#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 0.18 0.00 3.41 4.07 -1.98 -3.28 115.31 117.71 2qw4 h LEU 33 Ca 0.00 -0.14 0.00 0.00 0.08 0.00 0.00 57.88 57.82 2qw4 h LEU 33 Cb 0.00 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 41.68 2qw4 h LEU 33 CO 0.00 0.90 0.00 -0.11 -1.08 0.00 0.00 178.44 178.15 2qw4 n LEU 34 N -3.69 0.00 -0.17 1.67 0.00 -1.26 0.31 117.00 113.86 2qw4 n LEU 34 Ca -0.03 0.94 0.16 0.00 0.00 0.00 0.00 56.01 57.08 2qw4 n LEU 34 Cb 0.75 -0.44 0.51 0.00 0.00 0.00 0.00 43.42 44.24 2qw4 n LEU 34 CO 0.46 -0.44 1.21 0.71 0.00 0.00 0.00 177.39 179.33 2qw4 h THR 35 N 0.00 0.78 -0.40 1.96 1.35 -1.97 0.76 112.91 115.40 2qw4 h THR 35 Ca 0.00 -0.14 -0.01 0.00 -0.55 0.00 0.00 66.41 65.71 2qw4 h THR 35 Cb 0.00 0.33 -0.02 0.00 -1.73 0.00 0.00 68.15 66.74 2qw4 h THR 35 CO 0.00 0.08 0.23 -1.28 -0.25 0.00 0.00 175.52 174.30 2qw4 h SER 36 N 0.41 0.49 0.12 5.36 0.87 -1.29 0.18 113.55 119.70 2qw4 h SER 36 Ca 0.38 -0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.86 2qw4 h SER 36 Cb 0.88 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.71 2qw4 h SER 36 CO -0.12 0.42 -0.06 -0.07 -0.53 0.00 0.00 176.83 176.47 2qw4 h LEU 37 N 0.53 -0.14 -1.05 2.23 3.38 0.81 -2.07 115.31 118.99 2qw4 h LEU 37 Ca 0.14 -0.31 0.21 0.00 0.09 0.00 0.00 57.88 58.01 2qw4 h LEU 37 Cb 0.03 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2qw4 h LEU 37 CO -0.02 0.25 1.03 0.58 0.09 0.00 0.00 178.44 180.37 2qw4 h VAL 38 N -0.56 0.05 0.10 1.22 2.07 0.41 0.11 116.25 119.65 2qw4 h VAL 38 Ca -0.02 0.00 -0.33 0.00 0.82 0.00 0.00 66.70 67.17 2qw4 h VAL 38 Cb 0.44 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 2qw4 h VAL 38 CO 0.03 0.00 -1.78 -0.09 0.02 0.00 0.00 177.57 175.75 2qw4 h ARG 39 N 0.00 0.22 -0.25 1.57 2.43 -0.26 -3.21 114.38 114.87 2qw4 h ARG 39 Ca 0.34 -0.37 -0.12 0.00 -0.81 0.00 0.00 59.98 59.02 2qw4 h ARG 39 Cb 2.41 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 32.08 2qw4 h ARG 39 CO -0.00 1.04 -0.35 0.00 -1.51 0.00 0.00 179.97 179.15 2qw4 h ALA 40 N 0.40 0.93 0.04 2.80 0.00 -0.45 -0.75 119.26 122.23 2qw4 h ALA 40 Ca -0.34 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.16 2qw4 h ALA 40 Cb 2.03 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.71 2qw4 h ALA 40 CO 0.12 0.62 -0.02 1.25 0.00 0.00 0.00 179.25 181.22 2qw4 h HIS 41 N 0.46 -0.05 -0.08 0.00 -0.00 -1.60 -3.29 115.15 110.59 2qw4 h HIS 41 Ca 0.05 -0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.42 2qw4 h HIS 41 Cb 0.82 0.02 -0.00 0.00 -0.00 0.00 0.00 27.41 28.25 2qw4 h HIS 41 CO 0.03 0.29 0.04 -0.07 -0.00 0.00 0.00 177.93 178.23 2qw4 h LEU 42 N -0.41 0.09 -1.84 0.26 3.38 -1.54 -2.86 115.31 112.39 2qw4 h LEU 42 Ca -0.01 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2qw4 h LEU 42 Cb 0.37 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2qw4 h LEU 42 CO 0.01 0.15 0.00 0.47 0.09 0.00 0.00 178.44 179.16 2qw4 n ASP 43 N -4.99 1.78 0.13 -0.43 9.92 -0.29 -3.91 116.55 118.75 2qw4 n ASP 43 Ca -0.06 -1.33 0.00 0.00 -0.53 0.00 0.00 54.79 52.88 2qw4 n ASP 43 Cb 0.07 -0.33 0.00 0.00 -0.64 0.00 0.00 41.12 40.22 2qw4 n ASP 43 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 2qw4 n SER 44 N 0.59 -0.14 -4.45 -2.24 3.41 -1.09 -4.96 113.62 104.74 2qw4 n SER 44 Ca 0.00 0.44 -0.37 0.00 -0.26 0.00 0.00 58.87 58.68 2qw4 n SER 44 Cb 0.30 0.36 0.05 0.00 -0.26 0.00 0.00 64.21 64.66 2qw4 n SER 44 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qw4 n GLY 45 N 1.56 -1.65 3.78 5.00 0.00 -1.14 -4.91 105.19 107.83 2qw4 n GLY 45 Ca 0.00 -0.25 -0.37 0.00 0.00 0.00 0.00 46.02 45.40 2qw4 n GLY 45 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qw4 s PRO 46 N -2.25 4.31 0.01 1.61 0.04 -1.26 -4.95 135.00 132.52 2qw4 s PRO 46 Ca 0.67 1.49 -0.25 0.00 0.04 0.00 0.00 61.00 62.95 2qw4 s PRO 46 Cb -0.41 -2.66 -0.05 0.00 0.04 0.00 0.00 34.50 31.42 2qw4 s PRO 46 CO 0.57 -0.00 0.75 -1.12 0.04 0.00 0.00 177.00 177.23 2qw4 s SER 47 N -1.53 7.15 -0.14 6.66 0.01 -1.26 -4.90 113.70 119.71 2qw4 s SER 47 Ca 0.55 1.38 -0.30 0.00 1.31 0.00 0.00 55.95 58.89 2qw4 s SER 47 Cb -0.22 -2.45 -0.07 0.00 0.21 0.00 0.00 66.02 63.48 2qw4 s SER 47 CO 0.28 -0.02 2.12 0.35 0.41 0.00 0.00 173.24 176.37 2qw4 n THR 48 N 3.07 0.49 0.00 1.44 -2.24 -1.26 0.22 114.28 116.00 2qw4 n THR 48 Ca -0.02 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 2qw4 n THR 48 Cb 0.51 -2.37 0.00 0.00 -2.10 0.00 0.00 70.33 66.37 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 9.83 0.00 0.08 6.98 0.00 -1.26 -4.86 120.51 131.27 2qw4 n ALA 49 Ca 0.27 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.61 2qw4 n ALA 49 Cb 0.41 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.74 2qw4 n ALA 49 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2qw4 h LYS 50 N 0.00 0.10 -6.09 0.00 6.56 0.22 -3.48 116.57 113.88 2qw4 h LYS 50 Ca 0.00 -0.17 -0.69 0.00 -1.06 0.00 0.00 60.65 58.74 2qw4 h LYS 50 Cb 0.00 0.06 0.09 0.00 -0.57 0.00 0.00 32.23 31.81 2qw4 h LYS 50 CO 0.00 1.07 -0.23 1.28 -2.06 0.00 0.00 179.45 179.51 2qw4 n LEU 51 N -3.43 -0.31 -4.38 2.94 4.77 -1.23 -4.94 117.00 110.42 2qw4 n LEU 51 Ca -0.03 1.14 -0.36 0.00 -0.03 0.00 0.00 56.01 56.74 2qw4 n LEU 51 Cb 0.96 -1.01 -0.13 0.00 -2.33 0.00 0.00 43.42 40.90 2qw4 n LEU 51 CO 0.49 -2.37 -0.34 -0.62 -1.33 0.00 0.00 177.39 173.22 2qw4 s ASP 52 N -0.60 4.68 -0.09 -1.43 3.68 0.80 -4.96 116.67 118.75 2qw4 s ASP 52 Ca 0.71 -0.30 0.12 0.00 2.13 0.00 0.00 52.55 55.21 2qw4 s ASP 52 Cb -0.97 -1.82 0.27 0.00 -1.45 0.00 0.00 42.92 38.95 2qw4 s ASP 52 CO 0.56 -0.02 1.19 -1.22 0.13 0.00 0.00 175.17 175.81 2qw4 n TYR 53 N 4.79 0.28 0.81 -5.34 4.02 -1.26 -0.68 117.16 119.78 2qw4 n TYR 53 Ca -0.17 -0.77 0.11 0.00 -0.01 0.00 0.00 57.90 57.06 2qw4 n TYR 53 Cb 0.51 -0.14 0.49 0.00 -0.02 0.00 0.00 39.34 40.18 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 -0.69 0.00 0.00 7.72 3.41 -1.26 -2.58 113.62 120.22 2qw4 n SER 54 Ca 0.12 0.44 0.00 0.00 -0.26 0.00 0.00 58.87 59.17 2qw4 n SER 54 Cb 0.56 