#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qw4 h LEU 33 N 0.00 -0.01 -1.37 -4.53 5.85 -2.01 -3.11 115.31 110.13 2qw4 h LEU 33 Ca 0.00 -0.31 0.33 0.00 0.84 0.00 0.00 57.88 58.74 2qw4 h LEU 33 Cb 0.00 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 40.92 2qw4 h LEU 33 CO 0.00 0.31 0.73 0.25 -0.34 0.00 0.00 178.44 179.39 2qw4 h LEU 34 N -0.32 0.37 0.57 2.25 5.85 -1.98 0.61 115.31 122.66 2qw4 h LEU 34 Ca -0.00 0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.80 2qw4 h LEU 34 Cb 0.32 0.06 0.01 0.00 0.37 0.00 0.00 40.66 41.41 2qw4 h LEU 34 CO 0.00 -0.02 -0.27 0.74 -0.34 0.00 0.00 178.44 178.55 2qw4 h THR 35 N 0.27 0.38 -0.93 1.05 2.02 -1.98 -0.97 112.91 112.76 2qw4 h THR 35 Ca 0.68 -0.22 0.22 0.00 0.77 0.00 0.00 66.41 67.86 2qw4 h THR 35 Cb 1.90 0.47 -0.07 0.00 -1.74 0.00 0.00 68.15 68.71 2qw4 h THR 35 CO -0.35 0.03 0.61 0.28 0.37 0.00 0.00 175.52 176.47 2qw4 h SER 36 N -0.91 0.40 -0.43 4.18 0.02 0.15 0.35 113.55 117.32 2qw4 h SER 36 Ca -0.08 0.05 -0.05 0.00 -0.84 0.00 0.00 61.79 60.87 2qw4 h SER 36 Cb 0.64 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 63.14 2qw4 h SER 36 CO 0.13 0.15 0.06 -0.07 -1.14 0.00 0.00 176.83 175.96 2qw4 h LEU 37 N 0.39 0.68 -0.14 5.07 3.38 -0.87 -0.77 115.31 123.07 2qw4 h LEU 37 Ca 0.49 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 58.18 2qw4 h LEU 37 Cb 1.25 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 2qw4 h LEU 37 CO -0.19 0.78 0.02 0.58 0.09 0.00 0.00 178.44 179.71 2qw4 h VAL 38 N 0.57 1.23 -0.33 1.22 2.07 0.95 -1.68 116.25 120.27 2qw4 h VAL 38 Ca 0.13 -0.72 0.04 0.00 0.82 0.00 0.00 66.70 66.96 2qw4 h VAL 38 Cb 0.39 1.45 -0.04 0.00 -1.52 0.00 0.00 31.29 31.57 2qw4 h VAL 38 CO 0.01 0.21 0.11 0.03 0.02 0.00 0.00 177.57 177.95 2qw4 h ARG 39 N -0.00 0.24 -0.27 1.57 2.47 -0.63 1.00 114.38 118.75 2qw4 h ARG 39 Ca 0.04 -0.01 0.05 0.00 -1.26 0.00 0.00 59.98 58.79 2qw4 h ARG 39 Cb 0.31 -0.05 -0.05 0.00 -1.65 0.00 0.00 29.97 28.53 2qw4 h ARG 39 CO 0.00 0.16 -0.01 0.00 0.56 0.00 0.00 179.97 180.68 2qw4 h ALA 40 N 1.21 0.23 0.50 0.04 0.00 -0.92 1.34 119.26 121.67 2qw4 h ALA 40 Ca 0.15 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 2qw4 h ALA 40 Cb 0.12 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2qw4 h ALA 40 CO -0.16 -0.43 -0.37 1.25 0.00 0.00 0.00 179.25 179.55 2qw4 h HIS 41 N 0.07 -1.00 -0.93 0.00 -0.00 -0.91 -3.01 115.15 109.36 2qw4 h HIS 41 Ca 0.13 -0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.49 2qw4 h HIS 41 Cb 0.18 0.37 -0.05 0.00 -0.00 0.00 0.00 27.41 27.91 2qw4 h HIS 41 CO -0.22 -0.55 0.56 -0.07 -0.00 0.00 0.00 177.93 177.65 2qw4 h LEU 42 N -0.86 1.12 0.00 0.26 3.38 -0.28 -2.78 115.31 116.16 2qw4 h LEU 42 Ca -0.05 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2qw4 h LEU 42 Cb 0.72 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.19 2qw4 h LEU 42 CO 0.01 0.86 0.00 0.47 0.09 0.00 0.00 178.44 179.88 2qw4 n ASP 43 N -4.36 0.00 0.00 -0.43 8.00 0.46 -4.01 116.55 116.21 2qw4 n ASP 43 Ca 0.10 -1.51 0.00 0.00 0.71 0.00 0.00 54.79 54.09 2qw4 n ASP 43 Cb 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.16 2qw4 n ASP 43 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2qw4 n SER 44 N -0.66 0.07 -4.72 -2.24 3.41 -1.07 -5.03 113.62 103.39 2qw4 n SER 44 Ca 0.07 0.01 -0.34 0.00 -0.26 0.00 0.00 58.87 58.35 2qw4 n SER 44 Cb 0.03 -0.02 0.10 0.00 -0.26 0.00 0.00 64.21 64.06 2qw4 n SER 44 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2qw4 s GLY 45 N -4.93 2.36 -0.34 5.00 0.00 -1.12 -4.88 107.32 103.40 2qw4 s GLY 45 Ca 0.00 0.92 -0.28 0.00 0.00 0.00 0.00 44.72 45.36 2qw4 s GLY 45 CO 0.00 1.33 1.98 2.56 0.00 0.00 0.00 173.10 178.97 2qw4 s PRO 46 N -3.90 3.08 -0.07 2.90 0.04 -1.25 -4.94 135.00 130.85 2qw4 s PRO 46 Ca 0.75 1.51 -0.34 0.00 0.04 0.00 0.00 61.00 62.96 2qw4 s PRO 46 Cb -0.30 -4.31 -0.11 0.00 0.04 0.00 0.00 34.50 29.82 2qw4 s PRO 46 CO 0.46 -2.16 1.90 -1.13 0.04 0.00 0.00 177.00 176.11 2qw4 n SER 47 N 11.51 3.56 -4.54 6.66 3.41 -1.26 -4.83 113.62 128.13 2qw4 n SER 47 Ca 0.26 0.96 -0.43 0.00 -0.26 0.00 0.00 58.87 59.39 2qw4 n SER 47 Cb 0.48 -1.39 -0.05 0.00 -0.26 0.00 0.00 64.21 62.98 2qw4 n SER 47 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2qw4 n THR 48 N 5.25 0.18 0.00 6.66 -2.24 -1.26 -0.16 114.28 122.70 2qw4 n THR 48 Ca 0.22 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 2qw4 n THR 48 Cb 0.31 -2.27 0.00 0.00 -2.10 0.00 0.00 70.33 66.27 2qw4 n THR 48 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qw4 n ALA 49 N 12.20 0.00 -2.09 6.98 0.00 -1.26 -4.95 120.51 131.39 2qw4 n ALA 49 Ca 0.37 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.79 2qw4 n ALA 49 Cb 0.39 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.82 2qw4 n ALA 49 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2qw4 n LYS 50 N -0.09 0.00 -3.30 0.00 4.76 0.77 -5.11 118.16 115.18 2qw4 n LYS 50 Ca 0.00 -0.87 -0.41 0.00 -2.87 0.00 0.00 58.31 54.16 2qw4 n LYS 50 Cb 0.00 0.09 -0.08 0.00 -1.84 0.00 0.00 35.03 33.20 2qw4 n LYS 50 CO 0.00 0.00 0.00 -0.48 -1.37 0.00 0.00 177.40 175.55 2qw4 s LEU 51 N 0.00 4.47 -0.22 -0.35 0.05 -1.26 -4.82 118.68 116.54 2qw4 s LEU 51 Ca 0.06 -0.21 -0.28 0.00 0.05 0.00 0.00 54.13 53.75 2qw4 s LEU 51 Cb 0.07 -2.47 -0.04 0.00 -2.05 0.00 0.00 46.19 41.69 2qw4 s LEU 51 CO -0.03 -0.46 2.08 -0.62 -0.55 0.00 0.00 176.35 176.77 2qw4 s ASP 52 N 1.77 5.67 -0.03 1.48 3.68 0.53 -4.86 116.67 124.91 2qw4 s ASP 52 Ca 0.15 1.80 0.19 0.00 2.13 0.00 0.00 52.55 56.83 2qw4 s ASP 52 Cb -0.16 -2.52 0.60 0.00 -1.45 0.00 0.00 42.92 39.40 2qw4 s ASP 52 CO 0.13 -1.80 1.50 -1.22 0.13 0.00 0.00 175.17 173.91 2qw4 n TYR 53 N 10.91 1.03 0.46 -5.34 4.02 -1.26 -1.65 117.16 125.33 2qw4 n TYR 53 Ca 0.27 -0.47 0.07 0.00 -0.01 0.00 0.00 57.90 57.76 2qw4 n TYR 53 Cb 0.45 -0.07 0.31 0.00 -0.02 0.00 0.00 39.34 40.01 2qw4 n TYR 53 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 2qw4 n SER 54 N 1.28 0.06 -0.24 7.72 3.41 -1.26 -1.87 113.62 122.73 2qw4 n SER 54 Ca 0.22 0.52 0.02 0.00 -0.26 0.00 0.00 58.87 59.37 2qw4 n SER 54 Cb 0.64 -0.53 0.05 0.00 -0.26 0.00 0.00 64.21 64.11 2qw4 n SER 54 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2qw4 n LYS 55 N -1.57 1.71 -2.17 4.33 5.02 -1.26 -5.06 118.16 119.17 2qw4 n LYS 55 Ca 0.03 -1.38 -0.41 0.00 -2.02 0.00 0.00 58.31 54.53 2qw4 n LYS 55 Cb 0.16 -1.10 -0.03 0.00 -0.02 0.00 0.00 35.03 34.04 2qw4 n LYS 55 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2qw4 s PHE 56 N -0.77 3.18 -0.25 2.13 5.36 -0.78 -4.95 117.98 121.90 2qw4 s PHE 56 Ca 0.08 1.28 -0.01 0.00 -0.96 0.00 0.00 56.93 57.32 2qw4 s PHE 56 Cb 0.05 -3.64 0.07 0.00 -0.34 0.00 0.00 43.02 39.16 2qw4 s PHE 56 CO 0.06 -1.92 0.04 -0.65 -1.46 0.00 0.00 175.22 171.29 2qw4 s GLN 57 N -0.76 0.87 -0.44 10.12 -0.21 -1.26 -5.05 119.66 122.94 2qw4 s GLN 57 Ca 0.54 -0.78 -0.28 0.00 0.02 0.00 0.00 55.36 54.86 2qw4 s GLN 57 Cb -0.38 -2.17 -0.08 0.00 1.00 0.00 0.00 33.01 31.38 2qw4 s GLN 57 CO 0.44 -0.76 2.37 -1.91 -2.12 0.00 0.00 175.29 173.31 2qw4 n GLU 58 N 4.89 1.21 -4.72 2.91 4.07 -1.26 -4.62 120.64 123.13 2qw4 n GLU 58 Ca -0.07 0.15 -0.30 0.00 -0.06 0.00 0.00 57.16 56.88 2qw4 n GLU 58 Cb 0.45 -3.20 -0.13 0.00 -0.06 0.00 0.00 31.44 28.49 2qw4 n GLU 58 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 2qw4 s LEU 59 N 10.71 2.42 -0.05 4.31 1.43 -1.26 -4.97 118.68 131.26 2qw4 s LEU 59 Ca 1.02 -0.52 0.09 0.00 -1.03 0.00 0.00 54.13 53.69 2qw4 s LEU 59 Cb -0.33 -1.40 0.20 0.00 0.03 0.00 0.00 46.19 44.69 2qw4 s LEU 59 CO 0.32 0.25 1.15 0.52 0.23 0.00 0.00 176.35 178.81 2qw4 n VAL 60 N 1.56 1.37 -3.62 -1.59 0.31 -1.26 -4.92 118.33 110.17 2qw4 n VAL 60 Ca -0.17 -1.40 -0.37 0.00 -0.01 0.00 0.00 64.34 62.40 2qw4 n VAL 60 Cb 0.52 0.24 -0.06 0.00 -0.91 0.00 0.00 33.84 33.62 2qw4 n VAL 60 