 1dqn s THR 88 N -3.54 3.27 -0.05 -3.49 -4.23 -0.51 -4.87 115.64 102.22 1dqn s THR 88 Ca 0.04 -1.80 0.03 0.00 -1.18 0.00 0.00 61.69 58.79 1dqn s THR 88 Cb -0.02 -2.68 0.01 0.00 1.34 0.00 0.00 72.50 71.15 1dqn s THR 88 CO -0.08 -0.23 -0.13 -0.22 -0.54 0.00 0.00 174.62 173.42 1dqn s LEU 89 N -3.21 1.77 0.02 4.79 2.96 -1.26 -1.14 118.68 122.61 1dqn s LEU 89 Ca 0.28 -0.29 0.02 0.00 -0.22 0.00 0.00 54.13 53.92 1dqn s LEU 89 Cb -0.08 -0.80 -0.01 0.00 0.50 0.00 0.00 46.19 45.80 1dqn s LEU 89 CO 0.17 0.08 -0.06 -1.00 -1.32 0.00 0.00 176.35 174.23 1dqn s HIS 90 N 0.34 0.49 -0.07 5.38 3.76 -0.10 -4.99 115.29 120.10 1dqn s HIS 90 Ca -0.08 -0.32 0.02 0.00 -0.15 0.00 0.00 55.06 54.53 1dqn s HIS 90 Cb -0.13 -0.30 -0.02 0.00 1.11 0.00 0.00 32.58 33.24 1dqn s HIS 90 CO 0.02 -0.06 -0.13 -0.06 -0.85 0.00 0.00 174.74 173.66 1dqn s PHE 91 N -0.84 2.75 -0.10 1.40 0.40 -1.26 -0.27 117.98 120.05 1dqn s PHE 91 Ca -0.06 -0.26 0.04 0.00 -0.60 0.00 0.00 56.93 56.05 1dqn s PHE 91 Cb -0.06 -1.69 0.00 0.00 0.51 0.00 0.00 43.02 41.78 1dqn s PHE 91 CO -0.00 0.10 -0.23 0.14 0.70 0.00 0.00 175.22 175.93 1dqn s VAL 92 N -0.48 1.98 -0.48 -0.44 -7.23 -0.56 -4.94 120.40 108.26 1dqn s VAL 92 Ca 0.06 -0.97 0.03 0.00 -1.81 0.00 0.00 61.98 59.29 1dqn s VAL 92 Cb -0.12 -1.72 0.59 0.00 0.56 0.00 0.00 36.38 35.69 1dqn s VAL 92 CO 0.02 0.54 1.88 2.29 -0.31 0.00 0.00 175.10 179.52 1dqn n LYS 93 N 3.55 2.35 -0.81 4.82 2.85 -1.26 -1.47 118.16 128.20 1dqn n LYS 93 Ca -0.19 -3.13 -0.29 0.00 -1.05 0.00 0.00 58.31 53.64 1dqn n LYS 93 Cb 0.53 -2.17 0.03 0.00 -0.65 0.00 0.00 35.03 32.77 1dqn n LYS 93 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 177.40 178.68 1dqn n VAL 94 N -1.08 0.00 -4.92 0.58 0.24 -1.26 -4.97 118.33 106.91 1dqn n VAL 94 Ca 0.57 -0.37 -0.33 0.00 -2.04 0.00 0.00 64.34 62.18 1dqn n VAL 94 Cb 1.34 0.00 -0.14 0.00 -1.47 0.00 0.00 33.84 33.57 1dqn n VAL 94 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1dqn s SER 95 N -0.81 3.92 -0.28 -1.34 0.15 -0.99 -4.92 113.70 109.43 1dqn s SER 95 Ca 0.32 -0.24 -0.20 0.00 0.70 0.00 0.00 55.95 56.53 1dqn s SER 95 Cb -0.13 -0.88 -0.01 0.00 -1.71 0.00 0.00 66.02 63.29 1dqn s SER 95 CO 0.66 0.32 0.61 -0.55 1.20 0.00 0.00 173.24 175.48 1dqn s SER 96 N -0.60 6.51 -0.35 5.45 0.15 -1.26 -0.65 113.70 122.94 1dqn s SER 96 Ca 0.09 0.52 -0.08 0.00 0.70 0.00 0.00 55.95 57.17 1dqn s SER 96 Cb -0.11 -2.32 0.03 0.00 -1.71 0.00 0.00 66.02 61.91 1dqn s SER 96 CO 0.01 -0.41 0.15 -0.47 1.20 0.00 0.00 173.24 173.71 1dqn s TYR 97 N 2.52 3.25 -0.75 3.44 6.14 0.16 -4.96 117.35 127.14 1dqn s TYR 97 Ca 0.25 -1.22 -0.24 0.00 0.64 0.00 0.00 57.07 56.50 1dqn s TYR 97 Cb -0.15 -2.34 0.06 0.00 0.42 0.00 0.00 41.96 39.95 1dqn s TYR 97 CO 0.10 -0.69 1.13 0.15 0.64 0.00 0.00 175.55 176.88 1dqn s LYS 98 N 1.47 3.24 0.58 4.97 3.01 -1.26 -1.07 119.74 130.68 1dqn s LYS 98 Ca -0.00 -0.78 -0.09 0.00 -1.01 0.00 0.00 55.97 54.09 1dqn s LYS 98 Cb -0.19 -4.41 0.13 0.00 -1.01 0.00 0.00 37.83 32.35 1dqn s LYS 98 CO 0.04 -1.96 0.79 0.41 0.51 0.00 0.00 175.35 175.14 1dqn n GLY 99 N 5.53 -1.01 0.13 -3.33 0.00 0.12 -4.98 105.19 101.65 1dqn n GLY 99 Ca 0.05 -1.75 0.12 0.00 0.00 0.00 0.00 46.02 44.45 1dqn n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dqn h THR 100 N -1.31 0.00 0.00 2.61 1.03 -2.04 -3.37 112.91 109.83 1dqn h THR 100 Ca -0.26 -0.77 -0.17 0.00 -0.01 0.00 0.00 66.41 65.21 1dqn h THR 100 Cb 0.74 1.53 -0.03 0.00 -1.07 0.00 0.00 68.15 69.31 1dqn h THR 100 CO 0.19 0.00 -1.65 0.54 -0.01 0.00 0.00 175.52 174.60 1dqn n ARG 101 N -2.58 2.32 -3.63 0.00 1.74 -1.26 -5.09 116.66 108.17 1dqn n ARG 101 Ca 0.03 -0.01 -0.08 0.00 -0.77 0.00 0.00 57.85 57.02 1dqn n ARG 101 Cb 0.49 -1.25 -0.02 0.00 -1.02 0.00 0.00 32.46 30.67 1dqn n ARG 101 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 1dqn s GLN 102 N -2.26 1.25 -0.20 5.56 -2.07 -1.26 -5.15 119.66 115.54 1dqn s GLN 102 Ca -0.05 -0.59 -0.09 0.00 -1.82 0.00 0.00 55.36 52.81 1dqn s GLN 102 Cb 0.03 0.49 -0.04 0.00 -1.09 0.00 0.00 33.01 32.40 1dqn s GLN 102 CO 0.39 -0.56 0.10 -2.00 -1.32 0.00 0.00 175.29 171.90 1dqn s GLU 103 N -3.50 4.03 0.07 9.60 2.12 -1.26 -0.70 118.70 129.06 1dqn s GLU 103 Ca 0.07 -0.31 0.08 0.00 0.36 0.00 0.00 54.97 55.18 1dqn s GLU 103 Cb -0.02 -3.33 -0.03 0.00 0.26 0.00 0.00 34.13 31.01 1dqn s GLU 103 CO -0.03 0.22 -0.22 -1.12 -0.54 0.00 0.00 175.26 173.56 1dqn s SER 104 N 0.56 2.71 -0.28 -1.70 0.01 -0.23 -4.74 113.70 110.02 1dqn s SER 104 Ca 0.05 -0.61 -0.19 0.00 1.31 0.00 0.00 55.95 56.52 1dqn s SER 104 Cb -0.12 -0.20 -0.02 0.00 0.21 0.00 0.00 66.02 65.89 1dqn s SER 104 CO 0.01 0.15 0.56 -0.69 0.41 0.00 0.00 173.24 173.68 1dqn s VAL 105 N -0.93 5.02 -0.38 3.43 1.01 -1.26 -0.67 120.40 126.61 1dqn s VAL 105 Ca 0.09 0.86 -0.16 0.00 0.00 0.00 0.00 61.98 62.76 1dqn s VAL 105 Cb -0.09 -3.90 0.01 0.00 0.00 0.00 0.00 36.38 32.39 1dqn s VAL 105 CO 0.03 -0.02 