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 64.04 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 -1.48 -0.31 -1.66 4.33 5.02 -1.26 -5.05 118.16 117.75 2qw4 n LYS 55 Ca 0.06 -0.39 -0.31 0.00 -2.02 0.00 0.00 58.31 55.64 2qw4 n LYS 55 Cb 0.26 -0.80 0.04 0.00 -0.02 0.00 0.00 35.03 34.51 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 -0.07 3.19 0.00 2.13 5.36 -1.07 -4.91 117.98 122.61 2qw4 s PHE 56 Ca 0.00 1.41 0.00 0.00 -0.96 0.00 0.00 56.93 57.38 2qw4 s PHE 56 Cb 0.00 -2.86 0.00 0.00 -0.34 0.00 0.00 43.02 39.82 2qw4 s PHE 56 CO 0.00 -1.13 0.00 0.94 -1.46 0.00 0.00 175.22 173.57 2qw4 n GLN 57 N -2.98 0.00 -3.35 10.12 -0.06 -1.26 -5.05 117.38 114.80 2qw4 n GLN 57 Ca 0.07 0.00 -0.44 0.00 -2.00 0.00 0.00 57.00 54.63 2qw4 n GLN 57 Cb 0.54 0.00 -0.08 0.00 -4.06 0.00 0.00 30.24 26.64 2qw4 n GLN 57 CO 0.00 0.00 0.00 -2.00 -0.20 0.00 0.00 177.06 174.86 2qw4 s GLU 58 N 0.00 3.01 0.20 3.69 2.12 -1.26 -4.44 118.70 122.02 2qw4 s GLU 58 Ca 0.00 -1.23 0.01 0.00 0.36 0.00 0.00 54.97 54.11 2qw4 s GLU 58 Cb 0.00 -4.11 -0.04 0.00 0.26 0.00 0.00 34.13 30.24 2qw4 s GLU 58 CO 0.00 -1.04 0.37 -0.51 -0.54 0.00 0.00 175.26 173.54 2qw4 s LEU 59 N 1.84 4.25 -0.17 2.70 1.43 -1.26 -5.03 118.68 122.43 2qw4 s LEU 59 Ca 0.06 0.30 0.01 0.00 -1.03 0.00 0.00 54.13 53.47 2qw4 s LEU 59 Cb -0.23 -3.07 -0.22 0.00 0.03 0.00 0.00 46.19 42.70 2qw4 s LEU 59 CO 0.08 -0.04 0.14 0.52 0.23 0.00 0.00 176.35 177.28 2qw4 n VAL 60 N -0.82 1.62 -4.36 -1.59 0.31 -1.26 -4.91 118.33 107.32 2qw4 n VAL 60 Ca -0.06 -0.66 -0.30 0.00 -0.01 0.00 0.00 64.34 63.31 2qw4 n VAL 60 Cb 0.54 -1.41 -0.11 0.00 -0.91 0.00 0.00 33.84 31.95 2qw4 n VAL 60 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2qw4 s LEU 61 N -6.59 2.74 0.99 7.52 1.43 -1.26 -5.12 118.68 118.40 2qw4 s LEU 61 Ca -0.24 -0.50 -0.12 0.00 -1.03 0.00 0.00 54.13 52.24 2qw4 s LEU 61 Cb 0.08 -1.59 0.19 0.00 0.03 0.00 0.00 46.19 44.89 2qw4 s LEU 61 CO 0.72 0.19 1.08 -2.84 0.23 0.00 0.00 176.35 175.73 2qw4 s PRO 62 N -2.02 0.46 0.62 1.29 0.02 -1.26 -5.03 135.00 129.08 2qw4 s PRO 62 Ca 0.18 0.78 -0.11 0.00 0.02 0.00 0.00 61.00 61.88 2qw4 s PRO 62 Cb -0.11 -1.72 -0.03 0.00 0.02 0.00 0.00 34.50 32.66 2qw4 s PRO 62 CO 0.10 -2.78 1.02 -1.01 -0.33 0.00 0.00 177.00 174.00 2qw4 s HIS 63 N -2.81 3.57 -0.12 6.54 3.76 -1.26 -5.08 115.29 119.88 2qw4 s HIS 63 Ca 0.65 1.21 -0.04 0.00 -0.15 0.00 0.00 55.06 56.73 2qw4 s HIS 63 Cb -0.20 -2.75 -0.04 0.00 1.11 0.00 0.00 32.58 30.71 2qw4 s HIS 63 CO 0.59 -0.74 0.04 -0.59 -0.85 0.00 0.00 174.74 173.19 2qw4 s PHE 64 N -3.17 3.25 0.00 1.40 -0.12 -1.26 -5.03 117.98 113.04 2qw4 s PHE 64 Ca 0.55 0.19 0.00 0.00 -0.05 0.00 0.00 56.93 57.61 2qw4 s PHE 64 Cb -0.11 -1.90 0.00 0.00 -0.63 0.00 0.00 43.02 40.38 2qw4 s PHE 64 CO 0.53 0.40 0.00 0.41 -0.05 0.00 0.00 175.22 176.51 2qw4 n GLY 65 N 2.57 -0.67 3.84 1.99 0.00 -1.26 -5.02 105.19 106.65 2qw4 n GLY 65 Ca -0.18 -2.16 -0.31 0.00 0.00 0.00 0.00 46.02 43.37 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 0.00 3.11 -0.28 1.61 2.47 -1.26 -5.03 119.74 120.36 2qw4 s LYS 66 Ca 0.00 0.80 -0.23 0.00 -1.56 0.00 0.00 55.97 54.98 2qw4 s LYS 66 Cb 0.00 -2.02 -0.00 0.00 -1.46 0.00 0.00 37.83 34.35 2qw4 s LYS 66 CO 0.00 -0.94 0.78 -1.21 0.16 0.00 0.00 175.35 174.14 2qw4 s GLU 67 N -5.13 4.04 0.68 4.03 8.01 -1.26 -5.06 118.70 124.01 2qw4 s GLU 67 Ca 0.57 0.67 -0.13 0.00 0.01 0.00 0.00 54.97 56.09 2qw4 s GLU 67 Cb -0.13 -3.70 0.01 0.00 -4.31 0.00 0.00 34.13 26.01 2qw4 s GLU 67 CO 0.54 -0.60 1.08 0.16 0.01 0.00 0.00 175.26 176.45 2qw4 s ASP 68 N 1.53 5.17 0.58 -0.19 3.84 -1.26 -4.81 116.67 121.52 2qw4 s ASP 68 Ca 0.32 1.83 0.33 0.00 -0.00 0.00 0.00 52.55 55.04 2qw4 s ASP 68 Cb -0.15 -2.53 1.31 0.00 -1.38 0.00 0.00 42.92 40.17 2qw4 s ASP 68 CO 0.11 -1.59 1.57 0.00 -0.00 0.00 0.00 175.17 175.26 2qw4 h ALA 69 N -0.33 2.98 0.27 2.11 0.00 -1.97 0.26 119.26 122.58 2qw4 h ALA 69 Ca -0.45 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.42 2qw4 h ALA 69 Cb 1.23 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 19.06 2qw4 h ALA 69 CO 0.55 -1.59 -0.46 0.78 0.00 0.00 0.00 179.25 178.53 2qw4 h GLY 70 N 0.00 -1.03 0.65 0.00 0.00 -1.99 0.10 103.07 100.80 2qw4 h GLY 70 Ca 0.52 0.55 0.06 0.00 0.00 0.00 0.00 47.33 48.45 2qw4 h GLY 70 CO -0.01 -0.31 0.26 -0.55 0.00 0.00 0.00 176.54 175.94 2qw4 h ASP 71 N -0.80 0.36 -0.61 0.19 3.32 -1.29 0.90 116.42 118.50 2qw4 h ASP 71 Ca -0.01 0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.08 2qw4 h ASP 71 Cb 0.76 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.25 2qw4 h ASP 71 CO -0.18 0.24 0.40 0.58 -1.72 0.00 0.00 179.24 178.57 2qw4 h VAL 72 N 0.50 1.15 -0.02 -1.35 2.07 -1.34 -1.57 116.25 115.68 2qw4 h VAL 72 Ca 0.25 -0.28 -0.23 0.00 0.82 0.00 0.00 66.70 67.26 2qw4 h VAL 72 Cb 0.19 0.26 0.02 0.00 -1.52 0.00 0.00 31.29 30.24 2qw4 h VAL 72 CO -0.19 0.15 -0.88 -0.61 0.02 0.00 0.00 177.57 176.06 2qw4 h GLN 73 N 0.81 0.63 -0.54 1.57 5.75 0.56 -2.26 115.11 121.64 2qw4 h GLN 73 Ca 0.22 -0.65 0.09 0.00 -0.15 0.00 0.00 58.65 58.16 2qw4 h GLN 73 Cb -0.08 0.18 -0.03 0.00 1.07 0.00 0.00 27.48 28.61 2qw4 h GLN 73 CO -0.05 1.25 0.36 0.37 -2.65 0.00 0.00 178.83 178.11 2qw4 h GLN 74 N 0.27 0.36 0.63 1.69 4.15 -0.59 0.30 115.11 121.92 2qw4 h GLN 74 Ca -0.10 -0.02 -0.03 0.00 0.77 0.00 0.00 58.65 59.26 2qw4 h GLN 74 Cb 1.54 -0.08 0.01 0.00 0.21 0.00 0.00 27.48 29.16 2qw4 h GLN 74 CO 0.17 0.24 -0.30 0.35 -1.93 0.00 0.00 178.83 177.36 2qw4 h PHE 75 N 0.37 -0.78 -0.79 3.99 3.57 -1.15 -2.81 116.94 119.34 2qw4 h PHE 75 Ca 0.25 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.77 2qw4 h PHE 75 Cb 0.48 0.26 -0.05 0.00 2.79 0.00 0.00 35.95 39.43 2qw4 h PHE 75 CO -0.00 -0.45 0.52 1.88 -2.23 0.00 0.00 178.31 178.03 2qw4 h TYR 76 N -1.13 0.93 -0.43 0.41 0.05 -0.86 -0.10 116.97 115.83 2qw4 h TYR 76 Ca -0.09 0.02 -0.06 0.00 0.05 0.00 0.00 58.73 58.66 2qw4 h TYR 76 Cb 0.68 -0.31 -0.02 0.00 1.01 0.00 0.00 36.73 38.09 2qw4 h TYR 76 CO 0.00 0.53 0.04 -0.44 -1.05 0.00 0.00 178.16 177.24 2qw4 h ASP 