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 2qw4 s LEU 61 N -1.66 5.59 0.32 7.52 1.98 -1.26 -5.06 118.68 126.11 2qw4 s LEU 61 Ca 0.18 -3.62 -0.29 0.00 -2.89 0.00 0.00 54.13 47.51 2qw4 s LEU 61 Cb 0.14 -1.93 -0.12 0.00 0.66 0.00 0.00 46.19 44.94 2qw4 s LEU 61 CO 0.05 -0.21 1.39 -2.65 -1.89 0.00 0.00 176.35 173.04 2qw4 n PRO 62 N 2.48 2.29 -3.55 0.98 -0.02 -1.26 -4.90 135.00 131.03 2qw4 n PRO 62 Ca 0.20 0.81 -0.41 0.00 -2.02 0.00 0.00 63.50 62.08 2qw4 n PRO 62 Cb 0.37 -2.46 -0.09 0.00 -0.02 0.00 0.00 33.50 31.30 2qw4 n PRO 62 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 2qw4 s HIS 63 N -0.75 3.33 0.09 6.00 2.46 -1.26 -5.04 115.29 120.12 2qw4 s HIS 63 Ca 0.59 -1.45 -0.33 0.00 0.47 0.00 0.00 55.06 54.34 2qw4 s HIS 63 Cb -0.56 -3.08 -0.12 0.00 -0.13 0.00 0.00 32.58 28.69 2qw4 s HIS 63 CO 0.58 -0.86 1.77 1.19 -2.47 0.00 0.00 174.74 174.95 2qw4 n PHE 64 N 4.98 2.47 0.00 3.88 3.01 -1.26 -4.90 117.46 125.64 2qw4 n PHE 64 Ca -0.10 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.36 2qw4 n PHE 64 Cb 0.43 -2.67 0.00 0.00 -0.01 0.00 0.00 39.48 37.23 2qw4 n PHE 64 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2qw4 n GLY 65 N 4.04 3.94 3.60 1.37 0.00 -1.26 -5.07 105.19 111.80 2qw4 n GLY 65 Ca 0.19 -0.41 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 2qw4 n GLY 65 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qw4 s LYS 66 N -1.67 3.77 -0.08 1.61 2.20 -1.26 -4.96 119.74 119.36 2qw4 s LYS 66 Ca 0.00 0.57 -0.07 0.00 -0.36 0.00 0.00 55.97 56.11 2qw4 s LYS 66 Cb 0.00 -3.85 -0.03 0.00 -1.51 0.00 0.00 37.83 32.43 2qw4 s LYS 66 CO 0.00 -1.15 0.30 0.39 -0.36 0.00 0.00 175.35 174.52 2qw4 n GLU 67 N 7.25 0.00 -1.99 4.03 4.71 -1.26 -4.93 120.64 128.45 2qw4 n GLU 67 Ca 0.09 0.00 -0.28 0.00 -0.01 0.00 0.00 57.16 56.96 2qw4 n GLU 67 Cb 0.48 -0.24 0.08 0.00 -1.01 0.00 0.00 31.44 30.75 2qw4 n GLU 67 CO 0.00 0.00 0.00 0.16 0.09 0.00 0.00 177.13 177.38 2qw4 s ASP 68 N 0.68 4.69 0.25 1.62 1.47 -1.26 -4.93 116.67 119.19 2qw4 s ASP 68 Ca 0.18 0.73 0.18 0.00 1.18 0.00 0.00 52.55 54.82 2qw4 s ASP 68 Cb -0.24 -1.30 0.93 0.00 -0.34 0.00 0.00 42.92 41.97 2qw4 s ASP 68 CO 0.12 -1.76 1.56 0.00 0.68 0.00 0.00 175.17 175.78 2qw4 n ALA 69 N -3.17 1.18 0.02 2.11 0.00 -1.26 -1.30 120.51 118.09 2qw4 n ALA 69 Ca 0.08 0.14 -0.14 0.00 0.00 0.00 0.00 53.44 53.52 2qw4 n ALA 69 Cb 0.60 -1.28 -0.02 0.00 0.00 0.00 0.00 19.45 18.75 2qw4 n ALA 69 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2qw4 h GLY 70 N 0.55 0.66 0.51 0.00 0.00 -1.99 -2.88 103.07 99.91 2qw4 h GLY 70 Ca 0.00 -0.94 -0.00 0.00 0.00 0.00 0.00 47.33 46.39 2qw4 h GLY 70 CO 0.00 0.84 -0.00 -0.55 0.00 0.00 0.00 176.54 176.83 2qw4 h ASP 71 N 0.40 -0.00 0.18 0.19 3.32 -1.57 0.47 116.42 119.41 2qw4 h ASP 71 Ca -0.05 -0.49 -0.04 0.00 0.02 0.00 0.00 57.03 56.48 2qw4 h ASP 71 Cb 1.37 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.92 2qw4 h ASP 71 CO 0.15 0.49 -0.18 0.58 -1.72 0.00 0.00 179.24 178.55 2qw4 h VAL 72 N -0.50 1.14 -0.26 -1.35 2.07 -1.67 0.25 116.25 115.94 2qw4 h VAL 72 Ca -0.00 -0.64 -0.19 0.00 0.82 0.00 0.00 66.70 66.69 2qw4 h VAL 72 Cb 0.49 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.60 2qw4 h VAL 72 CO 0.00 0.18 -0.59 -0.61 0.02 0.00 0.00 177.57 176.58 2qw4 h GLN 73 N 0.01 0.83 0.93 1.57 5.75 -1.25 -2.09 115.11 120.86 2qw4 h GLN 73 Ca -0.00 -0.55 -0.04 0.00 -0.15 0.00 0.00 58.65 57.90 2qw4 h GLN 73 Cb 0.33 0.07 0.01 0.00 1.07 0.00 0.00 27.48 28.96 2qw4 h GLN 73 CO 0.02 1.18 -0.47 0.37 -2.65 0.00 0.00 178.83 177.29 2qw4 h GLN 74 N 0.63 -1.23 -0.84 1.69 4.15 0.12 -2.54 115.11 117.09 2qw4 h GLN 74 Ca 0.00 0.08 0.16 0.00 0.77 0.00 0.00 58.65 59.67 2qw4 h GLN 74 Cb 1.19 0.28 -0.16 0.00 0.21 0.00 0.00 27.48 29.01 2qw4 h GLN 74 CO 0.13 -0.82 -0.22 0.34 -1.93 0.00 0.00 178.83 176.33 2qw4 n PHE 75 N -5.64 0.27 0.13 3.99 7.35 0.80 -0.35 117.46 124.00 2qw4 n PHE 75 Ca -0.16 1.02 -0.02 0.00 -0.76 0.00 0.00 57.45 57.53 2qw4 n PHE 75 Cb 0.51 -0.97 0.13 0.00 0.35 0.00 0.00 39.48 39.51 2qw4 n PHE 75 CO 0.00 0.00 0.00 1.88 -0.76 0.00 0.00 176.76 177.88 2qw4 h TYR 76 N 0.00 0.02 -0.10 -5.13 0.05 -1.29 -2.68 116.97 107.84 2qw4 h TYR 76 Ca 0.39 -0.01 -0.19 0.00 0.05 0.00 0.00 58.73 58.97 2qw4 h TYR 76 Cb 0.60 -0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.34 2qw4 h TYR 76 CO -0.65 0.67 -0.74 -0.44 -1.05 0.00 0.00 178.16 175.95 2qw4 h ASP 77 N 0.01 0.60 0.25 3.88 3.32 -0.25 -1.52 116.42 122.70 2qw4 h ASP 77 Ca -0.01 -0.39 -0.01 0.00 0.02 0.00 0.00 57.03 56.64 2qw4 h ASP 77 Cb 1.18 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.55 2qw4 h ASP 77 CO 0.09 1.15 -0.12 -0.07 -1.72 0.00 0.00 179.24 178.56 2qw4 h LEU 78 N 0.34 -0.29 -0.24 1.55 4.07 -1.33 0.21 115.31 119.63 2qw4 h LEU 78 Ca -0.04 -0.13 0.04 0.00 0.08 0.00 0.00 57.88 57.84 2qw4 h LEU 78 Cb 1.33 0.07 -0.07 0.00 1.08 0.00 0.00 40.66 43.07 2qw4 h LEU 78 CO 0.13 -0.04 -0.54 -0.07 -1.08 0.00 0.00 178.44 176.85 2qw4 h LEU 79 N -0.53 -1.74 -0.55 1.67 -0.00 -1.48 0.13 115.31 112.81 2qw4 h LEU 79 Ca -0.03 0.22 0.11 0.00 -0.00 0.00 0.00 57.88 58.17 2qw4 h LEU 79 Cb 0.40 0.70 -0.09 0.00 -0.00 0.00 0.00 40.66 41.66 2qw4 h LEU 79 CO 0.06 -0.45 -0.04 0.28 -0.00 0.00 0.00 178.44 178.29 2qw4 h SER 80 N -0.50 -0.31 0.05 -0.43 0.02 -1.23 0.10 113.55 111.25 2qw4 h SER 80 Ca 0.05 0.14 0.03 0.00 -0.84 0.00 0.00 61.79 61.17 2qw4 h SER 80 Cb 0.65 0.26 -0.04 0.00 0.14 0.00 0.00 62.40 63.41 2qw4 h SER 80 CO -0.50 -0.12 -0.26 1.23 -1.14 0.00 0.00 176.83 176.04 2qw4 h GLY 81 N 0.08 -0.44 0.82 -3.77 0.00 -0.25 -2.69 103.07 96.81 2qw4 h GLY 81 Ca 0.28 0.31 0.14 0.00 0.00 0.00 0.00 47.33 48.06 2qw4 h GLY 81 CO -0.49 -0.22 0.46 1.76 0.00 0.00 0.00 176.54 178.05 2qw4 h SER 82 N -0.43 0.32 -0.33 0.19 0.02 0.11 -2.21 113.55 111.22 2qw4 h SER 82 Ca 0.05 0.01 -0.11 0.00 -0.84 0.00 0.00 61.79 60.90 2qw4 h SER 82 Cb 0.49 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 2qw4 h SER 82 CO -0.20 0.17 -0.24 0.25 -1.14 0.00 0.00 176.83 175.68 2qw4 h LEU 83 N 0.35 0.78 -0.89 5.07 5.85 -0.86 -0.77 115.31 124.83 2qw4 h LEU 83 Ca 0.33 -0.44 -0.06 0.00 0.84 0.00 0.00 57.88 58.54 2qw4 h LEU 83 Cb 0.80 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 2qw4 h LEU 83 CO -0.09 1.06 0.11 -0.08 -0.34 0.00 0.00 178.44 179.10 2qw4 h GLU 84 N 0.51 0.93 0.36 1.25 4.81 -1.25 0.32 114.58 121.52 2qw4 h GLU 84 Ca 0.06 -0.22 -0.02 0.00 -0.13 0.00 0.00 59.36 59.06 2qw4 h GLU 84 Cb 0.80 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.06 2qw4 h GLU 84 CO 0.06 0.85 -0.17 0.28 -0.73 0.00 0.00 179.01 179.30 2qw4 h VAL 85 N 0.88 0.65 -0.55 0.32 2.07 -1.39 -1.55 116.25 116.68 2qw4 h VAL 85 Ca 0.18 -0.29 0.10 0.00 0.82 0.00 0.00 66.70 67.51 2qw4 h VAL 85 Cb 0.36 0.80 -0.08 0.00 -1.52 0.00 0.00 31.29 30.86 2qw4 h VAL 85 CO 0.01 0.06 0.12 0.40 0.02 0.00 0.00 177.57 178.17 2qw4 h ILE 86 N -0.65 0.69 -0.25 4.57 2.04 -0.84 -0.60 117.51 122.48 2qw4 h ILE 86 Ca -0.05 -0.09 0.02 0.00 1.00 0.00 0.00 64.86 65.74 2qw4 h ILE 86 Cb 0.47 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 2qw4 h ILE 86 CO 0.08 0.05 0.11 -0.09 0.00 0.00 0.00 178.15 178.29 2qw4 h ARG 87 N 0.26 0.23 0.00 2.37 2.43 -0.89 -2.07 114.38 116.71 2qw4 h ARG 87 Ca 0.28 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.41 2qw4 h ARG 87 Cb 0.39 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.89 2qw4 h ARG 87 CO -0.36 0.15 -0.12 0.87 -1.51 0.00 0.00 179.97 179.00 2qw4 h LYS 88 N 0.23 0.00 0.00 0.20 6.56 -0.15 -1.71 116.57 121.70 2qw4 h LYS 88 Ca 0.11 0.00 -0.08 0.00 -1.06 0.00 0.00 60.65 59.62 2qw4 h LYS 88 Cb 0.05 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.70 2qw4 h LYS 88 CO -0.09 0.12 -0.42 2.35 -2.06 0.00 0.00 179.45 179.35 2qw4 h TRP 89 N 0.00 0.00 -0.08 -1.35 7.01 -0.53 -3.33 115.95 117.66 2qw4 h TRP 89 Ca -0.00 0.00 -0.09 0.00 2.11 0.00 0.00 58.89 60.91 2qw4 h TRP 89 Cb 0.32 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.38 2qw4 h TRP 89 CO 0.00 0.37 -0.30 0.00 -2.79 0.00 0.00 178.44 175.73 2qw4 h ALA 90 N 1.63 0.15 -1.00 2.65 0.00 -0.65 -3.09 119.26 118.94 2qw4 h ALA 90 Ca -0.01 -0.43 0.15 0.00 0.00 0.00 0.00 54.91 54.62 2qw4 h ALA 90 Cb 1.29 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.98 2qw4 h ALA 90 CO 0.05 0.18 0.62 1.05 0.00 0.00 0.00 179.25 181.15 2qw4 h GLU 91 N -0.13 0.86 0.00 0.00 4.11 -1.65 0.37 114.58 118.14 2qw4 h GLU 91 Ca -0.01 -0.05 0.00 0.00 0.07 0.00 0.00 59.36 59.36 2qw4 h GLU 91 Cb 0.93 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.98 2qw4 h GLU 91 CO 0.06 0.57 0.00 1.63 0.07 0.00 0.00 179.01 181.34 2qw4 n LYS 92 N -4.67 0.35 -2.98 1.06 5.02 -1.17 -4.51 118.16 111.26 2qw4 n LYS 92 Ca 0.21 0.06 -0.43 0.00 -2.02 0.00 0.00 58.31 56.13 2qw4 n LYS 92 Cb 0.45 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.90 2qw4 n LYS 92 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2qw4 s ILE 93 N -2.24 4.64 -0.03 -0.18 1.01 0.13 -4.74 121.20 119.79 2qw4 s ILE 93 Ca 0.18 0.17 -0.39 0.00 0.00 0.00 0.00 60.65 60.61 2qw4 s ILE 93 Cb 0.10 -4.37 -0.18 0.00 0.01 0.00 0.00 42.46 38.02 2qw4 s ILE 93 CO 0.19 -0.83 1.29 -2.65 0.00 0.00 0.00 174.94 172.93 2qw4 n PRO 94 N 6.77 0.58 0.00 2.79 -0.02 -1.26 -0.87 135.00 142.99 2qw4 n PRO 94 Ca 0.00 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 2qw4 n PRO 94 Cb 0.47 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 32.17 2qw4 n PRO 94 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qw4 n GLY 95 N 2.39 3.17 0.32 -1.23 0.00 -1.26 -4.87 105.19 103.71 2qw4 n GLY 95 Ca 0.21 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.17 2qw4 n GLY 95 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2qw4 h PHE 96 N 0.00 1.11 0.00 1.61 3.57 -1.30 -3.03 116.94 118.90 2qw4 h PHE 96 Ca 0.00 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.42 2qw4 h PHE 96 Cb 0.00 -0.34 -0.00 0.00 2.79 0.00 0.00 35.95 38.40 2qw4 h PHE 96 CO 0.00 0.83 -0.07 0.00 -2.23 0.00 0.00 178.31 176.84 2qw4 h ALA 97 N 1.17 1.00 -0.08 2.41 0.00 -1.79 -2.47 119.26 119.51 2qw4 h ALA 97 Ca 0.26 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2qw4 h ALA 97 Cb 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2qw4 h ALA 97 CO -0.03 0.08 0.00 0.39 0.00 0.00 0.00 179.25 179.69 2qw4 n GLU 98 N -3.17 1.70 -1.51 0.00 4.71 -1.15 -4.81 120.64 116.40 2qw4 n GLU 98 Ca 0.01 -1.02 -0.30 0.00 -0.01 0.00 0.00 57.16 55.83 2qw4 n GLU 98 Cb 0.38 -1.45 0.09 0.00 -1.01 0.00 0.00 31.44 29.45 2qw4 n GLU 98 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 2qw4 s LEU 99 N -1.83 2.68 0.70 -4.62 1.43 -0.93 -5.03 118.68 111.09 2qw4 s LEU 99 Ca 0.36 1.40 -0.16 0.00 -1.03 0.00 0.00 54.13 54.70 2qw4 s LEU 99 Cb 0.20 -4.05 0.02 0.00 0.03 0.00 0.00 46.19 42.39 2qw4 s LEU 99 CO 0.31 -1.93 1.24 -0.94 0.23 0.00 0.00 176.35 175.25 2qw4 s SER 100 N -3.82 4.37 0.25 2.29 1.04 -1.26 -4.79 113.70 111.78 2qw4 s SER 100 Ca 0.60 2.45 -0.05 0.00 0.48 0.00 0.00 55.95 59.44 2qw4 s SER 100 Cb -0.15 -2.60 0.33 0.00 0.10 0.00 0.00 66.02 63.70 2qw4 s SER 100 CO 0.55 -2.15 1.90 1.55 0.98 0.00 0.00 173.24 176.06 2qw4 h PRO 101 N 0.04 1.19 -0.14 4.02 0.13 -1.96 0.76 132.00 136.04 2qw4 h PRO 101 Ca -0.49 -0.07 -0.01 0.00 -0.87 0.00 0.00 66.00 64.56 2qw4 h PRO 101 Cb 1.31 -0.27 -0.01 0.00 0.13 0.00 0.00 31.00 32.17 2qw4 h PRO 101 CO 0.51 0.79 0.04 0.00 -0.23 0.00 0.00 178.00 179.10 2qw4 h ALA 102 N 1.41 0.19 -0.62 -0.56 0.00 -1.98 -0.18 119.26 117.52 2qw4 h ALA 102 Ca 0.39 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 55.07 2qw4 h ALA 102 Cb 0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2qw4 h ALA 102 CO -0.13 -0.18 0.02 -0.44 0.00 0.00 0.00 179.25 178.52 2qw4 h ASP 103 N 0.04 1.04 -0.54 0.00 5.19 -1.89 0.91 116.42 121.17 2qw4 h ASP 103 Ca 0.05 -0.28 0.16 0.00 -0.62 0.00 0.00 57.03 56.33 2qw4 h ASP 103 Cb 0.25 -0.28 -0.02 0.00 0.18 0.00 0.00 39.33 39.46 2qw4 h ASP 103 CO -0.00 1.08 0.41 1.56 -3.12 0.00 0.00 179.24 179.17 2qw4 h GLN 104 N 0.98 0.00 0.15 3.56 4.20 -0.68 0.17 115.11 123.49 2qw4 h GLN 104 Ca 0.18 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.53 2qw4 h GLN 104 Cb 0.53 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.30 2qw4 h GLN 104 CO 0.03 0.00 -1.90 -0.44 -0.67 0.00 0.00 178.83 175.84 2qw4 h ASP 105 N 0.00 0.49 0.40 1.46 3.32 0.75 -3.07 116.42 119.77 2qw4 h ASP 105 Ca 0.26 -0.95 -0.01 0.00 0.02 0.00 0.00 57.03 56.35 2qw4 h ASP 105 Cb 1.07 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.45 2qw4 h ASP 105 CO -0.00 1.84 -0.31 0.25 -1.72 0.00 0.00 179.24 179.30 2qw4 h LEU 106 N 0.08 -0.79 -0.81 1.55 5.85 0.12 0.58 115.31 121.88 2qw4 h LEU 106 Ca -0.40 0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.42 2qw4 h LEU 106 Cb 2.05 0.25 -0.05 0.00 0.37 0.00 0.00 40.66 43.29 2qw4 h LEU 106 CO 0.12 -0.46 0.51 -0.07 -0.34 0.00 0.00 178.44 178.20 2qw4 h LEU 107 N -0.70 0.84 0.18 2.25 3.38 -0.86 0.13 115.31 120.53 2qw4 h LEU 107 Ca -0.04 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2qw4 h LEU 107 Cb 0.60 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2qw4 h LEU 107 CO -0.00 0.57 -0.09 0.25 0.09 0.00 0.00 178.44 179.26 2qw4 h LEU 108 N 0.98 -0.21 -0.82 1.67 5.85 -1.42 -1.23 115.31 120.13 2qw4 h LEU 108 Ca 0.33 -0.32 0.07 0.00 0.84 0.00 0.00 57.88 58.80 2qw4 h LEU 108 Cb 0.04 0.05 -0.06 0.00 0.37 0.00 0.00 40.66 41.06 2qw4 h LEU 108 CO -0.13 0.28 0.49 -0.33 -0.34 0.00 0.00 178.44 178.41 2qw4 h GLU 109 N -0.77 0.84 0.00 1.25 5.08 0.34 -0.30 114.58 121.01 2qw4 h GLU 109 Ca -0.03 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 2qw4 h GLU 109 Cb 0.52 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 2qw4 h GLU 109 CO 0.04 0.55 -0.10 0.77 -1.00 0.00 0.00 179.01 179.28 2qw4 h SER 110 N 0.86 0.00 0.00 1.42 0.02 -0.73 -3.18 113.55 111.94 2qw4 h SER 110 Ca 0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 2qw4 h SER 110 Cb 0.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.79 2qw4 h SER 110 CO -0.20 0.10 -1.35 0.00 -1.14 0.00 0.00 176.83 174.23 2qw4 n ALA 111 N -2.14 4.00 0.08 3.77 0.00 -0.47 -4.70 120.51 121.05 2qw4 n ALA 111 Ca 0.01 -0.56 -0.14 0.00 0.00 0.00 0.00 53.44 52.75 2qw4 n ALA 111 Cb 0.41 -0.75 -0.09 0.00 0.00 0.00 0.00 19.45 19.03 2qw4 n ALA 111 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2qw4 h PHE 112 N 0.00 -1.34 -0.88 0.00 3.57 -1.06 -1.12 116.94 116.10 2qw4 h PHE 112 Ca 0.00 0.04 0.12 0.00 3.53 0.00 0.00 57.97 61.66 2qw4 h PHE 112 Cb 0.67 0.58 -0.07 0.00 2.79 0.00 0.00 35.95 39.93 2qw4 h PHE 112 CO 0.00 -0.51 0.57 1.25 -2.23 0.00 0.00 178.31 177.39 2qw4 h LEU 113 N -0.63 0.72 -0.04 0.59 5.85 -1.84 0.05 115.31 120.02 2qw4 h LEU 113 Ca 0.00 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.68 2qw4 h LEU 113 Cb 0.65 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.56 2qw4 h LEU 113 CO -0.27 0.40 -0.24 -0.33 -0.34 0.00 0.00 178.44 177.66 2qw4 h GLU 114 N 0.78 0.23 -0.21 1.25 5.08 -1.69 -1.94 114.58 118.09 2qw4 h GLU 114 Ca 0.42 -0.20 0.05 0.00 -1.00 0.00 0.00 59.36 58.63 2qw4 h GLU 114 Cb 0.55 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.77 2qw4 h GLU 114 CO -0.19 0.86 -0.46 -0.07 -1.00 0.00 0.00 179.01 178.16 2qw4 h LEU 115 N -0.34 -1.46 -0.83 1.33 3.38 -0.88 0.15 115.31 116.67 2qw4 h LEU 115 Ca -0.02 0.19 0.07 0.00 0.09 0.00 0.00 57.88 58.22 2qw4 h LEU 115 Cb 0.92 0.60 -0.10 0.00 0.09 0.00 0.00 40.66 42.17 2qw4 h LEU 115 CO 0.05 -0.43 -0.49 0.33 0.09 0.00 0.00 178.44 177.99 2qw4 n PHE 116 N -5.43 -0.36 -0.01 1.13 7.35 -0.03 -0.10 117.46 120.01 2qw4 n PHE 116 Ca -0.04 1.03 -0.10 0.00 -0.76 0.00 0.00 57.45 57.59 2qw4 n PHE 116 Cb 0.36 -0.56 -0.04 0.00 0.35 0.00 0.00 39.48 39.59 