0.38 -0.69 0.00 0.00 0.00 175.10 174.80 1dqn s VAL 106 N 2.43 5.16 0.56 2.92 1.01 0.18 -4.84 120.40 127.80 1dqn s VAL 106 Ca 0.23 -0.24 -0.02 0.00 0.00 0.00 0.00 61.98 61.95 1dqn s VAL 106 Cb -0.15 -3.92 0.02 0.00 0.00 0.00 0.00 36.38 32.33 1dqn s VAL 106 CO 0.10 -0.25 0.82 -0.36 0.00 0.00 0.00 175.10 175.41 1dqn s PHE 107 N 2.00 3.10 0.09 5.22 0.40 -1.26 -2.34 117.98 125.18 1dqn s PHE 107 Ca 0.10 0.33 -0.30 0.00 -0.60 0.00 0.00 56.93 56.47 1dqn s PHE 107 Cb -0.17 -2.68 -0.06 0.00 0.51 0.00 0.00 43.02 40.62 1dqn s PHE 107 CO 0.12 -0.78 1.08 0.34 0.70 0.00 0.00 175.22 176.68 1dqn s ASP 108 N -4.34 7.27 0.24 1.36 2.15 -1.26 -4.92 116.67 117.17 1dqn s ASP 108 Ca 0.54 1.91 -0.09 0.00 0.43 0.00 0.00 52.55 55.34 1dqn s ASP 108 Cb -0.10 -2.59 0.38 0.00 -0.30 0.00 0.00 42.92 40.31 1dqn s ASP 108 CO 0.41 -0.29 1.63 -0.33 -0.17 0.00 0.00 175.17 176.42 1dqn h GLU 109 N 6.14 0.06 -0.58 4.34 5.08 -2.00 -0.75 114.58 126.87 1dqn h GLU 109 Ca -0.42 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 57.91 1dqn h GLU 109 Cb 1.21 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.42 1dqn h GLU 109 CO 0.76 0.04 0.26 0.93 -1.00 0.00 0.00 179.01 180.00 1dqn h GLU 110 N 0.07 0.84 -0.50 2.33 5.08 -2.00 -1.62 114.58 118.78 1dqn h GLU 110 Ca 0.38 -0.14 0.01 0.00 -1.00 0.00 0.00 59.36 58.62 1dqn h GLU 110 Cb 0.65 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.73 1dqn h GLU 110 CO -0.68 0.71 0.32 -0.44 -1.00 0.00 0.00 179.01 177.91 1dqn h ASP 111 N 0.79 0.54 -0.66 1.42 3.32 -1.56 -1.89 116.42 118.38 1dqn h ASP 111 Ca 0.20 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.18 1dqn h ASP 111 Cb 0.16 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.55 1dqn h ASP 111 CO -0.02 0.38 0.16 0.25 -1.72 0.00 0.00 179.24 178.29 1dqn h LEU 112 N 0.64 0.99 -0.07 1.55 6.46 -1.11 -2.25 115.31 121.52 1dqn h LEU 112 Ca 0.19 -0.23 0.02 0.00 -0.12 0.00 0.00 57.88 57.74 1dqn h LEU 112 Cb -0.03 -0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 39.61 1dqn h LEU 112 CO -0.06 0.97 -0.08 0.11 -0.62 0.00 0.00 178.44 178.76 1dqn h LYS 113 N 0.97 -0.10 -0.30 1.25 1.79 -0.96 -2.19 116.57 117.03 1dqn h LYS 113 Ca 0.21 0.01 0.04 0.00 -2.18 0.00 0.00 60.65 58.72 1dqn h LYS 113 Cb 0.36 0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 31.00 1dqn h LYS 113 CO 0.00 -0.07 0.09 1.96 -1.08 0.00 0.00 179.45 180.36 1dqn h GLN 114 N -0.10 0.22 -0.39 3.15 1.08 -1.19 -3.08 115.11 114.79 1dqn h GLN 114 Ca 0.06 -0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.23 1dqn h GLN 114 Cb 0.19 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.55 1dqn h GLN 114 CO -0.14 0.14 0.17 -0.07 -0.95 0.00 0.00 178.83 177.99 1dqn h LEU 115 N 0.22 0.53 0.00 1.46 3.38 -1.25 -2.58 115.31 117.07 1dqn h LEU 115 Ca 0.14 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1dqn h LEU 115 Cb 0.11 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1dqn h LEU 115 CO -0.15 0.53 0.00 0.29 0.09 0.00 0.00 178.44 179.20 1dqn n LYS 116 N -4.68 0.00 0.03 1.13 5.02 -0.84 -1.53 118.16 117.29 1dqn n LYS 116 Ca -0.00 0.46 0.03 0.00 -2.02 0.00 0.00 58.31 56.77 1dqn n LYS 116 Cb 0.13 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.55 1dqn n LYS 116 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1dqn n GLU 117 N -1.46 0.63 -2.84 1.97 1.02 -0.97 -4.93 120.64 114.06 1dqn n GLU 117 Ca 0.00 0.13 -0.40 0.00 -0.02 0.00 0.00 57.16 56.87 1dqn n GLU 117 Cb 0.00 -1.75 -0.05 0.00 -0.02 0.00 0.00 31.44 29.62 1dqn n GLU 117 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1dqn s LYS 118 N -3.04 4.67 0.08 3.49 -0.14 -0.58 -4.98 119.74 119.23 1dqn s LYS 118 Ca -0.04 1.32 -0.19 0.00 -1.36 0.00 0.00 55.97 55.71 1dqn s LYS 118 Cb 0.09 -3.33 -0.09 0.00 -1.68 0.00 0.00 37.83 32.82 1dqn s LYS 118 CO 0.82 0.38 1.49 0.00 -0.76 0.00 0.00 175.35 177.27 1dqn h ARG 119 N 4.98 0.44 -4.73 1.68 3.08 -1.91 -3.41 114.38 114.52 1dqn h ARG 119 Ca -0.44 -0.16 -0.69 0.00 0.07 0.00 0.00 59.98 58.76 1dqn h ARG 119 Cb 1.21 -0.03 -0.29 0.00 0.08 0.00 0.00 29.97 30.93 1dqn h ARG 119 CO 0.69 0.66 -0.63 -1.21 -1.07 0.00 0.00 179.97 178.41 1dqn s GLU 120 N -4.83 2.67 -0.09 0.04 0.41 -1.26 -4.97 118.70 110.66 1dqn s GLU 120 Ca -0.14 -1.13 0.01 0.00 -0.41 0.00 0.00 54.97 53.30 1dqn s GLU 120 Cb 0.07 -3.37 0.02 0.00 -1.78 0.00 0.00 34.13 29.07 1dqn s GLU 120 CO 0.75 -0.61 -0.11 0.08 -0.49 0.00 0.00 175.26 174.88 1dqn s VAL 121 N 1.39 1.15 -0.14 2.63 1.01 -1.26 -0.95 120.40 124.23 1dqn s VAL 121 Ca -0.02 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 61.53 1dqn s VAL 121 Cb -0.19 -1.09 0.02 0.00 0.00 0.00 0.00 36.38 35.12 1dqn s VAL 121 CO 0.02 0.37 -0.14 -0.69 0.00 0.00 0.00 175.10 174.66 1dqn s VAL 122 N 1.05 1.54 -0.10 2.92 1.01 -0.27 -0.11 120.40 126.44 1dqn s VAL 122 Ca -0.07 -0.62 -0.24 0.00 0.00 0.00 0.00 61.98 61.05 1dqn s VAL 122 Cb -0.15 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.77 