77 N 0.95 0.63 0.16 3.88 3.32 -1.04 -2.16 116.42 122.17 2qw4 h ASP 77 Ca 0.32 -0.13 -0.18 0.00 0.02 0.00 0.00 57.03 57.06 2qw4 h ASP 77 Cb 0.09 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.47 2qw4 h ASP 77 CO -0.10 0.68 -0.69 0.25 -1.72 0.00 0.00 179.24 177.66 2qw4 h LEU 78 N 0.64 0.56 0.39 1.55 5.85 -0.81 0.59 115.31 124.09 2qw4 h LEU 78 Ca 0.14 -0.35 -0.02 0.00 0.84 0.00 0.00 57.88 58.49 2qw4 h LEU 78 Cb 0.35 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.21 2qw4 h LEU 78 CO 0.01 1.09 -0.24 -0.07 -0.34 0.00 0.00 178.44 178.89 2qw4 h LEU 79 N 0.34 -0.61 -0.60 2.25 -0.00 -0.96 -2.57 115.31 113.16 2qw4 h LEU 79 Ca -0.02 0.03 0.12 0.00 -0.00 0.00 0.00 57.88 58.01 2qw4 h LEU 79 Cb 1.26 0.18 -0.10 0.00 -0.00 0.00 0.00 40.66 42.00 2qw4 h LEU 79 CO 0.12 -0.37 0.05 0.28 -0.00 0.00 0.00 178.44 178.52 2qw4 h SER 80 N -0.59 -0.18 -0.26 -0.43 0.02 -1.21 0.17 113.55 111.07 2qw4 h SER 80 Ca -0.05 0.14 0.03 0.00 -0.84 0.00 0.00 61.79 61.07 2qw4 h SER 80 Cb 0.47 0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.23 2qw4 h SER 80 CO 0.05 -0.07 0.18 1.23 -1.14 0.00 0.00 176.83 177.08 2qw4 h GLY 81 N 0.16 0.25 1.55 -3.77 0.00 0.12 0.88 103.07 102.26 2qw4 h GLY 81 Ca 0.32 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.56 2qw4 h GLY 81 CO -0.48 0.07 -0.36 1.76 0.00 0.00 0.00 176.54 177.54 2qw4 h SER 82 N 0.22 0.00 0.00 0.19 0.02 -0.27 -3.15 113.55 110.55 2qw4 h SER 82 Ca 0.11 -0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 60.96 2qw4 h SER 82 Cb 0.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.71 2qw4 h SER 82 CO -0.02 0.05 -0.02 0.25 -1.14 0.00 0.00 176.83 175.95 2qw4 h LEU 83 N 0.00 0.01 -0.17 5.07 5.85 0.10 -2.44 115.31 123.73 2qw4 h LEU 83 Ca 0.00 -0.93 0.05 0.00 0.84 0.00 0.00 57.88 57.84 2qw4 h LEU 83 Cb 0.79 -0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.75 2qw4 h LEU 83 CO 0.00 0.95 -0.28 -0.33 -0.34 0.00 0.00 178.44 178.44 2qw4 h GLU 84 N -0.92 -0.31 -0.26 1.25 5.08 -1.46 0.24 114.58 118.21 2qw4 h GLU 84 Ca -0.00 0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.43 2qw4 h GLU 84 Cb 0.95 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 30.22 2qw4 h GLU 84 CO 0.00 -0.21 -0.08 0.28 -1.00 0.00 0.00 179.01 178.00 2qw4 h VAL 85 N -0.33 0.71 -0.19 3.13 2.07 -1.66 -1.77 116.25 118.22 2qw4 h VAL 85 Ca 0.11 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.69 2qw4 h VAL 85 Cb 0.50 0.71 -0.07 0.00 -1.52 0.00 0.00 31.29 30.91 2qw4 h VAL 85 CO -0.36 0.00 -0.31 0.40 0.02 0.00 0.00 177.57 177.32 2qw4 h ILE 86 N -0.02 0.29 -0.61 4.57 5.03 -0.90 -0.47 117.51 125.38 2qw4 h ILE 86 Ca 0.13 0.00 0.10 0.00 -0.12 0.00 0.00 64.86 64.96 2qw4 h ILE 86 Cb 0.22 0.29 -0.07 0.00 -3.03 0.00 0.00 36.82 34.22 2qw4 h ILE 86 CO -0.28 0.00 0.23 -0.09 -0.68 0.00 0.00 178.15 177.33 2qw4 h ARG 87 N -0.36 0.39 0.00 2.37 2.43 0.03 0.27 114.38 119.51 2qw4 h ARG 87 Ca 0.11 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.21 2qw4 h ARG 87 Cb 0.54 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 2qw4 h ARG 87 CO -0.39 0.26 -0.24 0.87 -1.51 0.00 0.00 179.97 178.96 2qw4 h LYS 88 N 0.40 0.00 -0.36 0.20 1.57 -1.06 -1.87 116.57 115.46 2qw4 h LYS 88 Ca 0.31 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.95 2qw4 h LYS 88 Cb 0.39 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 2qw4 h LYS 88 CO -0.31 0.24 -0.33 2.35 -0.57 0.00 0.00 179.45 180.82 2qw4 h TRP 89 N 0.00 1.02 -0.71 -1.35 7.01 0.77 -3.22 115.95 119.47 2qw4 h TRP 89 Ca -0.00 -0.30 -0.03 0.00 2.11 0.00 0.00 58.89 60.67 2qw4 h TRP 89 Cb 0.53 -0.22 -0.03 0.00 -2.10 0.00 0.00 29.16 27.34 2qw4 h TRP 89 CO 0.00 1.10 0.34 0.00 -2.79 0.00 0.00 178.44 177.09 2qw4 h ALA 90 N 0.75 1.26 -0.31 2.65 0.00 0.14 -3.02 119.26 120.73 2qw4 h ALA 90 Ca 0.06 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.84 2qw4 h ALA 90 Cb 0.92 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2qw4 h ALA 90 CO 0.08 0.57 0.17 0.93 0.00 0.00 0.00 179.25 181.01 2qw4 h GLU 91 N 1.01 0.34 0.00 0.00 4.39 -1.42 -2.75 114.58 116.15 2qw4 h GLU 91 Ca 0.25 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.93 2qw4 h GLU 91 Cb 0.11 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 2qw4 h GLU 91 CO -0.03 0.23 0.00 1.63 -1.16 0.00 0.00 179.01 179.67 2qw4 n LYS 92 N -4.93 0.04 -2.89 2.33 5.02 -1.14 -4.55 118.16 112.03 2qw4 n LYS 92 Ca -0.01 0.53 -0.42 0.00 -2.02 0.00 0.00 58.31 56.40 2qw4 n LYS 92 Cb 0.06 -1.62 -0.04 0.00 -0.02 0.00 0.00 35.03 33.41 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 -3.15 4.86 0.20 -0.18 1.01 -1.04 -4.77 121.20 118.14 2qw4 s ILE 93 Ca -0.00 1.59 -0.31 0.00 0.00 0.00 0.00 60.65 61.92 2qw4 s ILE 93 Cb 0.02 -4.12 -0.10 0.00 0.01 0.00 0.00 42.46 38.27 2qw4 s ILE 93 CO 0.06 -0.03 1.51 -2.16 0.00 0.00 0.00 174.94 174.32 2qw4 s PRO 94 N 2.55 4.24 0.00 2.79 0.04 -1.26 -2.00 135.00 141.36 2qw4 s PRO 94 Ca 0.36 2.33 0.00 0.00 0.04 0.00 0.00 61.00 63.73 2qw4 s PRO 94 Cb -0.16 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.25 2qw4 s PRO 94 CO 0.09 -0.52 0.00 0.41 0.04 0.00 0.00 177.00 177.02 2qw4 n GLY 95 N 3.01 2.99 0.07 0.56 0.00 -1.26 -4.92 105.19 105.64 2qw4 n GLY 95 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.04 -0.78 1.61 3.57 -1.70 -2.80 116.94 116.80 2qw4 h PHE 96 Ca 0.00 -0.00 0.20 0.00 3.53 0.00 0.00 57.97 61.70 2qw4 h PHE 96 Cb 0.00 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 38.71 2qw4 h PHE 96 CO 0.00 0.62 0.54 0.00 -2.23 0.00 0.00 178.31 177.24 2qw4 h ALA 97 N 0.13 2.45 -0.44 2.41 0.00 -1.81 -2.65 119.26 119.36 2qw4 h ALA 97 Ca -0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 2qw4 h ALA 97 Cb 0.68 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 2qw4 h ALA 97 CO 0.01 -0.68 0.11 0.93 0.00 0.00 0.00 179.25 179.62 2qw4 h GLU 98 N 0.19 0.70 -7.09 0.00 3.07 -1.86 -3.42 114.58 106.17 2qw4 h GLU 98 Ca 0.38 -0.17 -0.55 0.00 -0.50 0.00 0.00 59.36 58.53 2qw4 h GLU 98 Cb 1.23 -0.09 0.14 0.00 -0.84 0.00 0.00 28.75 29.18 2qw4 h GLU 98 CO -0.07 0.71 0.52 -0.51 -1.40 0.00 0.00 179.01 178.25 2qw4 s LEU 99 N -9.62 3.65 0.53 1.33 1.02 -1.00 -4.95 118.68 109.64 2qw4 s LEU 99 Ca -0.13 2.58 -0.21 0.00 0.02 0.00 0.00 54.13 56.39 2qw4 s LEU 99 Cb 0.11 -4.55 -0.07 0.00 0.02 0.00 0.00 46.19 41.69 2qw4 s LEU 99 CO 0.78 -1.81 0.95 -1.54 0.02 0.00 0.00 176.35 174.75 2qw4 n SER 100 N -1.65 0.85 -0.08 2.29 3.41 -1.26 -4.69 113.62 112.48 2qw4 n SER 100 Ca 0.14 0.89 0.25 0.00 -0.26 0.00 0.00 58.87 59.90 2qw4 n SER 100 Cb 0.48 -1.36 0.72 0.00 -0.26 0.00 0.00 64.21 63.79 2qw4 n SER 100 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 2qw4 h PRO 101 N 0.91 0.00 -0.39 4.33 0.13 -1.93 0.12 132.00 135.18 2qw4 h PRO 101 Ca -0.47 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2qw4 h PRO 101 Cb 1.35 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.47 2qw4 h PRO 101 CO 0.53 0.00 0.23 0.00 -0.23 0.00 0.00 178.00 178.53 2qw4 h ALA 102 N 1.53 0.50 0.00 -0.56 0.00 -2.01 -2.36 119.26 116.36 2qw4 h ALA 102 Ca 0.34 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.16 2qw4 h ALA 102 Cb 1.48 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 2qw4 h ALA 102 CO -0.00 0.00 -0.39 -0.44 0.00 0.00 0.00 179.25 178.41 2qw4 h ASP 103 N 0.51 0.00 -0.20 0.00 5.19 -1.51 -3.19 116.42 117.22 2qw4 h ASP 103 Ca 0.14 0.00 0.03 0.00 -0.62 0.00 0.00 57.03 56.58 2qw4 h ASP 103 Cb 0.02 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.50 2qw4 h ASP 103 CO -0.03 0.14 0.01 1.56 -3.12 0.00 0.00 179.24 177.80 2qw4 h GLN 104 N 0.00 0.07 -0.13 3.56 4.20 -0.59 -2.43 115.11 119.80 2qw4 h GLN 104 Ca -0.01 -0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.72 2qw4 h GLN 104 Cb 1.11 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.85 2qw4 h GLN 104 CO 0.02 0.05 -0.04 -0.44 -0.67 0.00 0.00 178.83 177.75 2qw4 h ASP 105 N 0.08 -0.13 0.18 1.46 3.32 -1.42 -2.12 116.42 117.78 2qw4 h ASP 105 Ca 0.09 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 2qw4 h ASP 105 Cb 0.11 0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.75 2qw4 h ASP 105 CO -0.15 -0.05 -0.09 0.25 -1.72 0.00 0.00 179.24 177.49 2qw4 h LEU 106 N -0.01 -0.20 -2.21 1.55 5.85 -1.61 0.52 115.31 119.19 2qw4 h LEU 106 Ca 0.06 -0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.73 2qw4 h LEU 106 Cb 0.11 0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 2qw4 h LEU 106 CO -0.14 -0.05 0.27 -0.07 -0.34 0.00 0.00 178.44 178.11 2qw4 h LEU 107 N -0.35 0.00 0.00 2.25 3.38 -1.15 -1.60 115.31 117.85 2qw4 h LEU 107 Ca -0.02 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.60 2qw4 h LEU 107 Cb 0.27 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.96 2qw4 h LEU 107 CO 0.04 0.00 -2.24 -0.11 0.09 0.00 0.00 178.44 176.22 2qw4 n LEU 108 N -3.19 2.58 -0.20 1.67 0.00 -0.82 -3.16 117.00 113.88 2qw4 n LEU 108 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 56.01 55.99 2qw4 n LEU 108 Cb 0.35 -0.73 0.09 0.00 0.00 0.00 0.00 43.42 43.12 2qw4 n LEU 108 CO 0.19 0.75 1.04 -0.33 0.00 0.00 0.00 177.39 179.04 2qw4 h GLU 109 N -0.24 0.52 0.00 1.96 5.08 0.41 -0.41 114.58 121.90 2qw4 h GLU 109 Ca -0.51 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 57.75 2qw4 h GLU 109 Cb 1.68 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.80 2qw4 h GLU 109 CO -0.16 0.35 -0.33 0.77 -1.00 0.00 0.00 179.01 178.64 2qw4 h SER 110 N 0.54 0.00 1.13 1.42 0.02 -1.51 -3.17 113.55 111.99 2qw4 h SER 110 Ca 0.28 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.23 2qw4 h SER 110 Cb 0.23 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.77 2qw4 h SER 110 CO -0.21 0.33 -0.83 0.00 -1.14 0.00 0.00 176.83 174.98 2qw4 h ALA 111 N 1.67 0.58 -0.40 3.77 0.00 -1.30 -3.42 119.26 120.16 2qw4 h ALA 111 Ca -0.00 0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.99 2qw4 h ALA 111 Cb 0.76 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.46 2qw4 h ALA 111 CO 0.04 0.00 -0.28 0.35 0.00 0.00 0.00 179.25 179.37 2qw4 h PHE 112 N 0.00 -0.75 -0.50 0.00 3.57 -1.07 0.13 116.94 118.31 2qw4 h PHE 112 Ca 0.00 0.05 -0.05 0.00 3.53 0.00 0.00 57.97 61.50 2qw4 h PHE 112 Cb 0.98 0.39 -0.02 0.00 2.79 0.00 0.00 35.95 40.09 2qw4 h PHE 112 CO 0.00 -0.35 0.10 1.25 -2.23 0.00 0.00 178.31 177.08 2qw4 h LEU 113 N -0.21 0.79 -0.26 0.59 5.85 -1.81 0.97 115.31 121.22 2qw4 h LEU 113 Ca 0.18 -0.25 -0.02 0.00 0.84 0.00 0.00 57.88 58.63 2qw4 h LEU 113 Cb 0.50 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 2qw4 h LEU 113 CO -0.52 0.83 0.08 -0.33 -0.34 0.00 0.00 178.44 178.16 2qw4 h GLU 114 N 0.71 0.41 0.01 1.25 5.08 -1.75 -2.29 114.58 117.99 2qw4 h GLU 114 Ca 0.16 -0.09 0.02 0.00 -1.00 0.00 0.00 59.36 58.44 2qw4 h GLU 114 Cb 0.37 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 2qw4 h GLU 114 CO 0.01 0.49 -0.12 -0.07 -1.00 0.00 0.00 179.01 178.32 2qw4 h LEU 115 N 0.26 -0.33 -0.72 1.33 3.38 -0.44 0.16 115.31 118.94 2qw4 h LEU 115 Ca 0.08 0.05 0.11 0.00 0.09 0.00 0.00 57.88 58.21 2qw4 h LEU 115 Cb 0.25 0.14 -0.12 0.00 0.09 0.00 0.00 40.66 41.01 2qw4 h LEU 115 CO -0.00 -0.17 -0.41 0.15 0.09 0.00 0.00 178.44 178.11 2qw4 h PHE 116 N -0.20 -1.17 0.03 1.13 3.57 0.10 -0.24 116.94 120.16 2qw4 h PHE 116 Ca 0.04 0.09 -0.00 0.00 3.53 0.00 0.00 57.97 61.63 2qw4 h PHE 116 Cb 0.25 0.62 0.00 0.00 2.79 0.00 0.00 35.95 39.61 2qw4 h PHE 116 CO -0.17 -0.40 -0.02 0.82 -2.23 0.00 0.00 178.31 176.31 2qw4 h ILE 117 N -0.13 1.15 -0.38 1.41 2.04 -0.77 -1.74 117.51 119.09 2qw4 h ILE 117 Ca 0.24 -0.59 0.02 0.00 1.00 0.00 0.00 64.86 65.52 2qw4 h ILE 117 Cb 0.56 1.55 -0.02 0.00 -0.74 0.00 0.00 36.82 38.16 2qw4 h ILE 117 CO -0.78 0.15 0.23 0.25 0.00 0.00 0.00 178.15 177.99 2qw4 h LEU 118 N -0.30 0.37 -0.15 1.44 5.85 -0.60 0.40 115.31 122.32 2qw4 h LEU 118 Ca -0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2qw4 h LEU 118 Cb 0.28 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 2qw4 h LEU 118 CO 0.01 0.27 0.02 0.03 -0.34 0.00 0.00 178.44 178.42 2qw4 h ARG 119 N 0.46 0.25 -0.49 1.25 3.08 -1.00 -0.63 114.38 117.30 2qw4 h ARG 119 Ca 0.15 -0.07 -0.05 0.00 