2qw4 n PHE 116 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 2qw4 h ILE 117 N 0.00 0.85 -0.17 -2.13 2.04 -0.38 -1.41 117.51 116.31 2qw4 h ILE 117 Ca 0.13 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.98 2qw4 h ILE 117 Cb 0.34 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 2qw4 h ILE 117 CO -0.78 0.00 0.07 0.25 0.00 0.00 0.00 178.15 177.70 2qw4 h LEU 118 N -0.02 0.24 -0.43 1.44 5.85 -0.32 0.23 115.31 122.31 2qw4 h LEU 118 Ca 0.06 -0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.63 2qw4 h LEU 118 Cb 0.11 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 2qw4 h LEU 118 CO -0.14 0.32 0.27 0.03 -0.34 0.00 0.00 178.44 178.58 2qw4 h ARG 119 N 0.13 0.58 -0.38 1.25 3.08 -0.48 -1.87 114.38 116.69 2qw4 h ARG 119 Ca 0.06 -0.05 0.05 0.00 0.07 0.00 0.00 59.98 60.11 2qw4 h ARG 119 Cb 0.16 -0.12 -0.05 0.00 0.08 0.00 0.00 29.97 30.04 2qw4 h ARG 119 CO -0.01 0.42 0.10 1.25 -1.07 0.00 0.00 179.97 180.66 2qw4 h LEU 120 N 0.57 0.07 -0.54 3.04 5.85 -0.92 -2.72 115.31 120.65 2qw4 h LEU 120 Ca 0.15 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 2qw4 h LEU 120 Cb -0.02 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 2qw4 h LEU 120 CO -0.03 0.07 0.22 0.00 -0.34 0.00 0.00 178.44 178.36 2qw4 h ALA 121 N 1.27 0.70 0.00 1.25 0.00 -0.30 -2.10 119.26 120.08 2qw4 h ALA 121 Ca 0.18 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2qw4 h ALA 121 Cb 0.19 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2qw4 h ALA 121 CO -0.21 0.31 -0.40 -0.92 0.00 0.00 0.00 179.25 178.02 2qw4 h TYR 122 N 0.74 0.00 0.00 0.00 3.20 -1.25 -3.24 116.97 116.41 2qw4 h TYR 122 Ca 0.18 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.05 2qw4 h TYR 122 Cb 0.19 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.46 2qw4 h TYR 122 CO 0.01 0.40 -1.73 -2.13 -1.64 0.00 0.00 178.16 173.07 2qw4 n ARG 123 N -3.85 0.48 -1.80 1.82 0.63 -1.04 -4.94 116.66 107.97 2qw4 n ARG 123 Ca -0.01 -0.14 -0.31 0.00 -0.92 0.00 0.00 57.85 56.47 2qw4 n ARG 123 Cb 0.46 -1.52 0.03 0.00 0.45 0.00 0.00 32.46 31.89 2qw4 n ARG 123 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 2qw4 s SER 124 N -4.12 5.73 -0.34 6.15 0.01 -0.80 -4.75 113.70 115.58 2qw4 s SER 124 Ca -0.04 1.37 0.03 0.00 1.31 0.00 0.00 55.95 58.62 2qw4 s SER 124 Cb 0.14 -2.30 0.10 0.00 0.21 0.00 0.00 66.02 64.18 2qw4 s SER 124 CO 0.90 -1.19 0.05 -0.54 0.41 0.00 0.00 173.24 172.87 2qw4 s LYS 125 N -5.20 1.61 0.13 12.44 3.01 -0.90 -4.99 119.74 125.84 2qw4 s LYS 125 Ca 0.57 -1.82 -0.09 0.00 -1.01 0.00 0.00 55.97 53.62 2qw4 s LYS 125 Cb -0.12 -3.21 -0.09 0.00 -1.01 0.00 0.00 37.83 33.40 2qw4 s LYS 125 CO 0.54 -0.91 1.34 -1.35 0.51 0.00 0.00 175.35 175.47 2qw4 h PRO 126 N 7.67 0.67 0.00 -1.68 0.11 -1.93 -1.35 132.00 135.50 2qw4 h PRO 126 Ca -0.06 -0.55 0.00 0.00 0.11 0.00 0.00 66.00 65.49 2qw4 h PRO 126 Cb 1.02 0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2qw4 h PRO 126 CO 0.53 1.17 0.12 0.41 -0.21 0.00 0.00 178.00 180.03 2qw4 n GLY 127 N 0.67 -0.29 1.06 -0.55 0.00 -1.26 0.12 105.19 104.94 2qw4 n GLY 127 Ca -0.07 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.98 2qw4 n GLY 127 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2qw4 n GLU 128 N -1.26 0.00 -4.23 1.61 0.28 -1.21 -5.04 120.64 110.79 2qw4 n GLU 128 Ca 0.00 -1.54 -0.37 0.00 -0.16 0.00 0.00 57.16 55.09 2qw4 n GLU 128 Cb 0.12 -0.20 -0.05 0.00 1.43 0.00 0.00 31.44 32.75 2qw4 n GLU 128 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2qw4 n GLY 129 N 0.28 -0.43 3.36 -1.84 0.00 0.31 -4.93 105.19 101.94 2qw4 n GLY 129 Ca 0.03 0.10 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 2qw4 n GLY 129 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qw4 s LYS 130 N -6.92 3.45 -0.25 1.61 1.02 -0.52 -0.29 119.74 117.84 2qw4 s LYS 130 Ca 0.73 -0.60 -0.14 0.00 0.02 0.00 0.00 55.97 55.99 2qw4 s LYS 130 Cb -0.41 -3.17 -0.04 0.00 -0.52 0.00 0.00 37.83 33.69 2qw4 s LYS 130 CO 0.90 -0.22 0.32 -0.51 -0.92 0.00 0.00 175.35 174.92 2qw4 s LEU 131 N 1.53 4.07 -0.29 3.17 1.02 0.87 -2.11 118.68 126.94 2qw4 s LEU 131 Ca 0.06 0.27 -0.10 0.00 0.02 0.00 0.00 54.13 54.38 2qw4 s LEU 131 Cb -0.15 -2.35 -0.03 0.00 0.02 0.00 0.00 46.19 43.68 2qw4 s LEU 131 CO -0.00 -0.10 0.16 -0.63 0.02 0.00 0.00 176.35 175.80 2qw4 s ILE 132 N 1.69 4.89 0.53 -0.59 -1.09 -1.26 -1.15 121.20 124.23 2qw4 s ILE 132 Ca 0.14 -0.10 -0.01 0.00 -2.23 0.00 0.00 60.65 58.44 2qw4 s ILE 132 Cb -0.15 -3.38 0.02 0.00 -1.58 0.00 0.00 42.46 37.36 2qw4 s ILE 132 CO 0.09 0.19 0.77 -0.36 -1.23 0.00 0.00 174.94 174.41 2qw4 s PHE 133 N 1.68 3.09 0.41 3.97 0.40 0.08 -4.65 117.98 122.97 2qw4 s PHE 133 Ca 0.06 0.25 0.13 0.00 -0.60 0.00 0.00 56.93 56.77 2qw4 s PHE 133 Cb -0.16 -2.60 0.87 0.00 0.51 0.00 0.00 43.02 41.64 2qw4 s PHE 133 CO 0.08 -0.69 1.93 0.00 0.70 0.00 0.00 175.22 177.24 2qw4 n SER 135 N -4.26 0.00 0.00 0.00 3.41 -1.26 -3.85 113.62 107.66 2qw4 n SER 135 Ca -0.02 0.37 0.00 0.00 -0.26 0.00 0.00 58.87 58.96 2qw4 n SER 135 Cb 0.29 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 2qw4 n SER 135 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qw4 n GLY 136 N -0.54 0.74 3.67 5.00 0.00 0.38 -4.82 105.19 109.62 2qw4 n GLY 136 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 2qw4 n GLY 136 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qw4 s LEU 137 N 0.00 4.22 0.37 0.99 2.96 -1.25 -0.34 118.68 125.63 2qw4 s LEU 137 Ca 0.00 1.73 -0.13 0.00 -0.22 0.00 0.00 54.13 55.51 2qw4 s LEU 137 Cb 0.00 -3.55 -0.08 0.00 0.50 0.00 0.00 46.19 43.06 2qw4 s LEU 137 CO 0.00 -0.67 0.77 -0.69 -1.32 0.00 0.00 176.35 174.44 2qw4 s VAL 138 N 2.85 4.72 -0.28 1.68 1.01 -0.66 -0.74 120.40 128.98 2qw4 s VAL 138 Ca 0.55 0.82 -0.24 0.00 0.00 0.00 0.00 61.98 63.10 2qw4 s VAL 138 Cb -0.23 -3.67 0.11 0.00 0.00 0.00 0.00 36.38 32.60 2qw4 s VAL 138 CO 0.18 -0.37 0.97 -0.22 0.00 0.00 0.00 175.10 175.66 2qw4 s LEU 139 N -3.44 -0.51 0.44 3.92 2.96 -0.30 -4.23 118.68 117.53 2qw4 s LEU 139 Ca 0.53 0.97 -0.21 0.00 -0.22 0.00 0.00 54.13 55.20 2qw4 s LEU 139 Cb -0.10 1.97 -0.10 0.00 0.50 0.00 0.00 46.19 48.46 2qw4 s LEU 139 CO 0.24 -0.17 0.98 -2.28 -1.32 0.00 0.00 176.35 173.81 2qw4 s HIS 140 N 0.34 3.23 0.18 5.38 2.46 -1.26 -0.09 115.29 125.53 2qw4 s HIS 140 Ca 0.02 1.61 -0.24 0.00 0.47 0.00 0.00 55.06 56.92 2qw4 s HIS 140 Cb -0.05 -2.92 0.07 0.00 -0.13 0.00 0.00 32.58 29.55 2qw4 s HIS 140 CO -0.06 -0.32 1.57 -0.09 -2.47 0.00 0.00 174.74 173.37 2qw4 h ARG 141 N 1.88 -0.16 0.00 2.88 2.43 -1.01 0.13 114.38 120.52 2qw4 h ARG 141 Ca -0.49 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 2qw4 h ARG 141 Cb 1.19 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 2qw4 h ARG 141 CO 0.61 -0.11 0.00 1.28 -1.51 0.00 0.00 179.97 180.24 2qw4 n LEU 142 N -5.41 0.77 0.08 3.80 4.77 -1.26 -0.80 117.00 118.94 2qw4 n LEU 142 Ca 0.03 0.64 -0.09 0.00 -0.03 0.00 0.00 56.01 56.56 2qw4 n LEU 142 Cb 0.35 -0.47 0.01 0.00 -2.33 0.00 0.00 43.42 40.98 2qw4 n LEU 142 CO -0.04 -0.43 0.29 -0.61 -1.33 0.00 0.00 177.39 175.28 2qw4 h GLN 143 N 0.00 0.28 0.00 3.23 4.15 -1.32 -3.33 115.11 118.12 2qw4 h GLN 143 Ca 0.00 -0.27 -0.22 0.00 0.77 0.00 0.00 58.65 58.93 2qw4 h GLN 143 Cb 0.52 0.07 -0.04 0.00 0.21 0.00 0.00 27.48 28.25 2qw4 h GLN 143 CO 0.00 0.96 -1.30 0.00 -1.93 0.00 0.00 178.83 176.56 2qw4 h ALA 145 N 1.16 2.74 -0.19 0.00 0.00 -1.29 -0.96 119.26 120.73 2qw4 h ALA 145 Ca -0.15 0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.80 2qw4 h ALA 145 Cb 1.77 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.62 2qw4 h ALA 145 CO 0.08 -1.17 -0.11 -2.13 0.00 0.00 0.00 179.25 175.93 2qw4 n ARG 146 N -4.43 -0.08 0.00 0.00 3.00 -1.23 -0.78 116.66 113.14 2qw4 n ARG 146 Ca 0.28 1.09 0.07 0.00 -0.00 0.00 0.00 57.85 59.30 2qw4 n ARG 146 Cb 1.17 -1.62 -0.03 0.00 0.00 0.00 