1dqn s VAL 122 CO -0.01 0.45 0.75 -0.76 0.00 0.00 0.00 175.10 175.53 1dqn s LEU 123 N 1.41 4.27 -0.18 3.92 1.43 0.38 -1.07 118.68 128.84 1dqn s LEU 123 Ca 0.03 1.19 -0.06 0.00 -1.03 0.00 0.00 54.13 54.27 1dqn s LEU 123 Cb -0.13 -3.15 -0.03 0.00 0.03 0.00 0.00 46.19 42.91 1dqn s LEU 123 CO -0.09 -0.21 0.02 -0.63 0.23 0.00 0.00 176.35 175.67 1dqn s ILE 124 N 1.25 4.30 -0.02 -0.59 1.01 0.68 -0.54 121.20 127.30 1dqn s ILE 124 Ca 0.38 -0.20 -0.05 0.00 0.00 0.00 0.00 60.65 60.78 1dqn s ILE 124 Cb -0.18 -2.93 0.00 0.00 0.01 0.00 0.00 42.46 39.37 1dqn s ILE 124 CO 0.17 0.45 0.12 -0.62 0.00 0.00 0.00 174.94 175.06 1dqn s ASP 125 N 0.60 -0.03 0.24 3.58 3.68 -0.70 -1.55 116.67 122.49 1dqn s ASP 125 Ca 0.01 -0.01 0.13 0.00 2.13 0.00 0.00 52.55 54.80 1dqn s ASP 125 Cb -0.14 0.23 0.07 0.00 -1.45 0.00 0.00 42.92 41.63 1dqn s ASP 125 CO 0.02 -0.21 1.44 1.05 0.13 0.00 0.00 175.17 177.60 1dqn h GLU 126 N 5.09 0.00 -2.42 4.34 9.09 -1.86 -2.58 114.58 126.24 1dqn h GLU 126 Ca -0.28 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 59.03 1dqn h GLU 126 Cb 1.20 0.00 -0.28 0.00 -1.65 0.00 0.00 28.75 28.02 1dqn h GLU 126 CO 0.41 0.66 -0.38 -0.47 0.05 0.00 0.00 179.01 179.28 1dqn s TYR 127 N -3.00 -0.82 -0.39 2.06 5.04 -1.26 -1.42 117.35 117.56 1dqn s TYR 127 Ca 0.02 1.46 -0.13 0.00 -2.44 0.00 0.00 57.07 55.98 1dqn s TYR 127 Cb 0.09 0.28 0.02 0.00 0.35 0.00 0.00 41.96 42.70 1dqn s TYR 127 CO 0.76 -0.52 0.26 0.08 -1.34 0.00 0.00 175.55 174.79 1dqn s VAL 128 N 2.61 4.98 0.00 3.14 1.01 -0.55 -4.98 120.40 126.62 1dqn s VAL 128 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.28 1dqn s VAL 128 Cb -0.12 -3.76 0.00 0.00 0.00 0.00 0.00 36.38 32.50 1dqn s VAL 128 CO -0.13 -0.25 0.00 -0.67 0.00 0.00 0.00 175.10 174.05 1dqn n ASP 129 N 5.09 0.00 0.23 3.32 -0.08 -1.26 -1.13 116.55 122.71 1dqn n ASP 129 Ca -0.11 0.00 0.07 0.00 -1.51 0.00 0.00 54.79 53.24 1dqn n ASP 129 Cb 0.47 0.00 0.53 0.00 2.34 0.00 0.00 41.12 44.46 1dqn n ASP 129 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 1dqn h SER 130 N 0.00 0.00 0.00 1.67 4.64 -2.01 -3.43 113.55 114.42 1dqn h SER 130 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1dqn h SER 130 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1dqn h SER 130 CO 0.00 0.23 0.00 0.61 -0.87 0.00 0.00 176.83 176.80 1dqn n GLY 131 N -0.63 1.62 0.37 -0.77 0.00 -1.26 -4.91 105.19 99.60 1dqn n GLY 131 Ca -0.02 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.11 1dqn n GLY 131 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1dqn h HIS 132 N 0.00 0.91 0.54 1.61 3.86 -1.95 0.41 115.15 120.52 1dqn h HIS 132 Ca 0.00 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.21 1dqn h HIS 132 Cb 0.00 -0.29 0.01 0.00 1.06 0.00 0.00 27.41 28.19 1dqn h HIS 132 CO 0.00 0.34 -0.26 1.15 0.86 0.00 0.00 177.93 180.02 1dqn h THR 133 N 0.77 0.46 -0.05 2.45 2.02 -1.91 -1.32 112.91 115.34 1dqn h THR 133 Ca 0.46 -0.09 -0.11 0.00 0.77 0.00 0.00 66.41 67.44 1dqn h THR 133 Cb 0.66 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.56 1dqn h THR 133 CO -0.22 0.02 -0.47 0.16 0.37 0.00 0.00 175.52 175.37 1dqn h ILE 134 N -0.78 1.34 -0.76 3.11 3.07 -1.86 -1.90 117.51 119.73 1dqn h ILE 134 Ca -0.07 -1.64 0.02 0.00 1.55 0.00 0.00 64.86 64.71 1dqn h ILE 134 Cb 0.58 1.82 -0.04 0.00 -0.27 0.00 0.00 36.82 38.91 1dqn h ILE 134 CO 0.12 0.48 0.49 0.15 -1.05 0.00 0.00 178.15 178.34 1dqn h PHE 135 N 0.10 0.93 0.17 0.16 3.57 -0.06 0.50 116.94 122.31 1dqn h PHE 135 Ca 0.00 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 1dqn h PHE 135 Cb 0.87 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 39.30 1dqn h PHE 135 CO 0.01 0.56 -0.08 1.03 -2.23 0.00 0.00 178.31 177.60 1dqn h SER 136 N 0.99 -0.20 -0.92 0.41 0.87 -0.98 -2.69 113.55 111.03 1dqn h SER 136 Ca 0.29 -0.28 0.09 0.00 -1.23 0.00 0.00 61.79 60.66 1dqn h SER 136 Cb -0.06 0.05 -0.06 0.00 -0.44 0.00 0.00 62.40 61.89 1dqn h SER 136 CO -0.08 0.20 0.59 0.40 -0.53 0.00 0.00 176.83 177.41 1dqn h ILE 137 N -0.62 1.01 -0.30 2.23 2.04 -1.09 -2.41 117.51 118.36 1dqn h ILE 137 Ca -0.02 -0.33 0.01 0.00 1.00 0.00 0.00 64.86 65.51 1dqn h ILE 137 Cb 0.46 -0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.47 1dqn h ILE 137 CO 0.04 0.18 0.19 -0.61 0.00 0.00 0.00 178.15 177.94 1dqn h GLN 138 N 0.97 0.37 0.00 2.37 5.75 0.07 0.41 115.11 125.05 1dqn h GLN 138 Ca 0.42 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.89 1dqn h GLN 138 Cb 0.32 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 28.79 1dqn h GLN 138 CO -0.17 0.25 0.00 -0.85 -2.65 0.00 0.00 178.83 175.40 1dqn n GLU 139 N -4.90 0.15 -0.07 1.69 0.28 -0.94 -0.80 120.64 116.06 1dqn n GLU 139 Ca -0.01 0.36 -0.14 0.00 -0.16 0.00 0.00 57.16 57.21 1dqn n GLU 139 Cb 0.03 -1.78 -0.14 0.00 1.43 0.00 0.00 31.44 30.98 1dqn n GLU 139 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1dqn n GLN 