0.07 0.00 0.00 59.98 60.08 2qw4 h ARG 119 Cb 0.00 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 2qw4 h ARG 119 CO -0.07 0.45 0.12 1.25 -1.07 0.00 0.00 179.97 180.65 2qw4 h LEU 120 N 0.02 0.75 -0.68 3.04 5.85 -1.05 -2.02 115.31 121.21 2qw4 h LEU 120 Ca 0.04 -0.23 -0.00 0.00 0.84 0.00 0.00 57.88 58.53 2qw4 h LEU 120 Cb 0.32 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 2qw4 h LEU 120 CO 0.00 0.79 0.41 0.00 -0.34 0.00 0.00 178.44 179.30 2qw4 h ALA 121 N 0.99 0.87 -0.31 1.25 0.00 -0.02 0.16 119.26 122.20 2qw4 h ALA 121 Ca 0.15 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 2qw4 h ALA 121 Cb 0.33 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2qw4 h ALA 121 CO 0.00 0.34 -0.12 -0.92 0.00 0.00 0.00 179.25 178.56 2qw4 h TYR 122 N 0.93 0.56 0.08 0.00 3.20 -0.70 -3.22 116.97 117.83 2qw4 h TYR 122 Ca 0.25 -0.09 -0.32 0.00 3.14 0.00 0.00 58.73 61.71 2qw4 h TYR 122 Cb -0.03 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.06 2qw4 h TYR 122 CO -0.01 0.63 -1.74 -0.09 -1.64 0.00 0.00 178.16 175.30 2qw4 h ARG 123 N 0.48 0.17 0.00 1.82 2.43 -0.90 -3.47 114.38 114.91 2qw4 h ARG 123 Ca 0.09 -0.30 -0.14 0.00 -0.81 0.00 0.00 59.98 58.83 2qw4 h ARG 123 Cb 0.50 0.11 0.07 0.00 -0.42 0.00 0.00 29.97 30.23 2qw4 h ARG 123 CO 0.03 0.95 0.01 0.43 -1.51 0.00 0.00 179.97 179.88 2qw4 n SER 124 N -3.33 -1.78 -3.38 -3.80 7.64 0.53 -4.70 113.62 104.79 2qw4 n SER 124 Ca -0.22 -0.62 -0.17 0.00 1.01 0.00 0.00 58.87 58.88 2qw4 n SER 124 Cb 1.05 -0.35 -0.09 0.00 -1.01 0.00 0.00 64.21 63.80 2qw4 n SER 124 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2qw4 s LYS 125 N -3.84 0.39 0.18 1.43 1.02 0.14 -4.91 119.74 114.15 2qw4 s LYS 125 Ca 0.25 -0.27 -0.18 0.00 0.02 0.00 0.00 55.97 55.79 2qw4 s LYS 125 Cb -0.03 -0.64 0.13 0.00 -0.52 0.00 0.00 37.83 36.77 2qw4 s LYS 125 CO 0.19 -1.07 1.63 -1.35 -0.92 0.00 0.00 175.35 173.84 2qw4 h PRO 126 N 8.01 -0.09 -0.65 -1.68 0.11 -1.88 -1.61 132.00 134.20 2qw4 h PRO 126 Ca -0.09 0.01 0.12 0.00 0.11 0.00 0.00 66.00 66.15 2qw4 h PRO 126 Cb 1.07 0.02 -0.09 0.00 0.11 0.00 0.00 31.00 32.12 2qw4 h PRO 126 CO 0.30 -0.06 0.17 0.78 -0.21 0.00 0.00 178.00 178.98 2qw4 h GLY 127 N -0.10 0.87 -0.90 -0.55 0.00 -1.95 0.37 103.07 100.82 2qw4 h GLY 127 Ca 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.49 2qw4 h GLY 127 CO -0.53 -0.12 0.00 1.18 0.00 0.00 0.00 176.54 177.08 2qw4 n GLU 128 N -5.10 1.79 -1.31 4.80 1.02 -1.16 -4.93 120.64 115.75 2qw4 n GLU 128 Ca 0.11 -1.18 -0.11 0.00 -0.02 0.00 0.00 57.16 55.95 2qw4 n GLU 128 Cb 0.35 -1.42 -0.05 0.00 -0.02 0.00 0.00 31.44 30.31 2qw4 n GLU 128 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qw4 n GLY 129 N 1.17 1.14 3.69 0.62 0.00 0.13 -4.89 105.19 107.04 2qw4 n GLY 129 Ca 0.17 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.74 4.40 -0.38 1.61 1.02 -0.69 -0.20 119.74 122.76 2qw4 s LYS 130 Ca 0.00 1.25 -0.15 0.00 0.02 0.00 0.00 55.97 57.09 2qw4 s LYS 130 Cb 0.00 -3.54 0.01 0.00 -0.52 0.00 0.00 37.83 33.78 2qw4 s LYS 130 CO 0.00 -0.27 0.33 -0.51 -0.92 0.00 0.00 175.35 173.98 2qw4 s LEU 131 N 1.88 4.79 -0.32 3.17 1.43 0.81 0.23 118.68 130.66 2qw4 s LEU 131 Ca 0.45 -0.61 -0.12 0.00 -1.03 0.00 0.00 54.13 52.83 2qw4 s LEU 131 Cb -0.18 -2.25 -0.02 0.00 0.03 0.00 0.00 46.19 43.78 2qw4 s LEU 131 CO 0.17 -0.41 0.21 -0.63 0.23 0.00 0.00 176.35 175.92 2qw4 s ILE 132 N 1.87 5.07 0.40 -0.59 1.01 -1.26 -1.60 121.20 126.09 2qw4 s ILE 132 Ca 0.08 -0.24 -0.03 0.00 0.00 0.00 0.00 60.65 60.46 2qw4 s ILE 132 Cb -0.18 -3.58 -0.04 0.00 0.01 0.00 0.00 42.46 38.68 2qw4 s ILE 132 CO 0.11 0.04 0.66 -0.36 0.00 0.00 0.00 174.94 175.39 2qw4 s PHE 133 N 1.69 3.52 0.38 3.97 0.40 -0.35 -4.32 117.98 123.28 2qw4 s PHE 133 Ca 0.06 0.60 0.14 0.00 -0.60 0.00 0.00 56.93 57.13 2qw4 s PHE 133 Cb -0.17 -2.11 0.97 0.00 0.51 0.00 0.00 43.02 42.22 2qw4 s PHE 133 CO 0.09 -0.06 1.82 0.00 0.70 0.00 0.00 175.22 177.78 2qw4 n SER 135 N -4.60 0.83 0.00 0.00 3.41 -1.26 -4.27 113.62 107.73 2qw4 n SER 135 Ca 0.21 -2.04 0.00 0.00 -0.26 0.00 0.00 58.87 56.79 2qw4 n SER 135 Cb 0.68 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 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 0.34 2.24 3.73 5.00 0.00 0.14 -4.90 105.19 111.74 2qw4 n GLY 136 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 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 4.42 -0.20 0.99 2.96 -1.25 -0.14 118.68 125.46 2qw4 s LEU 137 Ca 0.00 2.21 -0.04 0.00 -0.22 0.00 0.00 54.13 56.08 2qw4 s LEU 137 Cb 0.00 -3.60 -0.02 0.00 0.50 0.00 0.00 46.19 43.07 2qw4 s LEU 137 CO 0.00 -0.44 -0.02 -0.69 -1.32 0.00 0.00 176.35 173.88 2qw4 s VAL 138 N 0.33 3.68 -0.01 1.68 1.01 0.14 -1.21 120.40 126.03 2qw4 s VAL 138 Ca 0.56 -0.40 0.02 0.00 0.00 0.00 0.00 61.98 62.15 2qw4 s VAL 138 Cb -0.33 -2.66 -0.00 0.00 0.00 0.00 0.00 36.38 33.39 2qw4 s VAL 138 CO 0.34 0.43 -0.06 -0.76 0.00 0.00 0.00 175.10 175.05 2qw4 s LEU 139 N 1.14 1.96 0.45 3.92 1.02 -0.63 -3.64 118.68 122.88 2qw4 s LEU 139 Ca 0.02 -0.11 -0.23 0.00 0.02 0.00 0.00 54.13 53.83 2qw4 s LEU 139 Cb -0.15 -0.33 -0.08 0.00 0.02 0.00 0.00 46.19 45.66 2qw4 s LEU 139 CO 0.00 0.07 1.14 -2.28 0.02 0.00 0.00 176.35 175.30 2qw4 s HIS 140 N -0.06 2.96 0.17 0.29 5.65 -1.26 -0.13 115.29 122.90 2qw4 s HIS 140 Ca 0.01 1.56 -0.05 0.00 0.25 0.00 0.00 55.06 56.83 2qw4 s HIS 140 Cb -0.03 -3.32 0.27 0.00 -1.18 0.00 0.00 32.58 28.31 2qw4 s HIS 140 CO -0.00 -1.31 0.95 -2.13 -0.65 0.00 0.00 174.74 171.60 2qw4 n ARG 141 N -0.40 -0.06 0.01 2.88 0.63 0.72 -0.85 116.66 119.59 2qw4 n ARG 141 Ca 0.07 0.95 0.13 0.00 -0.92 0.00 0.00 57.85 58.08 2qw4 n ARG 141 Cb 0.48 -1.41 0.49 0.00 0.45 0.00 0.00 32.46 32.48 2qw4 n ARG 141 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2qw4 n LEU 142 N -4.98 0.22 0.11 6.15 4.77 -1.26 -2.96 117.00 119.05 2qw4 n LEU 142 Ca 0.09 0.38 0.05 0.00 -0.03 0.00 0.00 56.01 56.51 2qw4 n LEU 142 Cb 0.30 -0.41 0.01 0.00 -2.33 0.00 0.00 43.42 40.98 2qw4 n LEU 142 CO -0.07 0.01 0.17 1.56 -1.33 0.00 0.00 177.39 177.73 2qw4 h GLN 143 