0.00 32.46 31.98 2qw4 n ARG 146 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2qw4 n GLY 147 N -1.05 -0.15 0.01 5.14 0.00 -0.93 -4.37 105.19 103.84 2qw4 n GLY 147 Ca 0.00 -0.44 0.11 0.00 0.00 0.00 0.00 46.02 45.69 2qw4 n GLY 147 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2qw4 n PHE 148 N -0.48 0.00 -4.78 1.61 3.01 -0.41 -4.92 117.46 111.49 2qw4 n PHE 148 Ca 0.05 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.51 2qw4 n PHE 148 Cb 0.30 -0.35 0.00 0.00 -0.01 0.00 0.00 39.48 39.42 2qw4 n PHE 148 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2qw4 n GLY 149 N 1.34 0.71 0.07 1.37 0.00 0.04 -2.79 105.19 105.92 2qw4 n GLY 149 Ca -0.02 -0.72 0.12 0.00 0.00 0.00 0.00 46.02 45.40 2qw4 n GLY 149 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qw4 n ASP 150 N -2.13 0.42 -0.23 1.61 10.43 -1.26 -2.90 116.55 122.49 2qw4 n ASP 150 Ca 0.00 0.57 -0.10 0.00 2.57 0.00 0.00 54.79 57.83 2qw4 n ASP 150 Cb 0.00 -0.67 -0.06 0.00 1.84 0.00 0.00 41.12 42.22 2qw4 n ASP 150 CO 0.00 0.00 0.00 -0.25 -1.07 0.00 0.00 177.20 175.88 2qw4 h TRP 151 N 0.00 -1.52 -1.06 1.24 7.01 -1.88 -2.07 115.95 117.68 2qw4 h TRP 151 Ca 0.00 0.09 0.28 0.00 2.11 0.00 0.00 58.89 61.37 2qw4 h TRP 151 Cb 0.47 0.75 -0.11 0.00 -2.10 0.00 0.00 29.16 28.17 2qw4 h TRP 151 CO 0.00 -0.44 0.66 0.97 -2.79 0.00 0.00 178.44 176.85 2qw4 h ILE 152 N -0.24 0.47 -0.65 2.65 6.09 -1.63 0.54 117.51 124.75 2qw4 h ILE 152 Ca 0.15 -0.14 -0.02 0.00 -1.37 0.00 0.00 64.86 63.48 2qw4 h ILE 152 Cb 0.55 0.03 -0.03 0.00 0.47 0.00 0.00 36.82 37.84 2qw4 h ILE 152 CO -0.71 0.07 0.33 0.44 -3.07 0.00 0.00 178.15 175.21 2qw4 h ASP 153 N 0.40 0.83 0.32 2.19 3.32 -1.58 0.76 116.42 122.66 2qw4 h ASP 153 Ca 0.64 -0.11 -0.16 0.00 0.02 0.00 0.00 57.03 57.41 2qw4 h ASP 153 Cb 1.55 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.88 2qw4 h ASP 153 CO -0.37 0.70 -0.66 0.28 -1.72 0.00 0.00 179.24 177.47 2qw4 h SER 154 N 0.89 0.36 -0.42 6.45 0.02 0.14 0.45 113.55 121.43 2qw4 h SER 154 Ca 0.23 -0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2qw4 h SER 154 Cb 0.08 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.49 2qw4 h SER 154 CO -0.03 0.92 0.27 0.40 -1.14 0.00 0.00 176.83 177.25 2qw4 h ILE 155 N 0.22 1.12 -0.45 3.27 2.04 -1.16 0.27 117.51 122.82 2qw4 h ILE 155 Ca -0.02 -0.23 -0.07 0.00 1.00 0.00 0.00 64.86 65.54 2qw4 h ILE 155 Cb 1.20 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 2qw4 h ILE 155 CO 0.11 0.11 0.00 -0.07 0.00 0.00 0.00 178.15 178.30 2qw4 h LEU 156 N 0.57 0.77 -0.14 1.44 3.38 -0.21 0.11 115.31 121.22 2qw4 h LEU 156 Ca 0.15 -0.31 0.04 0.00 0.09 0.00 0.00 57.88 57.86 2qw4 h LEU 156 Cb -0.05 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.45 2qw4 h LEU 156 CO -0.03 0.89 -0.16 0.00 0.09 0.00 0.00 178.44 179.22 2qw4 h ALA 157 N 0.91 -0.07 -0.91 1.53 0.00 -0.04 0.42 119.26 121.09 2qw4 h ALA 157 Ca 0.13 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.13 2qw4 h ALA 157 Cb 0.49 0.33 -0.05 0.00 0.00 0.00 0.00 17.79 18.56 2qw4 h ALA 157 CO 0.02 -0.61 0.59 0.35 0.00 0.00 0.00 179.25 179.60 2qw4 h PHE 158 N -0.20 1.10 -0.57 0.00 3.57 -0.84 -0.02 116.94 119.99 2qw4 h PHE 158 Ca 0.10 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.61 2qw4 h PHE 158 Cb 0.34 -0.37 -0.03 0.00 2.79 0.00 0.00 35.95 38.69 2qw4 h PHE 158 CO -0.28 0.63 0.27 1.03 -2.23 0.00 0.00 178.31 177.73 2qw4 h SER 159 N 1.13 0.72 -0.54 0.41 0.87 0.40 -0.58 113.55 115.96 2qw4 h SER 159 Ca 0.36 -0.07 -0.07 0.00 -1.23 0.00 0.00 61.79 60.79 2qw4 h SER 159 Cb 0.02 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 61.77 2qw4 h SER 159 CO -0.12 0.62 0.10 -0.09 -0.53 0.00 0.00 176.83 176.81 2qw4 h ARG 160 N 0.80 0.94 0.30 2.24 2.43 0.12 -2.41 114.38 118.81 2qw4 h ARG 160 Ca 0.20 -0.22 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2qw4 h ARG 160 Cb 0.09 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.48 2qw4 h ARG 160 CO -0.03 0.86 -0.52 1.03 -1.51 0.00 0.00 179.97 179.81 2qw4 h SER 161 N 0.89 -1.51 -0.30 -3.80 0.87 -0.10 -2.78 113.55 106.82 2qw4 h SER 161 Ca 0.18 0.14 0.07 0.00 -1.23 0.00 0.00 61.79 60.96 2qw4 h SER 161 Cb 0.38 0.53 -0.07 0.00 -0.44 0.00 0.00 62.40 62.79 2qw4 h SER 161 CO 0.01 -0.61 -0.20 -0.07 -0.53 0.00 0.00 176.83 175.42 2qw4 h LEU 162 N -0.88 -0.67 -1.22 2.23 3.38 -0.98 -2.67 115.31 114.50 2qw4 h LEU 162 Ca -0.03 0.14 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 2qw4 h LEU 162 Cb 0.82 0.34 -0.02 0.00 0.09 0.00 0.00 40.66 41.89 2qw4 h LEU 162 CO -0.18 -0.24 0.17 0.45 0.09 0.00 0.00 178.44 178.73 2qw4 h HIS 163 N -0.17 0.72 0.00 1.13 3.86 -1.48 -1.72 115.15 117.48 2qw4 h HIS 163 Ca 0.16 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.33 2qw4 h HIS 163 Cb 0.42 -0.22 0.00 0.00 1.06 0.00 0.00 27.41 28.67 2qw4 h HIS 163 CO -0.39 0.58 0.00 0.43 0.86 0.00 0.00 177.93 179.40 2qw4 n SER 164 N -4.33 0.61 0.10 2.45 7.64 -1.02 -0.98 113.62 118.09 2qw4 n SER 164 Ca 0.04 0.68 0.12 0.00 1.01 0.00 0.00 58.87 60.71 2qw4 n SER 164 Cb 0.17 -0.79 0.07 0.00 -1.01 0.00 0.00 64.21 62.65 2qw4 n SER 164 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2qw4 h LEU 165 N 0.00 0.00 -1.22 -3.43 5.85 -1.21 -3.48 115.31 111.82 2qw4 h LEU 165 Ca 0.00 -0.08 -0.43 0.00 0.84 0.00 0.00 57.88 58.22 2qw4 h LEU 165 Cb 0.28 0.00 0.05 0.00 0.37 0.00 0.00 40.66 41.36 2qw4 h LEU 165 CO 0.00 0.04 -0.76 0.18 -0.34 0.00 0.00 178.44 177.56 2qw4 n LEU 166 N -2.52 -3.07 -4.67 2.25 4.77 -0.15 -4.90 117.00 108.73 2qw4 n LEU 166 Ca 0.01 -0.71 -0.42 0.00 -0.03 0.00 0.00 56.01 54.86 2qw4 n LEU 166 Cb 0.51 -2.77 -0.03 0.00 -2.33 0.00 0.00 43.42 38.80 2qw4 n LEU 166 CO 0.38 0.49 1.52 -0.69 -1.33 0.00 0.00 177.39 177.77 2qw4 s VAL 167 N -3.40 3.03 0.88 4.08 1.01 -1.26 -4.98 120.40 119.76 2qw4 s VAL 167 Ca 0.41 0.17 -0.12 0.00 0.00 0.00 0.00 61.98 62.44 2qw4 s VAL 167 Cb -0.20 -3.11 0.12 0.00 0.00 0.00 0.00 36.38 33.19 2qw4 s VAL 167 CO 0.79 -0.01 1.14 1.51 0.00 0.00 0.00 175.10 178.52 2qw4 s ASP 168 N 3.83 3.84 0.06 3.32 1.47 -1.26 -4.80 116.67 123.12 2qw4 s ASP 168 Ca 0.84 0.99 -0.29 0.00 1.18 0.00 0.00 52.55 55.26 2qw4 s ASP 168 Cb -0.41 -1.58 -0.18 0.00 -0.34 0.00 0.00 42.92 40.41 2qw4 s ASP 168 CO 0.38 -2.35 1.56 0.58 0.68 0.00 0.00 175.17 176.03 2qw4 h VAL 169 N -1.36 0.53 -0.61 2.11 2.07 -1.98 -0.80 116.25 116.22 2qw4 h VAL 169 Ca -0.49 -0.12 0.12 0.00 0.82 0.00 0.00 66.70 67.02 2qw4 h VAL 169 Cb 1.32 0.59 -0.09 0.00 -1.52 0.00 0.00 31.29 31.59 2qw4 h VAL 169 CO 0.62 0.02 0.11 -0.65 0.02 0.00 0.00 177.57 177.70 2qw4 h PRO 170 N -0.71 0.23 -0.50 1.57 0.11 -1.96 0.35 132.00 131.10 2qw4 h PRO 170 Ca -0.06 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 2qw4 h PRO 170 Cb 0.52 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.56 2qw4 h PRO 170 CO 0.11 0.15 0.28 0.00 -0.21 0.00 0.00 178.00 178.33 2qw4 h ALA 171 N 1.49 0.63 -0.23 -0.75 0.00 -1.91 -0.16 119.26 118.34 2qw4 h ALA 171 Ca 0.32 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.16 2qw4 h ALA 171 Cb 0.49 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2qw4 h ALA 171 CO -0.42 0.14 0.15 0.35 0.00 0.00 0.00 179.25 179.48 2qw4 h PHE 172 N 0.66 0.25 0.00 0.00 3.57 -0.16 0.20 116.94 121.46 2qw4 h PHE 172 Ca 0.18 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.58 2qw4 h PHE 172 Cb 0.03 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 2qw4 h PHE 172 CO -0.02 0.16 -0.47 0.00 -2.23 0.00 0.00 178.31 175.74 2qw4 h ALA 173 N 1.86 0.91 0.03 2.41 0.00 0.86 -1.07 119.26 124.26 2qw4 h ALA 173 Ca 0.09 -0.43 -0.10 0.00 0.00 0.00 0.00 54.91 54.48 2qw4 h ALA 173 Cb 0.03 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.76 2qw4 h ALA 173 CO -0.02 0.59 -0.39 0.00 0.00 0.00 0.00 179.25 179.43 2qw4 h LEU 175 N -0.48 -0.52 -1.12 0.00 7.12 -0.44 0.76 115.31 120.62 2qw4 h LEU 175 