140 N -2.07 0.68 -3.43 3.44 6.02 -0.76 -4.56 117.38 116.70 1dqn n GLN 140 Ca 0.03 0.15 -0.26 0.00 -0.01 0.00 0.00 57.00 56.91 1dqn n GLN 140 Cb 0.23 -1.62 -0.09 0.00 1.02 0.00 0.00 30.24 29.79 1dqn n GLN 140 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1dqn n ILE 141 N -3.10 0.74 -0.12 5.09 5.41 0.14 -4.97 119.36 122.54 1dqn n ILE 141 Ca -0.33 -4.51 0.28 0.00 1.00 0.00 0.00 62.75 59.19 1dqn n ILE 141 Cb 1.07 -2.00 0.69 0.00 -0.71 0.00 0.00 39.64 38.69 1dqn n ILE 141 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 1dqn h LYS 142 N 4.57 0.00 -0.02 0.38 1.57 -1.18 -0.21 116.57 121.68 1dqn h LYS 142 Ca 0.16 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1dqn h LYS 142 Cb 0.78 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.09 1dqn h LYS 142 CO 0.63 0.00 -0.02 -2.39 -0.57 0.00 0.00 179.45 177.10 1dqn n HIS 143 N -3.82 0.00 -1.89 -1.35 1.44 -1.26 -4.94 115.22 103.39 1dqn n HIS 143 Ca 0.17 0.00 -0.41 0.00 -2.01 0.00 0.00 57.72 55.47 1dqn n HIS 143 Cb 1.02 -0.01 -0.01 0.00 0.12 0.00 0.00 29.99 31.12 1dqn n HIS 143 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1dqn s ALA 144 N -2.04 3.59 0.36 1.59 0.00 -0.09 -4.65 121.76 120.51 1dqn s ALA 144 Ca 0.36 1.48 0.07 0.00 0.00 0.00 0.00 51.96 53.87 1dqn s ALA 144 Cb 0.21 -3.58 -0.02 0.00 0.00 0.00 0.00 23.12 19.73 1dqn s ALA 144 CO 0.35 -0.92 0.39 0.15 0.00 0.00 0.00 175.76 175.73 1dqn s LYS 145 N -1.61 2.84 0.01 0.00 1.02 0.84 -4.65 119.74 118.20 1dqn s LYS 145 Ca 0.54 -1.23 0.07 0.00 0.02 0.00 0.00 55.97 55.38 1dqn s LYS 145 Cb -0.45 -2.61 -0.02 0.00 -0.52 0.00 0.00 37.83 34.23 1dqn s LYS 145 CO 0.57 0.00 -0.23 0.42 -0.92 0.00 0.00 175.35 175.19 1dqn s ILE 146 N -2.29 1.81 -0.24 2.17 -1.09 -0.01 -0.47 121.20 121.08 1dqn s ILE 146 Ca 0.45 -1.11 -0.03 0.00 -2.23 0.00 0.00 60.65 57.73 1dqn s ILE 146 Cb -0.07 -1.53 0.08 0.00 -1.58 0.00 0.00 42.46 39.35 1dqn s ILE 146 CO 0.29 0.39 0.09 0.00 -1.23 0.00 0.00 174.94 174.48 1dqn s SER 148 N 1.95 2.08 0.08 0.00 0.15 -0.35 -1.72 113.70 115.90 1dqn s SER 148 Ca 0.04 -0.34 -0.20 0.00 0.70 0.00 0.00 55.95 56.16 1dqn s SER 148 Cb -0.17 -0.53 -0.09 0.00 -1.71 0.00 0.00 66.02 63.52 1dqn s SER 148 CO -0.19 0.16 1.57 0.00 1.20 0.00 0.00 173.24 175.97 1dqn s PHE 150 N -5.25 1.82 -0.06 0.00 0.40 -0.51 -0.90 117.98 113.48 1dqn s PHE 150 Ca -0.14 -0.37 0.00 0.00 -0.60 0.00 0.00 56.93 55.83 1dqn s PHE 150 Cb 0.07 -1.10 0.02 0.00 0.51 0.00 0.00 43.02 42.52 1dqn s PHE 150 CO 0.72 0.07 -0.04 0.08 0.70 0.00 0.00 175.22 176.75 1dqn s VAL 151 N -0.75 0.55 0.11 -0.44 1.01 -0.52 -1.48 120.40 118.88 1dqn s VAL 151 Ca 0.08 -0.09 -0.26 0.00 0.00 0.00 0.00 61.98 61.70 1dqn s VAL 151 Cb -0.09 -0.60 -0.08 0.00 0.00 0.00 0.00 36.38 35.62 1dqn s VAL 151 CO 0.01 0.25 1.64 0.50 0.00 0.00 0.00 175.10 177.50 1dqn h LYS 152 N 7.50 -0.42 -1.52 2.72 1.63 -1.39 -3.28 116.57 121.81 1dqn h LYS 152 Ca -0.33 0.03 -0.17 0.00 -0.85 0.00 0.00 60.65 59.33 1dqn h LYS 152 Cb 1.15 0.10 -0.26 0.00 -0.60 0.00 0.00 32.23 32.61 1dqn h LYS 152 CO 0.42 -0.28 -0.53 0.34 -3.45 0.00 0.00 179.45 175.95 1dqn s ASP 153 N -4.85 -0.09 0.19 4.20 3.68 -1.26 -1.08 116.67 117.45 1dqn s ASP 153 Ca -0.15 -0.63 -0.12 0.00 2.13 0.00 0.00 52.55 53.78 1dqn s ASP 153 Cb 0.08 1.28 0.15 0.00 -1.45 0.00 0.00 42.92 42.99 1dqn s ASP 153 CO 0.65 -0.29 1.79 0.58 0.13 0.00 0.00 175.17 178.03 1dqn h VAL 154 N 5.70 0.96 -0.43 1.11 2.07 -1.96 -2.08 116.25 121.62 1dqn h VAL 154 Ca -0.02 -0.18 0.09 0.00 0.82 0.00 0.00 66.70 67.40 1dqn h VAL 154 Cb 1.13 0.38 -0.09 0.00 -1.52 0.00 0.00 31.29 31.19 1dqn h VAL 154 CO 0.20 0.10 -0.17 0.44 0.02 0.00 0.00 177.57 178.16 1dqn h ASP 155 N 0.54 -0.60 -0.85 0.57 3.45 -1.98 -1.55 116.42 115.99 1dqn h ASP 155 Ca 0.24 0.15 0.03 0.00 0.43 0.00 0.00 57.03 57.88 1dqn h ASP 155 Cb 0.14 0.34 -0.05 0.00 -0.56 0.00 0.00 39.33 39.20 1dqn h ASP 155 CO -0.16 -0.21 0.55 0.00 -1.57 0.00 0.00 179.24 177.85 1dqn h ALA 156 N 1.26 1.12 -0.63 3.45 0.00 -1.82 -2.79 119.26 119.85 1dqn h ALA 156 Ca 0.21 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1dqn h ALA 156 Cb 0.40 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1dqn h ALA 156 CO -0.49 0.38 0.22 0.82 0.00 0.00 0.00 179.25 180.19 1dqn h ILE 157 N 1.06 1.24 0.00 0.00 2.04 -0.69 -2.31 117.51 118.85 1dqn h ILE 157 Ca 0.34 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 65.41 1dqn h ILE 157 Cb 0.01 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 36.66 1dqn h ILE 157 CO -0.12 0.31 0.00 0.29 0.00 0.00 0.00 178.15 178.63 1dqn n LYS 158 N -4.40 0.08 0.02 2.37 4.01 -0.77 -2.67 118.16 116.79 1dqn n LYS 158 Ca 0.04 0.43 0.07 0.00 -0.51 0.00 0.00 58.31 58.34 1dqn n LYS 158 Cb 0.19 -1.68 0.49 0.00 -0.51 0.00 0.00 35.03 33.51 1dqn n LYS 158 CO 0.00 0.00 0.00 0.87 -1.11 0.00 0.00 177.40 177.16 1dqn h LYS 159 N 0.00 0.41 -6.22 1.97 1.79 -1.30 -3.38 116.57 109.83 1dqn h LYS 159 Ca 0.00 -0.02 -0.56 0.00 -2.18 0.00 0.00 60.65 57.88 1dqn h LYS 159 Cb 0.18 -0.09 -0.04 0.00 -1.58 0.00 0.00 32.23 30.70 1dqn h LYS 159 CO 0.00 0.27 0.75 -1.01 -1.08 0.00 0.00 179.45 178.38 1dqn s HIS 160 N -5.39 3.17 0.49 -1.35 3.76 -1.09 -4.91 115.29 109.97 1dqn s HIS 160 Ca -0.08 1.26 0.17 0.00 -0.15 0.00 0.00 55.06 56.27 1dqn s HIS 160 Cb 0.18 -3.38 1.21 0.00 1.11 0.00 0.00 32.58 31.70 1dqn s HIS 160 CO 0.73 -1.11 2.05 0.66 -0.85 0.00 0.00 174.74 176.22 1dqn h SER 161 N 7.61 0.14 0.07 1.40 4.64 -1.91 0.79 113.55 126.29 1dqn h SER 161 Ca -0.29 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.95 1dqn h SER 161 Cb 1.13 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 63.17 1dqn h SER 161 CO 0.92 0.09 -0.24 0.00 -0.87 0.00 0.00 176.83 176.73 1dqn h ALA 162 N 1.82 1.30 -0.00 5.18 0.00 -1.93 -3.01 119.26 122.61 1dqn h ALA 162 Ca 0.16 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1dqn h ALA 162 Cb 0.43 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1dqn h ALA 162 CO -0.02 0.47 -0.92 1.28 0.00 0.00 0.00 179.25 180.06 1dqn n LEU 163 N -4.16 1.12 0.29 0.00 4.77 -0.40 -4.44 117.00 114.18 1dqn n LEU 163 Ca -0.01 -0.52 0.19 0.00 -0.03 0.00 0.00 56.01 55.64 1dqn n LEU 163 Cb 0.36 -0.01 0.97 0.00 -2.33 0.00 0.00 43.42 42.41 1dqn n LEU 163 CO 0.40 0.26 1.16 0.00 -1.33 0.00 0.00 177.39 177.88 1dqn h ALA 164 N 3.12 1.38 0.00 -1.18 0.00 -0.76 -2.14 119.26 119.68 1dqn h ALA 164 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1dqn h ALA 164 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1dqn h ALA 164 CO 0.00 -0.19 -1.08 -0.40 0.00 0.00 0.00 179.25 177.57 1dqn n ASP 165 N -3.29 1.16 -4.67 0.00 5.75 -1.26 -4.98 116.55 109.26 1dqn n ASP 165 Ca -0.01 -0.45 -0.42 0.00 -0.01 0.00 0.00 54.79 53.89 1dqn n ASP 165 Cb 0.24 1.29 -0.03 0.00 -1.03 0.00 0.00 41.12 41.59 1dqn n ASP 165 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1dqn s THR 166 N -2.59 3.27 0.14 2.12 -4.23 -0.81 -4.94 115.64 108.61 1dqn s THR 166 Ca 0.01 0.46 -0.31 0.00 -1.18 0.00 0.00 61.69 60.66 1dqn s THR 166 Cb 0.10 -3.30 -0.10 0.00 1.34 0.00 0.00 72.50 70.54 1dqn s THR 166 CO 0.57 -0.03 1.66 -0.75 -0.54 0.00 0.00 174.62 175.53 1dqn s LYS 167 N 3.74 4.18 -0.07 3.99 2.47 -1.26 -4.89 119.74 127.91 1dqn s LYS 167 Ca 0.78 2.43 0.03 0.00 -1.56 0.00 0.00 55.97 57.64 1dqn s LYS 167 Cb -0.38 -3.35 0.01 0.00 -1.46 0.00 0.00 37.83 32.65 1dqn s LYS 167 CO 0.33 -0.71 -0.15 -1.64 0.16 0.00 0.00 175.35 173.34 1dqn s MET 168 N 1.88 2.02 -0.13 4.03 -1.94 -1.26 -0.83 119.30 123.07 1dqn s MET 168 Ca 0.74 -0.54 -0.01 0.00 -1.71 0.00 0.00 55.69 54.17 1dqn s MET 168 Cb -0.44 -1.62 -0.02 0.00 2.01 0.00 0.00 34.83 34.76 1dqn s MET 168 CO 0.33 0.08 -0.09 -0.06 -0.01 0.00 0.00 175.02 175.26 1dqn s PHE 169 N 0.53 2.89 0.04 -0.03 0.08 0.13 -4.98 117.98 116.64 1dqn s PHE 169 Ca -0.15 -0.43 -0.12 0.00 0.12 0.00 0.00 56.93 56.36 1dqn s PHE 169 Cb -0.16 -1.85 0.01 0.00 -0.57 0.00 0.00 43.02 40.45 1dqn s PHE 169 CO 0.05 -0.07 0.26 1.52 -0.10 0.00 0.00 175.22 176.87 1dqn s TYR 170 N 0.16 -0.04 -0.14 0.36 -0.85 -1.26 -1.21 117.35 114.37 1dqn s TYR 170 Ca -0.05 -0.11 -0.19 0.00 -0.52 0.00 0.00 57.07 56.20 1dqn s TYR 170 Cb -0.14 0.04 -0.17 0.00 0.38 0.00 0.00 41.96 42.07 1dqn s TYR 170 CO 0.04 -0.46 0.42 0.78 -1.52 0.00 0.00 175.55 174.81 1dqn h GLY 171 N 3.38 0.00 -4.58 5.49 0.00 -0.24 -3.45 103.07 103.67 1dqn h GLY 171 Ca -0.32 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 46.90 1dqn h GLY 171 CO 0.46 0.00 -0.24 -0.47 0.00 0.00 0.00 176.54 176.30 1dqn s TYR 172 N -2.08 -0.25 -0.00 5.60 5.04 -0.08 -4.98 117.35 120.60 1dqn s TYR 172 Ca -0.16 0.44 -0.27 0.00 -2.44 0.00 0.00 57.07 54.65 1dqn s TYR 172 Cb -0.00 0.13 0.06 0.00 0.35 0.00 0.00 41.96 42.50 1dqn s TYR 172 CO 0.47 -0.38 0.60 -0.08 -1.34 0.00 0.00 175.55 174.82 1dqn s THR 173 N -1.10 0.01 0.40 4.34 -1.32 -1.26 -1.45 115.64 115.27 1dqn s THR 173 Ca -0.11 -0.10 0.04 0.00 -1.21 0.00 0.00 61.69 60.31 1dqn s THR 173 Cb -0.04 -0.96 -0.00 0.00 -1.51 0.00 0.00 72.50 69.99 1dqn s THR 173 CO 0.04 -0.05 0.58 -2.16 -2.21 0.00 0.00 174.62 170.82 1dqn s PRO 174 N -1.77 3.01 0.08 7.08 0.04 -1.26 -5.05 135.00 137.12 1dqn s PRO 174 Ca -0.09 -0.84 0.01 0.00 0.04 0.00 0.00 61.00 60.12 1dqn s PRO 174 Cb -0.01 -2.69 -0.04 0.00 0.04 0.00 0.00 34.50 31.80 1dqn s PRO 174 CO 0.04 -0.17 0.21 -1.64 0.04 0.00 0.00 177.00 175.49 1dqn s MET 175 N -4.38 3.38 0.21 4.56 -1.94 -0.24 -4.99 119.30 115.90 1dqn s MET 175 Ca 0.48 -0.50 -0.32 0.00 -1.71 0.00 0.00 55.69 53.64 1dqn s MET 175 Cb -0.10 -2.99 -0.14 0.00 2.01 0.00 0.00 34.83 33.62 1dqn s MET 175 CO 0.34 0.59 1.46 -2.30 -0.01 0.00 0.00 175.02 175.10 1dqn n PRO 176 N 0.15 2.06 -1.72 2.03 -0.02 -1.26 -4.88 135.00 131.36 1dqn n PRO 176 Ca -0.06 0.74 -0.43 0.00 -2.02 0.00 0.00 63.50 61.73 1dqn n PRO 176 Cb 0.52 -2.43 -0.02 0.00 -0.02 0.00 0.00 33.50 31.54 1dqn n PRO 176 