N 0.00 0.00 0.04 3.23 4.20 -1.33 -3.34 115.11 117.92 2qw4 h GLN 143 Ca 0.00 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.47 2qw4 h GLN 143 Cb 0.53 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.29 2qw4 h GLN 143 CO 0.00 0.24 -1.13 0.00 -0.67 0.00 0.00 178.83 177.28 2qw4 h ALA 145 N 0.86 0.88 -0.93 0.00 0.00 -1.65 0.16 119.26 118.57 2qw4 h ALA 145 Ca -0.07 0.29 0.17 0.00 0.00 0.00 0.00 54.91 55.30 2qw4 h ALA 145 Cb 1.85 0.52 -0.10 0.00 0.00 0.00 0.00 17.79 20.06 2qw4 h ALA 145 CO 0.15 -0.46 0.52 0.00 0.00 0.00 0.00 179.25 179.46 2qw4 h ARG 146 N 0.06 0.67 0.05 0.00 3.08 -1.77 -0.10 114.38 116.37 2qw4 h ARG 146 Ca 0.48 -0.04 -0.36 0.00 0.07 0.00 0.00 59.98 60.13 2qw4 h ARG 146 Cb 0.87 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.73 2qw4 h ARG 146 CO -0.79 0.44 -2.03 0.41 -1.07 0.00 0.00 179.97 176.93 2qw4 n GLY 147 N -1.33 -0.56 0.08 0.04 0.00 -0.40 -4.55 105.19 98.48 2qw4 n GLY 147 Ca 0.20 -0.15 -0.06 0.00 0.00 0.00 0.00 46.02 46.01 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 -3.76 0.88 -4.29 1.61 3.01 0.43 -4.94 117.46 110.41 2qw4 n PHE 148 Ca -0.39 0.31 0.00 0.00 1.01 0.00 0.00 57.45 58.39 2qw4 n PHE 148 Cb 0.93 -1.13 0.00 0.00 -0.01 0.00 0.00 39.48 39.26 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 1.53 -1.55 0.51 1.37 0.00 -0.05 -3.77 105.19 103.23 2qw4 n GLY 149 Ca -0.17 -1.27 0.32 0.00 0.00 0.00 0.00 46.02 44.90 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 -0.31 0.00 -0.07 1.61 8.00 -1.26 -1.81 116.55 122.71 2qw4 n ASP 150 Ca 0.00 0.72 0.13 0.00 0.71 0.00 0.00 54.79 56.35 2qw4 n ASP 150 Cb 0.00 -0.29 0.52 0.00 -0.02 0.00 0.00 41.12 41.33 2qw4 n ASP 150 CO 0.00 0.00 0.00 -0.25 -0.39 0.00 0.00 177.20 176.56 2qw4 h TRP 151 N 0.00 0.39 0.00 1.24 7.01 -1.95 0.40 115.95 123.04 2qw4 h TRP 151 Ca 0.56 0.01 -0.08 0.00 2.11 0.00 0.00 58.89 61.49 2qw4 h TRP 151 Cb 2.79 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 29.71 2qw4 h TRP 151 CO 0.00 0.18 -0.36 0.97 -2.79 0.00 0.00 178.44 176.45 2qw4 h ILE 152 N 0.36 0.94 -0.10 2.65 6.09 -1.60 -1.77 117.51 124.09 2qw4 h ILE 152 Ca 0.27 -1.39 -0.22 0.00 -1.37 0.00 0.00 64.86 62.15 2qw4 h ILE 152 Cb 0.58 1.83 0.01 0.00 0.47 0.00 0.00 36.82 39.70 2qw4 h ILE 152 CO -0.07 0.35 -0.80 0.44 -3.07 0.00 0.00 178.15 175.00 2qw4 h ASP 153 N 0.00 0.76 -0.52 2.19 3.32 -1.12 -1.56 116.42 119.49 2qw4 h ASP 153 Ca -0.00 -0.52 0.07 0.00 0.02 0.00 0.00 57.03 56.60 2qw4 h ASP 153 Cb 0.80 -0.23 -0.06 0.00 0.22 0.00 0.00 39.33 40.06 2qw4 h ASP 153 CO 0.05 1.30 0.18 0.28 -1.72 0.00 0.00 179.24 179.32 2qw4 h SER 154 N 0.42 0.16 -0.38 6.45 0.02 -1.37 0.14 113.55 118.99 2qw4 h SER 154 Ca -0.06 0.07 -0.03 0.00 -0.84 0.00 0.00 61.79 60.93 2qw4 h SER 154 Cb 1.42 0.06 -0.02 0.00 0.14 0.00 0.00 62.40 64.00 2qw4 h SER 154 CO 0.15 0.12 0.13 0.40 -1.14 0.00 0.00 176.83 176.49 2qw4 h ILE 155 N 0.35 1.20 -0.76 3.27 2.04 -1.33 -2.10 117.51 120.17 2qw4 h ILE 155 Ca 0.25 -0.65 0.05 0.00 1.00 0.00 0.00 64.86 65.52 2qw4 h ILE 155 Cb 0.28 0.92 -0.06 0.00 -0.74 0.00 0.00 36.82 37.23 2qw4 h ILE 155 CO -0.26 0.23 0.46 -0.07 0.00 0.00 0.00 178.15 178.50 2qw4 h LEU 156 N 0.46 0.71 -1.08 1.44 3.38 -0.82 -0.38 115.31 119.03 2qw4 h LEU 156 Ca 0.12 0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.12 2qw4 h LEU 156 Cb 0.22 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 2qw4 h LEU 156 CO -0.01 0.47 0.62 0.00 0.09 0.00 0.00 178.44 179.61 2qw4 h ALA 157 N 1.36 1.33 -0.18 1.53 0.00 -0.49 0.51 119.26 123.32 2qw4 h ALA 157 Ca 0.33 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 2qw4 h ALA 157 Cb 0.15 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2qw4 h ALA 157 CO -0.16 0.62 0.05 0.35 0.00 0.00 0.00 179.25 180.11 2qw4 h PHE 158 N 1.28 0.30 -0.86 0.00 3.57 -1.01 -2.27 116.94 117.95 2qw4 h PHE 158 Ca 0.34 -0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.89 2qw4 h PHE 158 Cb -0.15 -0.08 -0.06 0.00 2.79 0.00 0.00 35.95 38.45 2qw4 h PHE 158 CO 0.00 0.41 0.56 1.03 -2.23 0.00 0.00 178.31 178.08 2qw4 h SER 159 N 0.10 0.80 0.48 0.41 0.87 -0.51 -1.02 113.55 114.67 2qw4 h SER 159 Ca 0.06 0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.62 2qw4 h SER 159 Cb 0.26 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.06 2qw4 h SER 159 CO 0.00 0.49 -0.34 -0.09 -0.53 0.00 0.00 176.83 176.36 2qw4 h ARG 160 N 0.89 -0.77 -0.60 2.24 2.43 -0.72 -2.52 114.38 115.33 2qw4 h ARG 160 Ca 0.39 0.05 0.11 0.00 -0.81 0.00 0.00 59.98 59.72 2qw4 h ARG 160 Cb 0.33 0.17 -0.12 0.00 -0.42 0.00 0.00 29.97 29.93 2qw4 h ARG 160 CO -0.15 -0.51 -0.25 1.03 -1.51 0.00 0.00 179.97 178.57 2qw4 h SER 161 N -0.80 -0.89 0.29 -3.80 0.87 -0.78 -2.45 113.55 105.99 2qw4 h SER 161 Ca -0.05 0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.72 2qw4 h SER 161 Cb 0.67 0.49 -0.03 0.00 -0.44 0.00 0.00 62.40 63.08 2qw4 h SER 161 CO 0.03 -0.27 -0.44 -0.07 -0.53 0.00 0.00 176.83 175.55 2qw4 h LEU 162 N -0.10 -1.24 -0.69 2.23 3.38 -1.21 -3.15 115.31 114.52 2qw4 h LEU 162 Ca 0.27 0.12 0.13 0.00 0.09 0.00 0.00 57.88 58.49 2qw4 h LEU 162 Cb 0.52 0.44 -0.09 0.00 0.09 0.00 0.00 40.66 41.61 2qw4 h LEU 162 CO -0.66 -0.55 0.23 0.45 0.09 0.00 0.00 178.44 177.99 2qw4 h HIS 163 N -0.79 0.38 -1.04 1.13 3.86 -1.23 0.16 115.15 117.63 2qw4 h HIS 163 Ca -0.02 0.04 0.37 0.00 -1.16 0.00 0.00 60.37 59.60 2qw4 h HIS 163 Cb 0.74 -0.06 -0.16 0.00 1.06 0.00 0.00 27.41 28.99 2qw4 h HIS 163 CO -0.30 0.02 0.59 1.03 0.86 0.00 0.00 177.93 180.13 2qw4 h SER 164 N 0.36 0.41 0.76 2.45 0.87 -1.41 0.26 113.55 117.26 2qw4 h SER 164 Ca 0.38 0.21 0.00 0.00 -1.23 0.00 0.00 61.79 61.15 2qw4 h SER 164 Cb 0.57 0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.71 2qw4 h SER 164 CO -0.41 -0.26 0.00 -0.07 -0.53 0.00 0.00 176.83 175.56 2qw4 h LEU 165 N 0.17 0.00 -2.92 2.23 4.07 -0.68 -3.47 115.31 114.71 2qw4 h LEU 165 Ca 0.79 0.00 -0.41 0.00 0.08 0.00 0.00 57.88 58.33 2qw4 h LEU 165 Cb 1.99 0.00 0.09 0.00 1.08 0.00 0.00 40.66 43.82 2qw4 h LEU 165 CO -0.65 0.00 -0.92 0.18 -1.08 0.00 