Ca -0.06 0.10 -0.08 0.00 0.13 0.00 0.00 57.88 57.97 2qw4 h LEU 175 Cb 1.19 0.25 -0.01 0.00 -0.53 0.00 0.00 40.66 41.56 2qw4 h LEU 175 CO 0.08 -0.21 -0.23 0.77 -0.13 0.00 0.00 178.44 178.71 2qw4 h SER 176 N -0.20 0.33 -0.69 1.25 4.64 -1.35 -2.09 113.55 115.44 2qw4 h SER 176 Ca 0.11 -0.10 -0.02 0.00 -0.47 0.00 0.00 61.79 61.31 2qw4 h SER 176 Cb 0.35 -0.09 -0.03 0.00 -0.31 0.00 0.00 62.40 62.32 2qw4 h SER 176 CO -0.27 0.57 0.36 0.00 -0.87 0.00 0.00 176.83 176.62 2qw4 h ALA 177 N 1.46 0.89 -0.77 5.18 0.00 -1.29 -2.42 119.26 122.31 2qw4 h ALA 177 Ca 0.05 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2qw4 h ALA 177 Cb 0.58 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 2qw4 h ALA 177 CO 0.04 0.43 0.45 -0.07 0.00 0.00 0.00 179.25 180.09 2qw4 h LEU 178 N 0.95 0.93 -1.99 0.00 3.38 -0.48 0.31 115.31 118.41 2qw4 h LEU 178 Ca 0.24 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 2qw4 h LEU 178 Cb 0.08 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 2qw4 h LEU 178 CO -0.03 0.73 -0.07 0.58 0.09 0.00 0.00 178.44 179.73 2qw4 h VAL 179 N 1.06 0.87 0.00 1.22 2.07 -0.90 -3.12 116.25 117.45 2qw4 h VAL 179 Ca 0.28 -0.26 -0.06 0.00 0.82 0.00 0.00 66.70 67.47 2qw4 h VAL 179 Cb -0.02 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 2qw4 h VAL 179 CO -0.05 0.07 -0.43 0.25 0.02 0.00 0.00 177.57 177.43 2qw4 h LEU 180 N 0.00 0.00 -8.02 2.57 5.85 -1.03 -3.43 115.31 111.25 2qw4 h LEU 180 Ca -0.00 -0.44 -0.69 0.00 0.84 0.00 0.00 57.88 57.59 2qw4 h LEU 180 Cb 0.14 0.00 -0.18 0.00 0.37 0.00 0.00 40.66 41.00 2qw4 h LEU 180 CO 0.01 0.96 0.71 -0.63 -0.34 0.00 0.00 178.44 179.16 2qw4 s ILE 181 N -2.10 4.72 0.10 4.05 1.01 0.10 -4.83 121.20 124.24 2qw4 s ILE 181 Ca -0.16 -1.41 -0.19 0.00 0.00 0.00 0.00 60.65 58.89 2qw4 s ILE 181 Cb 0.01 -4.73 0.04 0.00 0.01 0.00 0.00 42.46 37.79 2qw4 s ILE 181 CO 0.41 -1.45 0.46 0.28 0.00 0.00 0.00 174.94 174.63 2qw4 s THR 182 N 2.76 0.05 0.16 2.92 -1.32 -1.26 -4.62 115.64 114.34 2qw4 s THR 182 Ca 0.29 -0.40 -0.31 0.00 -1.21 0.00 0.00 61.69 60.06 2qw4 s THR 182 Cb -0.08 -1.06 -0.09 0.00 -1.51 0.00 0.00 72.50 69.76 2qw4 s THR 182 CO -0.06 -0.22 1.42 -0.62 -2.21 0.00 0.00 174.62 172.94 2qw4 s ASP 183 N -2.46 6.75 -0.02 8.08 2.15 -1.26 -5.00 116.67 124.91 2qw4 s ASP 183 Ca -0.01 2.46 0.03 0.00 0.43 0.00 0.00 52.55 55.47 2qw4 s ASP 183 Cb 0.00 -2.60 -0.00 0.00 -0.30 0.00 0.00 42.92 40.02 2qw4 s ASP 183 CO -0.08 -0.68 -0.11 -0.13 -0.17 0.00 0.00 175.17 174.00 2qw4 s ARG 184 N 0.64 1.08 0.01 4.34 1.81 -1.26 -5.12 118.95 120.46 2qw4 s ARG 184 Ca 0.63 -0.39 -0.30 0.00 -1.72 0.00 0.00 55.73 53.95 2qw4 s ARG 184 Cb -0.39 -1.01 -0.05 0.00 -0.45 0.00 0.00 34.95 33.04 2qw4 s ARG 184 CO 0.34 0.18 1.35 -1.01 -0.68 0.00 0.00 175.30 175.48 2qw4 s HIS 185 N 0.00 3.02 0.00 -0.53 3.76 -1.26 -2.36 115.29 117.92 2qw4 s HIS 185 Ca -0.00 0.95 0.00 0.00 -0.15 0.00 0.00 55.06 55.85 2qw4 s HIS 185 Cb -0.08 -3.60 0.00 0.00 1.11 0.00 0.00 32.58 30.01 2qw4 s HIS 185 CO 0.00 -2.14 0.00 0.41 -0.85 0.00 0.00 174.74 172.17 2qw4 n GLY 186 N 3.54 0.96 3.71 -2.22 0.00 -1.26 -5.07 105.19 104.85 2qw4 n GLY 186 Ca 0.12 -0.53 -0.41 0.00 0.00 0.00 0.00 46.02 45.19 2qw4 n GLY 186 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qw4 s LEU 187 N -0.16 4.35 0.24 0.99 1.43 -0.99 -4.95 118.68 119.58 2qw4 s LEU 187 Ca 0.00 1.53 -0.05 0.00 -1.03 0.00 0.00 54.13 54.57 2qw4 s LEU 187 Cb 0.00 -3.43 0.38 0.00 0.03 0.00 0.00 46.19 43.17 2qw4 s LEU 187 CO 0.00 -0.22 1.78 1.56 0.23 0.00 0.00 176.35 179.70 2qw4 h GLN 188 N 6.80 0.62 -2.23 1.70 4.20 -1.96 -3.37 115.11 120.87 2qw4 h GLN 188 Ca -0.41 -0.04 -0.58 0.00 0.06 0.00 0.00 58.65 57.69 2qw4 h GLN 188 Cb 1.21 -0.14 -0.39 0.00 0.30 0.00 0.00 27.48 28.47 2qw4 h GLN 188 CO 0.75 0.41 -1.02 0.39 -0.67 0.00 0.00 178.83 178.70 2qw4 n GLU 189 N -4.84 0.48 -0.14 1.46 1.02 -1.26 -4.99 120.64 112.36 2qw4 n GLU 189 Ca 0.13 -3.25 -0.03 0.00 -0.02 0.00 0.00 57.16 53.98 2qw4 n GLU 189 Cb 0.30 -1.51 0.18 0.00 -0.02 0.00 0.00 31.44 30.39 2qw4 n GLU 189 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2qw4 h PRO 190 N 4.93 0.86 -0.41 3.49 0.13 -1.97 -2.77 132.00 136.26 2qw4 h PRO 190 Ca 0.18 -0.18 0.07 0.00 -0.87 0.00 0.00 66.00 65.21 2qw4 h PRO 190 Cb 0.89 -0.13 -0.09 0.00 0.13 0.00 0.00 31.00 31.80 2qw4 h PRO 190 CO 0.42 0.77 -0.39 0.00 -0.23 0.00 0.00 178.00 178.58 2qw4 h ARG 191 N 0.83 -0.29 0.28 0.86 -0.00 -1.96 0.68 114.38 114.79 2qw4 h ARG 191 Ca 0.18 0.02 0.00 0.00 -0.50 0.00 0.00 59.98 59.68 2qw4 h ARG 191 Cb 0.30 0.06 -0.02 0.00 0.00 0.00 0.00 29.97 30.31 2qw4 h ARG 191 CO -0.00 -0.19 -0.29 0.00 0.00 0.00 0.00 179.97 179.49 2qw4 h ARG 192 N -0.30 -0.58 -0.71 0.04 3.08 -1.93 -1.25 114.38 112.73 2qw4 h ARG 192 Ca 0.15 0.04 0.15 0.00 0.07 0.00 0.00 59.98 60.40 2qw4 h ARG 192 Cb 0.57 0.13 -0.13 0.00 0.08 0.00 0.00 29.97 30.63 2qw4 h ARG 192 CO -0.57 -0.39 -0.05 0.28 -1.07 0.00 0.00 179.97 178.17 2qw4 h VAL 193 N -0.61 0.36 -0.92 2.04 2.07 -1.53 0.48 116.25 118.14 2qw4 h VAL 193 Ca -0.01 -0.02 0.10 0.00 0.82 0.00 0.00 66.70 67.58 2qw4 h VAL 193 Cb 0.56 0.28 -0.08 0.00 -1.52 0.00 0.00 31.29 30.54 2qw4 h VAL 193 CO -0.07 0.01 0.56 -0.08 0.02 0.00 0.00 177.57 178.01 2qw4 h GLU 194 N 0.07 0.91 -0.35 1.57 4.81 -0.11 0.34 114.58 121.82 2qw4 h GLU 194 Ca 0.37 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.54 2qw4 h GLU 194 Cb 0.62 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 2qw4 h GLU 194 CO -0.65 0.60 0.20 0.93 -0.73 0.00 0.00 179.01 179.36 2qw4 h GLU 195 N 0.94 0.48 -0.39 1.92 5.08 0.10 0.12 114.58 122.82 2qw4 h GLU 195 Ca 0.44 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.65 2qw4 h GLU 195 Cb 0.36 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 2qw4 h GLU 195 CO -0.24 0.39 -0.13 1.25 -1.00 0.00 0.00 179.01 179.28 2qw4 h LEU 196 N 0.44 0.79 -0.59 1.33 5.85 -0.57 -1.11 115.31 121.46 2qw4 h LEU 196 Ca 0.12 -0.38 0.11 0.00 0.84 0.00 0.00 57.88 58.58 2qw4 h LEU 196 Cb 0.04 -0.22 -0.09 0.00 0.37 0.00 0.00 40.66 40.77 2qw4 h LEU 196 CO -0.02 0.99 0.10 -0.61 -0.34 0.00 0.00 178.44 178.56 2qw4 h GLN 197 N 0.59 0.22 -0.49 1.25 4.15 -0.06 -1.81 115.11 118.95 2qw4 h GLN 197 Ca 0.09 -0.01 0.03 0.00 0.77 0.00 0.00 58.65 59.53 2qw4 h GLN 197 Cb 0.67 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.27 2qw4 h GLN 197 CO 0.05 0.15 0.29 -0.91 -1.93 0.00 0.00 178.83 176.47 2qw4 h ASN 198 N 0.23 0.46 0.07 -0.69 2.35 -0.17 -0.89 115.58 116.94 2qw4 h ASN 198 Ca 0.31 0.01 0.01 0.00 -0.55 0.00 0.00 56.30 56.08 2qw4 h ASN 198 Cb 0.47 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.73 2qw4 h ASN 198 CO -0.42 0.33 -0.14 0.03 -1.65 0.00 0.00 177.43 175.58 2qw4 h ARG 199 N 0.57 -0.27 0.02 0.81 3.08 -0.40 -0.24 114.38 117.96 2qw4 h ARG 199 Ca 0.20 0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.29 2qw4 h ARG 199 Cb 0.03 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 2qw4 h ARG 199 CO -0.10 -0.18 -0.12 0.82 -1.07 0.00 0.00 179.97 179.32 2qw4 h ILE 200 N -0.28 0.69 -0.45 2.04 2.04 -1.27 -0.82 117.51 119.47 2qw4 h ILE 200 Ca 0.03 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.97 2qw4 h ILE 200 Cb 0.30 0.69 -0.08 0.00 -0.74 0.00 0.00 36.82 36.99 2qw4 h ILE 200 CO -0.09 0.00 -0.08 0.00 0.00 0.00 0.00 178.15 177.98 2qw4 h ALA 201 N 0.72 0.33 0.00 1.87 0.00 -0.99 0.16 119.26 121.35 2qw4 h ALA 201 Ca 0.04 0.16 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 2qw4 h ALA 201 Cb 0.27 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2qw4 h ALA 201 CO -0.11 -0.43 -0.27 0.66 0.00 0.00 0.00 179.25 179.10 2qw4 h SER 202 N 0.03 0.00 -0.16 0.00 4.64 -0.79 -1.47 113.55 115.80 2qw4 h SER 202 Ca 0.22 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.49 2qw4 h SER 202 Cb 0.33 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.42 2qw4 