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1dqn n LYS 177 N 2.46 2.58 -1.00 -0.52 4.81 -1.26 -1.96 118.16 123.27 1dqn n LYS 177 Ca 0.13 0.92 0.00 0.00 -0.87 0.00 0.00 58.31 58.49 1dqn n LYS 177 Cb 0.30 -2.70 0.00 0.00 0.02 0.00 0.00 35.03 32.66 1dqn n LYS 177 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1dqn n GLY 178 N 2.61 0.87 3.82 3.14 0.00 -1.26 -5.01 105.19 109.36 1dqn n GLY 178 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 1dqn n GLY 178 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dqn s SER 179 N -2.74 5.72 -0.13 1.61 1.04 -0.83 -4.67 113.70 113.71 1dqn s SER 179 Ca 0.00 1.67 -0.03 0.00 0.48 0.00 0.00 55.95 58.07 1dqn s SER 179 Cb 0.00 -2.51 0.05 0.00 0.10 0.00 0.00 66.02 63.66 1dqn s SER 179 CO 0.00 -1.21 0.05 0.86 0.98 0.00 0.00 173.24 173.92 1dqn s TRP 180 N -2.80 0.51 0.06 5.02 -0.11 -1.26 -4.97 118.94 115.39 1dqn s TRP 180 Ca 0.60 -0.33 -0.15 0.00 1.22 0.00 0.00 56.10 57.44 1dqn s TRP 180 Cb -0.14 -0.77 -0.06 0.00 -1.50 0.00 0.00 33.47 30.99 1dqn s TRP 180 CO 0.46 -0.44 0.48 -0.51 -4.62 0.00 0.00 176.95 172.32 1dqn s LEU 181 N 2.03 4.44 0.03 5.86 1.43 -1.26 -1.64 118.68 129.57 1dqn s LEU 181 Ca 0.02 1.04 0.00 0.00 -1.03 0.00 0.00 54.13 54.17 1dqn s LEU 181 Cb -0.15 -2.87 -0.02 0.00 0.03 0.00 0.00 46.19 43.18 1dqn s LEU 181 CO -0.07 0.24 -0.03 0.27 0.23 0.00 0.00 176.35 176.99 1dqn s ILE 182 N -1.21 0.16 0.00 -0.59 -5.25 -0.27 -4.75 121.20 109.29 1dqn s ILE 182 Ca 0.29 -1.04 0.00 0.00 -0.99 0.00 0.00 60.65 58.91 1dqn s ILE 182 Cb -0.17 -0.45 0.00 0.00 2.95 0.00 0.00 42.46 44.79 1dqn s ILE 182 CO 0.17 -0.55 0.00 0.61 -1.79 0.00 0.00 174.94 173.37 1dqn n GLY 183 N 1.39 0.42 3.41 6.27 0.00 0.50 -1.05 105.19 116.14 1dqn n GLY 183 Ca -0.23 -2.00 -0.25 0.00 0.00 0.00 0.00 46.02 43.55 1dqn n GLY 183 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1dqn n PHE 184 N 0.40 -1.94 0.00 1.61 7.35 0.15 -0.77 117.46 124.26 1dqn n PHE 184 Ca 0.00 0.58 0.00 0.00 -0.76 0.00 0.00 57.45 57.27 1dqn n PHE 184 Cb 0.00 -3.53 0.00 0.00 0.35 0.00 0.00 39.48 36.30 1dqn n PHE 184 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1dqn n GLY 185 N -1.37 3.25 3.74 7.13 0.00 -0.02 -4.66 105.19 113.26 1dqn n GLY 185 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 1dqn n GLY 185 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1dqn s LEU 186 N 0.00 4.56 0.39 0.99 1.43 0.05 -4.19 118.68 121.92 1dqn s LEU 186 Ca 0.00 2.02 -0.09 0.00 -1.03 0.00 0.00 54.13 55.03 1dqn s LEU 186 Cb 0.00 -3.61 -0.06 0.00 0.03 0.00 0.00 46.19 42.56 1dqn s LEU 186 CO 0.00 -0.04 0.73 1.51 0.23 0.00 0.00 176.35 178.78 1dqn s ASP 187 N -0.61 6.47 -0.77 2.29 -4.77 -1.26 -0.37 116.67 117.65 1dqn s ASP 187 Ca 0.45 1.02 -0.02 0.00 -3.30 0.00 0.00 52.55 50.70 1dqn s ASP 187 Cb -0.27 -2.28 0.19 0.00 -1.09 0.00 0.00 42.92 39.47 1dqn s ASP 187 CO 0.34 -0.39 0.62 -0.62 0.70 0.00 0.00 175.17 175.82 1dqn s ASP 188 N -3.30 5.60 -1.29 2.11 2.15 0.90 -4.63 116.67 118.21 1dqn s ASP 188 Ca 0.49 -3.37 -0.01 0.00 0.43 0.00 0.00 52.55 50.10 1dqn s ASP 188 Cb -0.10 -1.87 0.00 0.00 -0.30 0.00 0.00 42.92 40.65 1dqn s ASP 188 CO 0.33 -0.26 0.79 -3.20 -0.17 0.00 0.00 175.17 172.66 1dqn n ASN 189 N 2.79 -1.56 0.00 -0.34 5.15 -1.26 -1.95 115.26 118.10 1dqn n ASN 189 Ca 0.16 -0.76 0.00 0.00 -0.60 0.00 0.00 54.58 53.37 1dqn n ASN 189 Cb 0.37 -4.34 0.00 0.00 -0.53 0.00 0.00 39.78 35.29 1dqn n ASN 189 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1dqn n GLY 190 N -1.47 3.09 4.02 8.20 0.00 -1.26 -5.03 105.19 112.73 1dqn n GLY 190 Ca -0.28 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.55 1dqn n GLY 190 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1dqn s LEU 191 N 0.00 3.44 -1.76 0.99 1.02 -0.82 -4.69 118.68 116.86 1dqn s LEU 191 Ca 0.00 -0.55 0.00 0.00 0.02 0.00 0.00 54.13 53.60 1dqn s LEU 191 Cb 0.00 -2.30 0.00 0.00 0.02 0.00 0.00 46.19 43.91 1dqn s LEU 191 CO 0.00 -1.00 0.00 0.54 0.02 0.00 0.00 176.35 175.91 1dqn n ARG 192 N -2.03 -1.63 0.05 1.70 1.74 -1.26 -0.07 116.66 115.17 1dqn n ARG 192 Ca 0.11 0.99 0.03 0.00 -0.77 0.00 0.00 57.85 58.20 1dqn n ARG 192 Cb 0.60 -5.49 0.39 0.00 -1.02 0.00 0.00 32.46 26.95 1dqn n ARG 192 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1dqn h ARG 193 N 0.00 0.41 0.00 5.56 3.08 -1.84 -2.08 114.38 119.50 1dqn h ARG 193 Ca -0.41 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.58 1dqn h ARG 193 Cb 1.26 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.24 1dqn h ARG 193 CO 0.53 0.39 0.00 0.41 -1.07 0.00 0.00 179.97 180.24 1dqn n GLY 194 N -1.13 -0.91 3.56 0.04 0.00 -1.26 -0.84 105.19 104.64 1dqn n GLY 194 Ca 0.01 -0.16 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 1dqn n GLY 194 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1dqn s TRP 195 N -2.14 1.80 0.36 1.61 0.52 -0.78 -4.83 118.94 115.48 1dqn s TRP 195 Ca 0.36 0.67 0.20 0.00 0.02 0.00 