0.00 178.44 175.97 2qw4 n LEU 166 N -2.59 -3.17 -4.54 1.67 4.77 0.90 -4.88 117.00 109.17 2qw4 n LEU 166 Ca 0.01 -0.96 -0.42 0.00 -0.03 0.00 0.00 56.01 54.60 2qw4 n LEU 166 Cb 0.24 -2.50 -0.03 0.00 -2.33 0.00 0.00 43.42 38.79 2qw4 n LEU 166 CO 0.22 0.42 0.89 -0.69 -1.33 0.00 0.00 177.39 176.90 2qw4 s VAL 167 N -3.50 4.20 0.82 4.08 1.01 -1.26 -5.02 120.40 120.73 2qw4 s VAL 167 Ca 0.41 0.42 -0.10 0.00 0.00 0.00 0.00 61.98 62.70 2qw4 s VAL 167 Cb -0.13 -4.65 0.08 0.00 0.00 0.00 0.00 36.38 31.68 2qw4 s VAL 167 CO 0.84 -1.29 1.10 1.51 0.00 0.00 0.00 175.10 177.27 2qw4 s ASP 168 N 3.05 4.03 0.19 3.32 3.84 -1.26 -4.77 116.67 125.07 2qw4 s ASP 168 Ca 0.34 1.90 -0.21 0.00 -0.00 0.00 0.00 52.55 54.58 2qw4 s ASP 168 Cb -0.11 -2.51 0.13 0.00 -1.38 0.00 0.00 42.92 39.04 2qw4 s ASP 168 CO 0.20 -2.35 1.59 0.58 -0.00 0.00 0.00 175.17 175.19 2qw4 h VAL 169 N -1.35 0.17 0.58 2.11 2.07 -1.99 -1.43 116.25 116.41 2qw4 h VAL 169 Ca -0.44 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.05 2qw4 h VAL 169 Cb 1.24 0.17 0.01 0.00 -1.52 0.00 0.00 31.29 31.19 2qw4 h VAL 169 CO 0.49 0.00 -0.28 -0.65 0.02 0.00 0.00 177.57 177.15 2qw4 h PRO 170 N -0.16 -0.75 -0.83 1.57 0.11 -1.95 0.12 132.00 130.11 2qw4 h PRO 170 Ca 0.24 0.05 0.16 0.00 0.11 0.00 0.00 66.00 66.56 2qw4 h PRO 170 Cb 0.55 0.17 -0.15 0.00 0.11 0.00 0.00 31.00 31.68 2qw4 h PRO 170 CO -0.69 -0.46 -0.22 0.00 -0.21 0.00 0.00 178.00 176.43 2qw4 n ALA 171 N -2.51 0.16 -0.24 -0.75 0.00 -1.14 0.04 120.51 116.07 2qw4 n ALA 171 Ca -0.12 0.90 -0.08 0.00 0.00 0.00 0.00 53.44 54.14 2qw4 n ALA 171 Cb 0.34 -0.53 0.04 0.00 0.00 0.00 0.00 19.45 19.31 2qw4 n ALA 171 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2qw4 h PHE 172 N 0.00 1.20 -0.69 0.00 3.57 -0.49 -1.72 116.94 118.81 2qw4 h PHE 172 Ca 0.38 -0.16 0.13 0.00 3.53 0.00 0.00 57.97 61.86 2qw4 h PHE 172 Cb 0.59 -0.33 -0.13 0.00 2.79 0.00 0.00 35.95 38.87 2qw4 h PHE 172 CO -0.65 0.99 -0.25 0.00 -2.23 0.00 0.00 178.31 176.17 2qw4 h ALA 173 N 1.07 0.27 -0.15 2.41 0.00 0.23 -1.18 119.26 121.91 2qw4 h ALA 173 Ca 0.21 0.24 -0.21 0.00 0.00 0.00 0.00 54.91 55.15 2qw4 h ALA 173 Cb 0.43 0.66 0.01 0.00 0.00 0.00 0.00 17.79 18.88 2qw4 h ALA 173 CO 0.01 -0.52 -0.72 0.00 0.00 0.00 0.00 179.25 178.02 2qw4 h LEU 175 N 0.47 -1.33 -1.54 0.00 6.46 -0.37 0.13 115.31 119.14 2qw4 h LEU 175 Ca -0.05 0.19 -0.01 0.00 -0.12 0.00 0.00 57.88 57.89 2qw4 h LEU 175 Cb 1.36 0.56 -0.02 0.00 -0.73 0.00 0.00 40.66 41.82 2qw4 h LEU 175 CO 0.15 -0.40 0.20 0.77 -0.62 0.00 0.00 178.44 178.54 2qw4 h SER 176 N -0.42 0.45 -0.59 1.25 4.64 -1.32 -0.31 113.55 117.24 2qw4 h SER 176 Ca 0.10 -0.03 -0.08 0.00 -0.47 0.00 0.00 61.79 61.31 2qw4 h SER 176 Cb 0.60 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 62.56 2qw4 h SER 176 CO -0.46 0.37 0.04 0.00 -0.87 0.00 0.00 176.83 175.91 2qw4 h ALA 177 N 1.71 0.79 -0.42 5.18 0.00 -1.15 -2.62 119.26 122.75 2qw4 h ALA 177 Ca 0.13 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2qw4 h ALA 177 Cb 0.03 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2qw4 h ALA 177 CO -0.02 0.59 0.18 -0.07 0.00 0.00 0.00 179.25 179.93 2qw4 h LEU 178 N 0.91 0.57 -0.88 0.00 3.38 0.82 0.65 115.31 120.76 2qw4 h LEU 178 Ca 0.17 -0.16 0.17 0.00 0.09 0.00 0.00 57.88 58.16 2qw4 h LEU 178 Cb 0.50 -0.15 -0.10 0.00 0.09 0.00 0.00 40.66 41.00 2qw4 h LEU 178 CO 0.02 0.57 0.45 0.58 0.09 0.00 0.00 178.44 180.16 2qw4 h VAL 179 N 0.53 0.66 0.20 1.22 2.07 -1.07 -2.86 116.25 117.00 2qw4 h VAL 179 Ca 0.14 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 2qw4 h VAL 179 Cb 0.17 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 29.97 2qw4 h VAL 179 CO -0.01 0.11 -0.10 0.25 0.02 0.00 0.00 177.57 177.84 2qw4 h LEU 180 N 0.58 -0.23 -8.25 2.57 5.85 -0.89 -3.43 115.31 111.51 2qw4 h LEU 180 Ca 0.51 -0.23 -0.60 0.00 0.84 0.00 0.00 57.88 58.40 2qw4 h LEU 180 Cb 0.80 0.06 -0.12 0.00 0.37 0.00 0.00 40.66 41.77 2qw4 h LEU 180 CO -0.41 0.30 0.85 -0.63 -0.34 0.00 0.00 178.44 178.21 2qw4 s ILE 181 N -3.08 4.10 0.02 4.05 1.09 0.22 -4.83 121.20 122.77 2qw4 s ILE 181 Ca -0.10 -0.22 -0.28 0.00 -1.10 0.00 0.00 60.65 58.95 2qw4 s ILE 181 Cb 0.00 -4.82 0.09 0.00 -1.06 0.00 0.00 42.46 36.68 2qw4 s ILE 181 CO 0.35 -1.66 0.77 0.28 -0.10 0.00 0.00 174.94 174.59 2qw4 s THR 182 N 4.65 0.00 -0.15 2.92 -1.32 -1.26 -4.62 115.64 115.86 2qw4 s THR 182 Ca 0.30 0.00 -0.41 0.00 -1.21 0.00 0.00 61.69 60.37 2qw4 s THR 182 Cb -0.11 -1.00 -0.19 0.00 -1.51 0.00 0.00 72.50 69.69 2qw4 s THR 182 CO 0.08 0.00 1.32 0.47 -2.21 0.00 0.00 174.62 174.29 2qw4 n ASP 183 N 0.07 0.82 -3.82 8.08 8.00 -1.26 -4.99 116.55 123.45 2qw4 n ASP 183 Ca -0.13 1.15 -0.14 0.00 0.71 0.00 0.00 54.79 56.38 2qw4 n ASP 183 Cb 0.61 -0.97 -0.15 0.00 -0.02 0.00 0.00 41.12 40.59 2qw4 n ASP 183 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2qw4 s ARG 184 N 1.24 -0.01 0.14 -1.24 1.81 -1.26 -5.12 118.95 114.51 2qw4 s ARG 184 Ca 0.95 0.09 -0.35 0.00 -1.72 0.00 0.00 55.73 54.70 2qw4 s ARG 184 Cb -1.26 -0.14 -0.15 0.00 -0.45 0.00 0.00 34.95 32.95 2qw4 s ARG 184 CO 0.63 -0.09 1.52 1.58 -0.68 0.00 0.00 175.30 178.27 2qw4 n HIS 185 N 3.65 2.09 0.00 -0.53 -0.00 -1.26 -2.20 115.22 116.96 2qw4 n HIS 185 Ca -0.20 0.36 0.00 0.00 -0.00 0.00 0.00 57.72 57.88 2qw4 n HIS 185 Cb 0.55 -2.49 0.00 0.00 -0.00 0.00 0.00 29.99 28.05 2qw4 n HIS 185 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2qw4 n GLY 186 N 3.21 2.98 3.60 1.57 0.00 -1.26 -5.06 105.19 110.22 2qw4 n GLY 186 Ca 0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 2qw4 n GLY 186 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qw4 n LEU 187 N 0.00 3.31 0.08 0.99 4.77 -0.94 -4.88 117.00 120.33 2qw4 n LEU 187 Ca 0.00 0.39 -0.12 0.00 -0.03 0.00 0.00 56.01 56.25 2qw4 n LEU 187 Cb 0.00 -1.51 -0.05 0.00 -2.33 0.00 0.00 43.42 39.53 2qw4 n LEU 187 CO 0.00 -0.50 0.76 1.56 -1.33 0.00 0.00 177.39 177.88 2qw4 h GLN 188 N 13.66 -0.28 -2.88 3.23 4.20 -1.97 -3.35 115.11 127.73 2qw4 h GLN 188 Ca -0.42 0.02 -0.62 0.00 0.06 0.00 0.00 58.65 57.70 