h SER 202 CO -0.43 0.27 -0.09 0.00 -0.87 0.00 0.00 176.83 175.70 2qw4 h LEU 204 N 0.02 -1.20 -0.71 0.00 5.85 -0.42 -2.92 115.31 115.92 2qw4 h LEU 204 Ca 0.03 0.14 0.13 0.00 0.84 0.00 0.00 57.88 59.02 2qw4 h LEU 204 Cb 0.58 0.46 -0.13 0.00 0.37 0.00 0.00 40.66 41.94 2qw4 h LEU 204 CO 0.03 -0.37 -0.29 0.11 -0.34 0.00 0.00 178.44 177.58 2qw4 h LYS 205 N -0.48 -0.08 -0.83 1.25 1.79 -1.18 0.12 116.57 117.17 2qw4 h LYS 205 Ca 0.01 0.01 0.14 0.00 -2.18 0.00 0.00 60.65 58.63 2qw4 h LYS 205 Cb 0.52 0.02 -0.15 0.00 -1.58 0.00 0.00 32.23 31.04 2qw4 h LYS 205 CO -0.27 -0.05 -0.32 1.49 -1.08 0.00 0.00 179.45 179.22 2qw4 h GLU 206 N -0.08 -0.05 0.01 3.15 4.57 -1.11 -0.64 114.58 120.43 2qw4 h GLU 206 Ca 0.30 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.48 2qw4 h GLU 206 Cb 0.56 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.16 2qw4 h GLU 206 CO -0.76 -0.03 -0.00 1.25 -1.18 0.00 0.00 179.01 178.28 2qw4 h HIS 207 N -0.05 -0.01 0.00 0.92 2.76 -0.59 -1.58 115.15 116.60 2qw4 h HIS 207 Ca 0.33 -0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.45 2qw4 h HIS 207 Cb 0.59 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.55 2qw4 h HIS 207 CO -0.74 0.29 -0.23 -0.39 -1.30 0.00 0.00 177.93 175.56 2qw4 h VAL 208 N -0.32 0.55 -0.02 5.26 -1.51 -1.21 -1.85 116.25 117.15 2qw4 h VAL 208 Ca -0.00 -1.19 0.02 0.00 -1.23 0.00 0.00 66.70 64.30 2qw4 h VAL 208 Cb 0.31 1.82 -0.05 0.00 -2.13 0.00 0.00 31.29 31.23 2qw4 h VAL 208 CO 0.00 0.23 -0.50 0.00 -1.23 0.00 0.00 177.57 176.08 2qw4 h ALA 209 N 1.77 -0.91 -0.80 5.19 0.00 -0.88 -2.94 119.26 120.69 2qw4 h ALA 209 Ca -0.00 -0.08 0.18 0.00 0.00 0.00 0.00 54.91 55.02 2qw4 h ALA 209 Cb 0.80 0.93 -0.12 0.00 0.00 0.00 0.00 17.79 19.40 2qw4 h ALA 209 CO 0.03 -1.06 0.21 0.00 0.00 0.00 0.00 179.25 178.43 2qw4 h ALA 210 N -0.50 1.09 -0.99 0.00 0.00 -0.45 -3.02 119.26 115.38 2qw4 h ALA 210 Ca 0.01 0.18 -0.65 0.00 0.00 0.00 0.00 54.91 54.46 2qw4 h ALA 210 Cb 0.66 0.25 -0.09 0.00 0.00 0.00 0.00 17.79 18.60 2qw4 h ALA 210 CO -0.34 -0.37 1.89 0.08 0.00 0.00 0.00 179.25 180.51 2qw4 s VAL 211 N -6.00 4.07 0.00 0.00 1.01 -1.02 -4.70 120.40 113.76 2qw4 s VAL 211 Ca -0.12 -1.48 0.00 0.00 0.00 0.00 0.00 61.98 60.38 2qw4 s VAL 211 Cb 0.23 -5.13 0.00 0.00 0.00 0.00 0.00 36.38 31.48 2qw4 s VAL 211 CO 0.76 -1.98 0.00 0.00 0.00 0.00 0.00 175.10 173.89 2qw4 n ALA 212 N 8.50 0.00 -0.05 5.51 0.00 -1.14 -4.89 120.51 128.43 2qw4 n ALA 212 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.86 2qw4 n ALA 212 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 2qw4 n ALA 212 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qw4 n GLY 213 N 0.00 0.38 2.66 0.00 0.00 -1.22 -5.05 105.19 101.96 2qw4 n GLY 213 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2qw4 n GLY 213 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2qw4 n PRO 217 N 0.00 0.00 -3.39 1.61 -0.09 -1.26 -4.75 135.00 127.13 2qw4 n PRO 217 Ca 0.00 0.00 -0.38 0.00 -0.09 0.00 0.00 63.50 63.03 2qw4 n PRO 217 Cb 0.00 0.00 -0.06 0.00 -0.09 0.00 0.00 33.50 33.35 2qw4 n PRO 217 CO 0.00 0.00 0.00 0.00 -0.09 0.00 0.00 175.50 175.41 2qw4 s ALA 218 N -1.02 3.63 0.07 0.58 0.00 -1.26 -4.90 121.76 118.87 2qw4 s ALA 218 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 51.96 51.86 2qw4 s ALA 218 Cb 0.00 -2.52 -0.04 0.00 0.00 0.00 0.00 23.12 20.56 2qw4 s ALA 218 CO 0.00 0.40 0.22 0.45 0.00 0.00 0.00 175.76 176.83 2qw4 s SER 219 N -0.90 6.36 0.00 0.00 0.15 -1.26 -3.34 113.70 114.70 2qw4 s SER 219 Ca 0.26 0.25 0.00 0.00 0.70 0.00 0.00 55.95 57.17 2qw4 s SER 219 Cb -0.18 -1.95 0.00 0.00 -1.71 0.00 0.00 66.02 62.18 2qw4 s SER 219 CO 0.15 0.15 0.00 0.00 1.20 0.00 0.00 173.24 174.74 2qw4 h LEU 221 N 0.00 -0.88 -1.55 0.00 4.07 -1.90 -2.69 115.31 112.36 2qw4 h LEU 221 Ca 0.00 0.13 0.00 0.00 0.08 0.00 0.00 57.88 58.09 2qw4 h LEU 221 Cb 0.00 0.37 0.00 0.00 1.08 0.00 0.00 40.66 42.11 2qw4 h LEU 221 CO 0.00 -0.34 0.00 0.77 -1.08 0.00 0.00 178.44 177.79 2qw4 h SER 222 N -0.40 0.00 0.05 -0.43 4.64 -1.90 0.72 113.55 116.23 2qw4 h SER 222 Ca 0.08 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.40 2qw4 h SER 222 Cb 0.52 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2qw4 h SER 222 CO -0.30 0.00 -0.04 -0.09 -0.87 0.00 0.00 176.83 175.54 2qw4 h ARG 223 N 0.00 -0.08 -0.68 4.77 2.43 -1.85 0.14 114.38 119.10 2qw4 h ARG 223 Ca 0.00 0.01 0.13 0.00 -0.81 0.00 0.00 59.98 59.30 2qw4 h ARG 223 Cb 0.43 0.02 -0.13 0.00 -0.42 0.00 0.00 29.97 29.87 2qw4 h ARG 223 CO 0.00 -0.05 -0.27 1.25 -1.51 0.00 0.00 179.97 179.39 2qw4 h LEU 224 N -0.08 -0.96 -1.80 3.80 5.85 -1.10 -1.16 115.31 119.86 2qw4 h LEU 224 Ca -0.01 0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.91 2qw4 h LEU 224 Cb 0.07 0.53 -0.00 0.00 0.37 0.00 0.00 40.66 41.63 2qw4 h LEU 224 CO 0.00 -0.28 -0.15 -0.07 -0.34 0.00 0.00 178.44 177.61 2qw4 h LEU 225 N -0.08 0.00 -1.91 2.25 3.38 0.39 -2.05 115.31 117.29 2qw4 h LEU 225 Ca 0.30 0.00 0.24 0.00 0.09 0.00 0.00 57.88 58.50 2qw4 h LEU 225 Cb 0.55 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 2qw4 h LEU 225 CO -0.73 0.15 0.67 1.23 0.09 0.00 0.00 178.44 179.85 2qw4 h GLY 226 N 0.62 0.00 0.08 0.83 0.00 0.60 -2.12 103.07 103.08 2qw4 h GLY 226 Ca -0.00 0.00 0.11 0.00 0.00 0.00 0.00 47.33 47.44 2qw4 h GLY 226 CO 0.02 0.00 -0.01 0.50 0.00 0.00 0.00 176.54 177.04 2qw4 h LYS 227 N 0.00 0.10 -0.98 4.80 1.79 -1.44 -3.33 116.57 117.50 2qw4 h LYS 227 Ca 0.39 -0.01 0.24 0.00 -2.18 0.00 0.00 60.65 59.09 2qw4 h LYS 227 Cb 1.73 -0.02 -0.08 0.00 -1.58 0.00 0.00 32.23 32.28 2qw4 h LYS 227 CO -0.00 0.07 0.65 -0.07 -1.08 0.00 0.00 179.45 179.01 2qw4 h LEU 228 N 0.10 0.38 0.12 2.94 3.38 -1.60 -0.01 115.31 120.63 2qw4 h LEU 228 Ca 0.27 0.06 -0.30 0.00 0.09 0.00 0.00 57.88 58.00 2qw4 h LEU 228 Cb 0.42 -0.01 0.03 0.00 0.09 0.00 0.00 40.66 41.19 2qw4 h LEU 228 CO -0.47 0.11 -1.25 -0.65 0.09 0.00 0.00 178.44 176.28 2qw4 h PRO 229 N 0.36 0.63 -0.91 1.13 0.11 -1.80 -3.20 132.00 128.32 2qw4 h PRO 229 Ca 0.53 -0.84 0.22 0.00 0.11 0.00 0.00 66.00 66.02 2qw4 h PRO 229 Cb 1.41 0.28 -0.12 0.00 0.11 0.00 0.00 31.00 32.68 2qw4 h PRO 229 CO -0.21 1.38 0.44 0.93 -0.21 0.00 0.00 178.00 180.33 2qw4 h GLU 230 N 0.28 0.44 0.00 1.05 5.08 -1.18 0.43 114.58 120.68 2qw4 h GLU 230 Ca -0.19 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.14 2qw4 h GLU 230 Cb 1.92 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 31.07 2qw4 h GLU 230 CO 0.24 0.29 -0.01 1.25 -1.00 0.00 0.00 179.01 179.78 2qw4 h LEU 231 N 0.46 0.00 0.08 1.33 5.85 -1.25 -2.75 115.31 119.03 2qw4 h LEU 231 Ca 0.57 0.00 -0.26 0.00 0.84 0.00 0.00 57.88 59.02 2qw4 h LEU 231 Cb 1.06 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.09 2qw4 h LEU 231 CO -0.50 0.01 -1.19 -0.09 -0.34 0.00 0.00 178.44 176.33 2qw4 h ARG 232 N 0.00 0.25 -0.84 1.25 9.65 -0.15 -3.00 114.38 121.55 2qw4 h ARG 232 Ca -0.00 -0.41 -0.02 0.00 -1.10 0.00 0.00 59.98 58.45 2qw4 h ARG 232 Cb 0.04 0.15 -0.04 0.00 -1.39 0.00 0.00 29.97 28.73 2qw4 h ARG 232 CO 0.00 1.19 0.46 1.15 2.80 0.00 0.00 179.97 185.57 2qw4 h THR 233 N 0.08 1.24 -0.44 0.20 2.02 -1.31 -2.87 112.91 111.84 2qw4 h THR 233 Ca -0.12 -0.60 -0.10 0.00 0.77 0.00 0.00 66.41 66.36 2qw4 h THR 233 Cb 1.91 0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 68.42 2qw4 h THR 233 CO 0.19 0.27 -0.13 -0.07 0.37 0.00 0.00 175.52 176.15 2qw4 h LEU 234 N 1.17 0.81 -0.76 2.58 3.38 -1.46 -2.60 115.31 118.43 2qw4 h LEU 234 Ca 0.30 -0.26 0.01 0.00 0.09 0.00 0.00 57.88 58.02 2qw4 h LEU 234 Cb 0.02 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 2qw4 h LEU 234 CO -0.05 0.95 0.50 0.00 0.09 0.00 0.00 178.44 179.93 2qw4 h THR 236 N 1.03 0.00 -0.30 0.00 2.02 -1.35 0.14 112.91 114.45 2qw4 h THR 236 Ca 0.28 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.51 2qw4 h THR 