0.00 56.10 57.35 1dqn s TRP 195 Cb 0.18 -4.17 1.04 0.00 -1.15 0.00 0.00 33.47 29.37 1dqn s TRP 195 CO 0.33 -2.32 1.93 0.00 0.02 0.00 0.00 176.95 176.92 1dqn h ALA 196 N 13.90 1.32 -2.41 0.98 0.00 -1.89 0.43 119.26 131.60 1dqn h ALA 196 Ca -0.27 -0.22 -0.49 0.00 0.00 0.00 0.00 54.91 53.93 1dqn h ALA 196 Cb 1.15 -0.04 0.06 0.00 0.00 0.00 0.00 17.79 18.96 1dqn h ALA 196 CO 1.20 0.30 0.39 -1.01 0.00 0.00 0.00 179.25 180.13 1dqn s HIS 197 N -4.16 2.87 -0.30 0.00 3.76 -1.26 -3.68 115.29 112.52 1dqn s HIS 197 Ca -0.02 1.54 -0.18 0.00 -0.15 0.00 0.00 55.06 56.25 1dqn s HIS 197 Cb 0.13 -3.11 -0.02 0.00 1.11 0.00 0.00 32.58 30.70 1dqn s HIS 197 CO 0.66 -1.22 0.51 -1.17 -0.85 0.00 0.00 174.74 172.68 1dqn s LEU 198 N -4.13 4.16 0.29 0.89 2.96 0.31 -3.05 118.68 120.10 1dqn s LEU 198 Ca 0.67 0.30 0.09 0.00 -0.22 0.00 0.00 54.13 54.97 1dqn s LEU 198 Cb -0.18 -2.63 -0.04 0.00 0.50 0.00 0.00 46.19 43.83 1dqn s LEU 198 CO 0.31 -0.36 0.04 -0.36 -1.32 0.00 0.00 176.35 174.66 1dqn s PHE 199 N 2.35 2.71 0.15 5.38 0.40 -0.21 -0.72 117.98 128.03 1dqn s PHE 199 Ca 0.20 -0.27 0.09 0.00 -0.60 0.00 0.00 56.93 56.35 1dqn s PHE 199 Cb -0.15 -1.32 -0.04 0.00 0.51 0.00 0.00 43.02 42.01 1dqn s PHE 199 CO 0.11 0.54 -0.19 0.34 0.70 0.00 0.00 175.22 176.72 1dqn s ASP 200 N -3.72 2.67 0.00 1.36 2.15 0.42 -1.11 116.67 118.43 1dqn s ASP 200 Ca 0.33 -0.81 0.00 0.00 0.43 0.00 0.00 52.55 52.51 1dqn s ASP 200 Cb -0.05 -0.16 0.00 0.00 -0.30 0.00 0.00 42.92 42.41 1dqn s ASP 200 CO 0.21 0.00 0.64 2.30 -0.17 0.00 0.00 175.17 178.15 1dqn n ILE 201 N 0.55 0.40 -0.02 4.11 -5.35 -0.65 -0.79 119.36 117.61 1dqn n ILE 201 Ca -0.15 -0.57 -0.00 0.00 -0.27 0.00 0.00 62.75 61.75 1dqn n ILE 201 Cb 0.56 0.92 -0.06 0.00 -1.74 0.00 0.00 39.64 39.31 1dqn n ILE 201 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1dqn n ASN 202 N -0.20 3.11 -4.87 7.28 3.02 -1.26 -4.98 115.26 117.36 1dqn n ASN 202 Ca 0.00 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.24 1dqn n ASN 202 Cb 0.20 0.99 0.01 0.00 -0.61 0.00 0.00 39.78 40.38 1dqn n ASN 202 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1dqn s LEU 203 N -4.12 3.21 0.58 3.41 1.43 -1.26 -4.97 118.68 116.95 1dqn s LEU 203 Ca -0.03 1.40 -0.07 0.00 -1.03 0.00 0.00 54.13 54.40 1dqn s LEU 203 Cb 0.04 -4.43 -0.00 0.00 0.03 0.00 0.00 46.19 41.82 1dqn s LEU 203 CO 0.33 -0.90 0.90 -0.94 0.23 0.00 0.00 176.35 175.97 1dqn s SER 204 N -4.19 5.75 0.23 2.29 1.04 -1.26 -4.92 113.70 112.65 1dqn s SER 204 Ca 0.55 0.84 -0.06 0.00 0.48 0.00 0.00 55.95 57.75 1dqn s SER 204 Cb -0.11 -1.88 0.32 0.00 0.10 0.00 0.00 66.02 64.45 1dqn s SER 204 CO 0.54 -0.98 1.82 -0.33 0.98 0.00 0.00 173.24 175.27 1dqn h GLU 205 N -0.14 0.77 -0.53 4.02 5.08 -1.99 -1.57 114.58 120.21 1dqn h GLU 205 Ca -0.46 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 57.78 1dqn h GLU 205 Cb 1.24 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.30 1dqn h GLU 205 CO 0.61 0.51 0.01 0.66 -1.00 0.00 0.00 179.01 179.80 1dqn h SER 206 N 0.79 0.85 -0.64 1.42 4.64 -1.99 0.32 113.55 118.93 1dqn h SER 206 Ca 0.35 -0.21 -0.09 0.00 -0.47 0.00 0.00 61.79 61.38 1dqn h SER 206 Cb 0.25 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 62.09 1dqn h SER 206 CO -0.21 0.90 0.07 -0.33 -0.87 0.00 0.00 176.83 176.39 1dqn h GLU 207 N 0.82 1.09 -0.28 4.77 5.08 -1.78 -1.72 114.58 122.56 1dqn h GLU 207 Ca 0.16 -0.31 -0.07 0.00 -1.00 0.00 0.00 59.36 58.13 1dqn h GLU 207 Cb 0.47 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1dqn h GLU 207 CO 0.02 1.02 -0.11 0.28 -1.00 0.00 0.00 179.01 179.22 1dqn h VAL 208 N 1.00 1.29 -0.60 3.13 2.07 -0.99 -1.81 116.25 120.35 1dqn h VAL 208 Ca 0.19 -1.18 0.05 0.00 0.82 0.00 0.00 66.70 66.57 1dqn h VAL 208 Cb 0.49 1.49 -0.05 0.00 -1.52 0.00 0.00 31.29 31.69 1dqn h VAL 208 CO 0.02 0.37 0.33 0.74 0.02 0.00 0.00 177.57 179.05 1dqn h THR 209 N 0.31 0.98 -0.70 2.57 2.02 -0.82 -1.00 112.91 116.26 1dqn h THR 209 Ca 0.06 -0.21 -0.05 0.00 0.77 0.00 0.00 66.41 66.98 1dqn h THR 209 Cb 0.62 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 67.30 1dqn h THR 209 CO 0.04 0.11 0.25 -0.08 0.37 0.00 0.00 175.52 176.21 1dqn h GLU 210 N 0.62 1.06 -0.21 6.66 4.57 -1.19 -1.47 114.58 124.62 1dqn h GLU 210 Ca 0.26 -0.21 -0.01 0.00 -1.18 0.00 0.00 59.36 58.22 1dqn h GLU 210 Cb 0.14 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 28.56 1dqn h GLU 210 CO -0.16 0.90 0.10 0.35 -1.18 0.00 0.00 179.01 179.02 1dqn h PHE 211 N 1.01 0.30 -0.13 0.92 3.57 -0.79 -2.61 116.94 119.20 1dqn h PHE 211 Ca 0.23 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 1dqn h PHE 211 Cb 0.26 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 1dqn h PHE 211 CO 0.02 0.30 -0.07 0.00 -2.23 0.00 0.00 178.31 176.32 1dqn h ARG 212 N 0.21 0.20 -0.19 1.11 3.08 -0.98 -0.14 114.38 117.67 1dqn h ARG 212 Ca 0.07 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1dqn h ARG 