236 Cb -0.11 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 66.29 2qw4 h THR 236 CO -0.06 0.00 0.21 1.56 0.37 0.00 0.00 175.52 177.60 2qw4 h GLN 237 N -0.14 0.19 -0.36 6.66 4.20 -1.31 0.54 115.11 124.89 2qw4 h GLN 237 Ca 0.08 -0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.72 2qw4 h GLN 237 Cb 0.34 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 2qw4 h GLN 237 CO -0.50 0.12 0.01 0.78 -0.67 0.00 0.00 178.83 178.57 2qw4 h GLY 238 N 0.19 0.68 0.79 3.46 0.00 -0.89 0.13 103.07 107.44 2qw4 h GLY 238 Ca 0.13 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 46.96 2qw4 h GLY 238 CO -0.02 0.45 -0.26 1.41 0.00 0.00 0.00 176.54 178.12 2qw4 h LEU 239 N 0.45 -0.68 -0.78 3.11 3.38 0.43 0.21 115.31 121.42 2qw4 h LEU 239 Ca 0.10 0.05 0.13 0.00 0.09 0.00 0.00 57.88 58.26 2qw4 h LEU 239 Cb 0.44 0.22 -0.14 0.00 0.09 0.00 0.00 40.66 41.27 2qw4 h LEU 239 CO 0.02 -0.40 -0.35 1.56 0.09 0.00 0.00 178.44 179.36 2qw4 h GLN 240 N -0.61 -0.08 -0.76 1.13 4.20 -0.83 0.76 115.11 118.92 2qw4 h GLN 240 Ca -0.03 0.01 0.05 0.00 0.06 0.00 0.00 58.65 58.73 2qw4 h GLN 240 Cb 0.53 0.02 -0.05 0.00 0.30 0.00 0.00 27.48 28.27 2qw4 h GLN 240 CO -0.00 -0.05 0.47 -0.09 -0.67 0.00 0.00 178.83 178.48 2qw4 h ARG 241 N -0.08 0.86 -0.49 1.46 1.12 -0.36 0.29 114.38 117.18 2qw4 h ARG 241 Ca 0.29 -0.05 -0.10 0.00 -1.11 0.00 0.00 59.98 59.01 2qw4 h ARG 241 Cb 0.57 -0.19 -0.02 0.00 -0.01 0.00 0.00 29.97 30.32 2qw4 h ARG 241 CO -0.82 0.57 -0.10 0.82 -3.11 0.00 0.00 179.97 177.33 2qw4 h ILE 242 N 0.89 1.26 0.04 1.20 2.04 0.27 -1.69 117.51 121.52 2qw4 h ILE 242 Ca 0.32 -1.21 0.02 0.00 1.00 0.00 0.00 64.86 64.99 2qw4 h ILE 242 Cb 0.09 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 2qw4 h ILE 242 CO -0.14 0.42 -0.18 0.15 0.00 0.00 0.00 178.15 178.40 2qw4 h PHE 243 N 0.81 -0.47 -0.32 1.37 3.57 0.11 0.12 116.94 122.13 2qw4 h PHE 243 Ca 0.13 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.67 2qw4 h PHE 243 Cb 0.62 0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.55 2qw4 h PHE 243 CO 0.04 -0.26 0.22 -0.92 -2.23 0.00 0.00 178.31 175.15 2qw4 h TYR 244 N -0.31 0.33 0.00 0.41 3.20 -0.68 0.46 116.97 120.38 2qw4 h TYR 244 Ca 0.04 0.01 -0.13 0.00 3.14 0.00 0.00 58.73 61.79 2qw4 h TYR 244 Cb 0.36 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.50 2qw4 h TYR 244 CO -0.21 0.20 -0.61 -0.07 -1.64 0.00 0.00 178.16 175.83 2qw4 h LEU 245 N 0.35 0.00 0.00 2.82 3.38 -1.03 -1.50 115.31 119.32 2qw4 h LEU 245 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2qw4 h LEU 245 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2qw4 h LEU 245 CO -0.03 0.61 0.00 1.17 0.09 0.00 0.00 178.44 180.28 2qw4 n LYS 246 N -3.31 0.23 -0.11 1.13 4.81 0.39 -2.47 118.16 118.83 2qw4 n LYS 246 Ca 0.01 0.03 -0.16 0.00 -0.87 0.00 0.00 58.31 57.32 2qw4 n LYS 246 Cb 0.75 -1.50 -0.05 0.00 0.02 0.00 0.00 35.03 34.25 2qw4 n LYS 246 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2qw4 n LEU 247 N -1.38 1.94 -0.08 3.14 4.77 -0.68 -4.31 117.00 120.41 2qw4 n LEU 247 Ca 0.10 0.35 0.25 0.00 -0.03 0.00 0.00 56.01 56.68 2qw4 n LEU 247 Cb 0.26 -0.78 0.59 0.00 -2.33 0.00 0.00 43.42 41.16 2qw4 n LEU 247 CO 0.23 0.02 1.23 1.05 -1.33 0.00 0.00 177.39 178.59 2qw4 h GLU 248 N -1.00 0.00 -6.97 3.23 -0.00 -1.39 -3.44 114.58 105.00 2qw4 h GLU 248 Ca -0.25 0.00 -0.23 0.00 -0.00 0.00 0.00 59.36 58.88 2qw4 h GLU 248 Cb 1.20 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 29.93 2qw4 h GLU 248 CO -0.15 0.00 -0.38 -3.47 -0.00 0.00 0.00 179.01 175.01 2qw4 n ASP 249 N -3.45 -1.15 0.00 3.06 2.03 -1.03 -4.99 116.55 111.01 2qw4 n ASP 249 Ca 0.16 -0.49 0.00 0.00 0.52 0.00 0.00 54.79 54.98 2qw4 n ASP 249 Cb 1.11 -0.59 0.00 0.00 -0.72 0.00 0.00 41.12 40.92 2qw4 n ASP 249 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2qw4 n LEU 250 N -2.47 0.00 -4.52 -2.67 4.77 -1.26 -4.96 117.00 105.89 2qw4 n LEU 250 Ca -0.06 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.52 2qw4 n LEU 250 Cb 0.22 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.33 2qw4 n LEU 250 CO 0.29 0.00 0.28 1.33 -1.33 0.00 0.00 177.39 177.96 2qw4 n VAL 251 N 0.00 2.23 -2.40 4.08 0.24 -1.26 -4.95 118.33 116.27 2qw4 n VAL 251 Ca 0.00 -0.50 -0.36 0.00 -2.04 0.00 0.00 64.34 61.44 2qw4 n VAL 251 Cb 0.00 -0.81 -0.02 0.00 -1.47 0.00 0.00 33.84 31.54 2qw4 n VAL 251 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2qw4 s PRO 252 N -1.90 3.92 0.57 7.34 0.04 -1.26 -5.02 135.00 138.69 2qw4 s PRO 252 Ca 0.65 1.63 -0.19 0.00 0.04 0.00 0.00 61.00 63.13 2qw4 s PRO 252 Cb -0.55 -2.42 -0.04 0.00 0.04 0.00 0.00 34.50 31.52 2qw4 s PRO 252 CO 0.56 -0.38 1.17 -2.14 0.04 0.00 0.00 177.00 176.25 2qw4 s PRO 253 N -2.68 3.14 0.27 0.56 0.02 -1.26 -5.00 135.00 130.05 2qw4 s PRO 253 Ca 0.62 1.71 -0.31 0.00 0.02 0.00 0.00 61.00 63.05 2qw4 s PRO 253 Cb -0.25 -1.96 -0.13 0.00 0.02 0.00 0.00 34.50 32.18 2qw4 s PRO 253 CO 0.30 -1.05 1.48 -2.30 -0.33 0.00 0.00 177.00 175.11 2qw4 n PRO 254 N -1.49 2.32 -0.28 5.54 -0.02 -1.26 -4.79 135.00 135.02 2qw4 n PRO 254 Ca 0.13 0.82 0.04 0.00 -2.02 0.00 0.00 63.50 62.47 2qw4 n PRO 254 Cb 0.50 -2.53 0.18 0.00 -0.02 0.00 0.00 33.50 31.63 2qw4 n PRO 254 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2qw4 h PRO 255 N 4.37 0.64 -0.97 0.52 0.11 -1.99 0.18 132.00 134.86 2qw4 h PRO 255 Ca -0.46 -0.04 0.20 0.00 0.11 0.00 0.00 66.00 65.81 2qw4 h PRO 255 Cb 1.25 -0.15 -0.11 0.00 0.11 0.00 0.00 31.00 32.11 2qw4 h PRO 255 CO 0.76 0.43 0.56 -0.84 -0.21 0.00 0.00 178.00 178.70 2qw4 h ILE 256 N 0.66 0.65 0.04 4.15 3.07 -2.00 -0.17 117.51 123.91 2qw4 h ILE 256 Ca 0.41 -0.23 -0.31 0.00 1.55 0.00 0.00 64.86 66.28 2qw4 h ILE 256 Cb 0.47 -0.07 -0.04 0.00 -0.27 0.00 0.00 36.82 36.91 2qw4 h ILE 256 CO -0.30 0.12 -1.72 0.40 -1.05 0.00 0.00 178.15 175.61 2qw4 h ILE 257 N 0.67 0.88 -0.54 0.16 1.08 -1.08 -2.95 117.51 115.73 2qw4 h ILE 257 Ca 0.57 -2.67 -0.01 0.00 -0.39 0.00 0.00 64.86 62.36 2qw4 h ILE 257 Cb 0.94 2.50 -0.03 0.00 -3.07 0.00 0.00 36.82 37.17 2qw4 h ILE 257 CO -0.41 0.65 0.30 -0.78 -0.69 0.00 0.00 178.15 177.21 2qw4 h ASP 258 N 0.02 0.68 0.20 1.72 3.58 -0.89 -0.11 116.42 121.62 2qw4 h ASP 258 Ca -0.30 -0.09 0.01 0.00 0.42 0.00 0.00 57.03 57.07 2qw4 h ASP 258 Cb 2.01 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 42.86 2qw4 h ASP 258 CO 0.09 0.57 -0.23 0.50 -2.88 0.00 0.00 179.24 177.30 2qw4 h LYS 259 N 0.73 -0.46 -0.65 0.28 3.64 -1.08 0.16 116.57 119.19 2qw4 h LYS 259 Ca 0.19 0.03 0.11 0.00 -1.27 0.00 0.00 60.65 59.71 2qw4 h LYS 259 Cb 0.05 0.10 -0.08 0.00 -0.41 0.00 0.00 32.23 31.89 2qw4 h LYS 259 CO -0.03 -0.30 0.23 0.82 -2.27 0.00 0.00 179.45 177.90 2qw4 h ILE 260 N -0.47 0.72 -0.64 2.00 2.04 -1.49 -0.33 117.51 119.34 2qw4 h ILE 260 Ca 0.01 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 65.75 2qw4 h ILE 260 Cb 0.46 0.29 -0.03 0.00 -0.74 0.00 0.00 36.82 36.79 2qw4 h ILE 260 CO -0.08 0.07 0.42 0.15 0.00 0.00 0.00 178.15 178.72 2qw4 h PHE 261 N 0.40 0.78 0.00 1.37 3.57 -0.24 -2.54 116.94 120.27 2qw4 h PHE 261 Ca 0.34 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.79 2qw4 h PHE 261 Cb 0.46 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 2qw4 h PHE 261 CO -0.18 0.48 -0.33 0.52 -2.23 0.00 0.00 178.31 176.56 2qw4 h MET 262 N 0.83 0.00 -5.56 1.11 2.86 0.10 -3.33 114.93 110.94 2qw4 h MET 262 Ca 0.24 0.00 -0.27 0.00 -2.06 0.00 0.00 59.70 57.61 2qw4 h MET 262 Cb -0.03 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.59 2qw4 h MET 262 CO -0.06 0.33 0.77 -0.51 1.06 0.00 0.00 176.91 178.50 2qw4 s ASP 263 N -6.47 4.90 0.00 1.22 1.11 -0.86 -5.09 116.67 111.49 2qw4 s ASP 263 Ca -0.01 -1.01 0.00 0.00 0.18 0.00 0.00 52.55 51.71 2qw4 s ASP 263 Cb 0.12 -2.57 0.00 0.00 1.07 0.00 0.00 42.92 41.54 2qw4 s ASP 263 CO 0.68 -3.08 0.44 1.07 1.18 0.00 0.00 175.17 175.45