212 Cb 0.11 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 1dqn h ARG 212 CO -0.01 0.29 0.13 -0.09 -1.07 0.00 0.00 179.97 179.22 1dqn h ARG 213 N 0.19 0.26 -0.52 0.04 2.43 -0.90 0.15 114.38 116.02 1dqn h ARG 213 Ca 0.04 -0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 59.10 1dqn h ARG 213 Cb 0.26 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 1dqn h ARG 213 CO 0.01 0.17 -0.05 0.00 -1.51 0.00 0.00 179.97 178.60 1dqn h ARG 214 N 0.26 0.96 -0.29 0.20 3.08 -1.13 -1.88 114.38 115.58 1dqn h ARG 214 Ca 0.07 -0.33 -0.01 0.00 0.07 0.00 0.00 59.98 59.78 1dqn h ARG 214 Cb -0.03 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 1dqn h ARG 214 CO -0.02 0.99 0.15 1.25 -1.07 0.00 0.00 179.97 181.28 1dqn h LEU 215 N 0.83 0.37 -0.33 3.04 5.85 -0.82 -2.17 115.31 122.07 1dqn h LEU 215 Ca 0.14 -0.11 0.06 0.00 0.84 0.00 0.00 57.88 58.81 1dqn h LEU 215 Cb 0.59 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.47 1dqn h LEU 215 CO 0.04 0.38 -0.00 0.74 -0.34 0.00 0.00 178.44 179.25 1dqn h THR 216 N 0.34 0.75 -0.70 1.05 2.02 -0.57 -0.12 112.91 115.69 1dqn h THR 216 Ca 0.10 -0.03 0.09 0.00 0.77 0.00 0.00 66.41 67.34 1dqn h THR 216 Cb 0.10 0.65 -0.07 0.00 -1.74 0.00 0.00 68.15 67.09 1dqn h THR 216 CO -0.01 0.02 0.35 -0.08 0.37 0.00 0.00 175.52 176.17 1dqn h GLU 217 N 0.09 0.59 -0.00 6.66 4.57 -1.13 -0.42 114.58 124.95 1dqn h GLU 217 Ca 0.16 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.30 1dqn h GLU 217 Cb 0.22 -0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 28.67 1dqn h GLU 217 CO -0.27 0.39 0.00 1.25 -1.18 0.00 0.00 179.01 179.20 1dqn h HIS 218 N 0.61 0.00 -0.51 0.92 2.76 -0.69 -3.17 115.15 115.08 1dqn h HIS 218 Ca 0.34 -0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.45 1dqn h HIS 218 Cb 0.34 -0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.28 1dqn h HIS 218 CO -0.10 0.28 0.06 0.82 -1.30 0.00 0.00 177.93 177.69 1dqn h ILE 219 N -0.28 1.23 0.00 6.26 2.04 -0.71 -2.56 117.51 123.50 1dqn h ILE 219 Ca 0.00 -0.91 -0.04 0.00 1.00 0.00 0.00 64.86 64.91 1dqn h ILE 219 Cb 0.28 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 1dqn h ILE 219 CO 0.00 0.33 -0.20 0.07 0.00 0.00 0.00 178.15 178.34 1dqn h LYS 220 N 0.77 0.00 -0.18 2.37 2.10 -1.12 -1.37 116.57 119.14 1dqn h LYS 220 Ca 0.16 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.81 1dqn h LYS 220 Cb 0.37 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.70 1dqn h LYS 220 CO 0.01 0.20 0.00 0.41 -2.00 0.00 0.00 179.45 178.07 1dqn n GLY 221 N -0.61 0.45 3.77 0.07 0.00 -0.98 -4.92 105.19 102.96 1dqn n GLY 221 Ca -0.02 -0.46 -0.39 0.00 0.00 0.00 0.00 46.02 45.14 1dqn n GLY 221 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1dqn s LEU 222 N -1.59 4.39 -0.48 0.99 2.96 -0.52 -5.02 118.68 119.42 1dqn s LEU 222 Ca 0.33 2.35 0.04 0.00 -0.22 0.00 0.00 54.13 56.63 1dqn s LEU 222 Cb 0.18 -3.79 0.12 0.00 0.50 0.00 0.00 46.19 43.20 1dqn s LEU 222 CO 0.27 -0.40 0.21 0.21 -1.32 0.00 0.00 176.35 175.32 1dqn s ASN 223 N -0.94 4.36 0.00 3.68 2.47 -1.26 -4.85 114.94 118.40 1dqn s ASN 223 Ca 0.50 -2.80 0.00 0.00 0.42 0.00 0.00 52.86 50.98 1dqn s ASN 223 Cb -0.32 -1.59 0.00 0.00 -1.45 0.00 0.00 41.25 37.89 1dqn s ASN 223 CO 0.41 -0.27 0.33 2.30 -3.72 0.00 0.00 177.10 176.16 1dqn n ILE 224 N 3.39 0.10 -1.55 -5.21 -5.35 -1.26 -4.99 119.36 104.48 1dqn n ILE 224 Ca 0.05 -0.16 -0.42 0.00 -0.27 0.00 0.00 62.75 61.95 1dqn n ILE 224 Cb 0.34 1.38 -0.04 0.00 -1.74 0.00 0.00 39.64 39.58 1dqn n ILE 224 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1dqn n ASN 225 N -0.05 2.51 0.00 7.28 2.85 -1.26 -0.69 115.26 125.91 1dqn n ASN 225 Ca 0.00 -0.04 0.00 0.00 -0.11 0.00 0.00 54.58 54.43 1dqn n ASN 225 Cb 0.31 -1.48 0.00 0.00 1.24 0.00 0.00 39.78 39.85 1dqn n ASN 225 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1dqn n GLY 226 N 6.05 0.88 0.35 8.20 0.00 -1.26 -4.97 105.19 114.44 1dqn n GLY 226 Ca 0.37 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.44 1dqn n GLY 226 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1dqn h VAL 227 N 0.00 0.98 -3.18 1.61 2.07 -1.30 -3.38 116.25 113.05 1dqn h VAL 227 Ca 0.00 -0.35 -0.59 0.00 0.82 0.00 0.00 66.70 66.58 1dqn h VAL 227 Cb 0.00 -0.13 -0.07 0.00 -1.52 0.00 0.00 31.29 29.57 1dqn h VAL 227 CO 0.00 0.19 0.64 0.21 0.02 0.00 0.00 177.57 178.63 1dqn s ASN 228 N -5.75 6.98 0.00 0.57 2.47 -1.26 -4.90 114.94 113.04 1dqn s ASN 228 Ca -0.12 1.22 0.20 0.00 0.42 0.00 0.00 52.86 54.58 1dqn s ASN 228 Cb 0.21 -2.49 0.12 0.00 -1.45 0.00 0.00 41.25 37.64 1dqn s ASN 228 CO 0.81 -0.59 1.10 0.54 -3.72 0.00 0.00 177.10 175.23 1dqn n ARG 229 N 6.14 1.73 0.00 0.43 1.74 -1.26 -5.12 116.66 120.32 1dqn n ARG 229 Ca 0.09 -1.51 0.13 0.00 -0.77 0.00 0.00 57.85 55.79 1dqn n ARG 229 Cb 0.47 -1.38 0.34 0.00 -1.02 0.00 0.00 32.46 30.86 1dqn n ARG 229 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77