2qw4 h GLN 188 Cb 1.25 0.06 -0.42 0.00 0.30 0.00 0.00 27.48 28.68 2qw4 h GLN 188 CO 0.96 -0.19 -0.58 0.39 -0.67 0.00 0.00 178.83 178.74 2qw4 n GLU 189 N -5.29 1.97 -0.11 1.46 1.02 -1.26 -4.97 120.64 113.45 2qw4 n GLU 189 Ca -0.06 -4.52 -0.12 0.00 -0.02 0.00 0.00 57.16 52.45 2qw4 n GLU 189 Cb 0.20 -2.27 -0.03 0.00 -0.02 0.00 0.00 31.44 29.32 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 5.12 0.67 0.00 3.49 0.13 -1.98 -2.87 132.00 136.56 2qw4 h PRO 190 Ca 0.16 -0.28 0.00 0.00 -0.87 0.00 0.00 66.00 65.01 2qw4 h PRO 190 Cb 0.73 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.84 2qw4 h PRO 190 CO 0.74 0.87 0.00 0.07 -0.23 0.00 0.00 178.00 179.45 2qw4 h ARG 191 N 0.44 0.00 -0.04 0.86 -0.00 -1.95 0.43 114.38 114.12 2qw4 h ARG 191 Ca 0.08 0.00 -0.14 0.00 -0.00 0.00 0.00 59.98 59.92 2qw4 h ARG 191 Cb 0.66 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.61 2qw4 h ARG 191 CO 0.04 0.00 -0.60 0.00 -0.00 0.00 0.00 179.97 179.41 2qw4 h ARG 192 N 0.00 0.14 0.03 0.08 3.08 -1.93 0.54 114.38 116.32 2qw4 h ARG 192 Ca 0.00 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 2qw4 h ARG 192 Cb 0.40 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.47 2qw4 h ARG 192 CO 0.00 0.70 -0.01 0.28 -1.07 0.00 0.00 179.97 179.87 2qw4 h VAL 193 N 0.10 1.39 -0.75 2.04 2.07 -0.59 -2.92 116.25 117.60 2qw4 h VAL 193 Ca -0.01 -1.37 -0.06 0.00 0.82 0.00 0.00 66.70 66.08 2qw4 h VAL 193 Cb 1.09 2.30 -0.03 0.00 -1.52 0.00 0.00 31.29 33.12 2qw4 h VAL 193 CO 0.09 0.35 0.23 -0.08 0.02 0.00 0.00 177.57 178.17 2qw4 h GLU 194 N -0.64 1.16 -0.47 1.57 4.81 -0.35 0.39 114.58 121.05 2qw4 h GLU 194 Ca -0.00 -0.25 0.08 0.00 -0.13 0.00 0.00 59.36 59.06 2qw4 h GLU 194 Cb 0.59 -0.17 -0.10 0.00 0.63 0.00 0.00 28.75 29.71 2qw4 h GLU 194 CO 0.01 0.99 -0.38 1.49 -0.73 0.00 0.00 179.01 180.38 2qw4 h GLU 195 N 1.11 -0.25 -0.31 1.92 4.81 0.01 -2.32 114.58 119.57 2qw4 h GLU 195 Ca 0.24 0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.33 2qw4 h GLU 195 Cb 0.31 0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.75 2qw4 h GLU 195 CO -0.01 -0.16 -0.43 1.25 -0.73 0.00 0.00 179.01 178.93 2qw4 h LEU 196 N -0.25 0.90 -0.77 1.64 5.85 -1.23 -2.80 115.31 118.65 2qw4 h LEU 196 Ca 0.18 -0.50 0.12 0.00 0.84 0.00 0.00 57.88 58.52 2qw4 h LEU 196 Cb 0.56 -0.26 -0.13 0.00 0.37 0.00 0.00 40.66 41.20 2qw4 h LEU 196 CO -0.61 1.23 -0.37 -0.61 -0.34 0.00 0.00 178.44 177.74 2qw4 h GLN 197 N 0.60 -0.09 -0.73 1.25 4.15 -0.77 -2.08 115.11 117.43 2qw4 h GLN 197 Ca 0.03 0.01 0.04 0.00 0.77 0.00 0.00 58.65 59.50 2qw4 h GLN 197 Cb 1.02 0.02 -0.05 0.00 0.21 0.00 0.00 27.48 28.69 2qw4 h GLN 197 CO 0.10 -0.06 0.46 -0.91 -1.93 0.00 0.00 178.83 176.49 2qw4 h ASN 198 N -0.10 0.74 -0.26 -0.69 4.21 -1.15 0.73 115.58 119.08 2qw4 h ASN 198 Ca 0.28 0.00 -0.16 0.00 1.21 0.00 0.00 56.30 57.63 2qw4 h ASN 198 Cb 0.57 -0.16 0.00 0.00 -1.12 0.00 0.00 38.32 37.61 2qw4 h ASN 198 CO -0.82 0.51 -0.45 0.03 -1.29 0.00 0.00 177.43 175.41 2qw4 h ARG 199 N 0.88 0.76 -0.50 0.81 3.08 -1.43 0.62 114.38 118.60 2qw4 h ARG 199 Ca 0.30 -0.47 0.09 0.00 0.07 0.00 0.00 59.98 59.96 2qw4 h ARG 199 Cb 0.04 0.05 -0.07 0.00 0.08 0.00 0.00 29.97 30.07 2qw4 h ARG 199 CO -0.12 1.10 0.08 0.82 -1.07 0.00 0.00 179.97 180.78 2qw4 h ILE 200 N 0.50 0.69 -0.93 2.04 2.04 -1.07 0.21 117.51 121.00 2qw4 h ILE 200 Ca 0.02 -0.07 0.14 0.00 1.00 0.00 0.00 64.86 65.94 2qw4 h ILE 200 Cb 1.05 0.47 -0.09 0.00 -0.74 0.00 0.00 36.82 37.51 2qw4 h ILE 200 CO 0.10 0.04 0.55 0.00 0.00 0.00 0.00 178.15 178.84 2qw4 h ALA 201 N 1.40 1.42 -0.17 1.87 0.00 -0.26 -1.61 119.26 121.90 2qw4 h ALA 201 Ca 0.25 0.05 -0.13 0.00 0.00 0.00 0.00 54.91 55.08 2qw4 h ALA 201 Cb 0.35 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2qw4 h ALA 201 CO -0.35 0.07 -0.45 0.77 0.00 0.00 0.00 179.25 179.29 2qw4 h SER 202 N 0.82 0.45 0.47 0.00 0.02 0.10 0.13 113.55 115.54 2qw4 h SER 202 Ca 0.48 -0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 61.21 2qw4 h SER 202 Cb 0.58 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.98 2qw4 h SER 202 CO -0.31 0.84 -0.44 0.00 -1.14 0.00 0.00 176.83 175.78 2qw4 h LEU 204 N -0.90 -0.59 -0.44 0.00 5.85 -1.21 0.36 115.31 118.39 2qw4 h LEU 204 Ca -0.06 0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.82 2qw4 h LEU 204 Cb 0.77 0.31 -0.04 0.00 0.37 0.00 0.00 40.66 42.08 2qw4 h LEU 204 CO -0.04 -0.21 0.22 0.50 -0.34 0.00 0.00 178.44 178.57 2qw4 h LYS 205 N -0.14 0.43 0.00 1.25 3.64 -0.70 -1.41 116.57 119.63 2qw4 h LYS 205 Ca 0.16 -0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 59.41 2qw4 h LYS 205 Cb 0.39 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.09 2qw4 h LYS 205 CO -0.40 0.28 -0.53 1.49 -2.27 0.00 0.00 179.45 178.03 2qw4 h GLU 206 N 0.44 0.00 -0.48 1.90 4.81 -0.65 -2.55 114.58 118.06 2qw4 h GLU 206 Ca 0.19 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.32 2qw4 h GLU 206 Cb 0.09 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 2qw4 h GLU 206 CO -0.13 0.53 -0.07 1.25 -0.73 0.00 0.00 179.01 179.85 2qw4 h HIS 207 N 0.00 0.99 0.00 0.92 2.76 0.20 -2.90 115.15 117.12 2qw4 h HIS 207 Ca -0.01 -0.20 -0.06 0.00 -2.20 0.00 0.00 60.37 57.90 2qw4 h HIS 207 Cb 1.18 -0.25 -0.01 0.00 1.55 0.00 0.00 27.41 29.89 2qw4 h HIS 207 CO 0.00 0.96 -0.30 -0.39 -1.30 0.00 0.00 177.93 176.90 2qw4 h VAL 208 N 0.74 0.55 -0.66 5.26 -1.51 -1.30 -2.96 116.25 116.38 2qw4 h VAL 208 Ca 0.13 -1.60 -0.01 0.00 -1.23 0.00 0.00 66.70 63.99 2qw4 h VAL 208 Cb 0.61 2.13 -0.03 0.00 -2.13 0.00 0.00 31.29 31.87 2qw4 h VAL 208 CO 0.04 0.29 0.38 0.00 -1.23 0.00 0.00 177.57 177.05 2qw4 h ALA 209 N 1.70 1.42 -3.00 5.19 0.00 -1.37 -3.28 119.26 119.93 2qw4 h ALA 209 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2qw4 h ALA 209 Cb 1.11 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2qw4 h ALA 209 CO 0.04 0.49 0.00 0.00 0.00 0.00 0.00 179.25 179.77 2qw4 n ALA 210 N -2.44 0.00 -1.00 0.00 0.00 -1.10 -5.10 120.51 110.87 2qw4 n ALA 210 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2qw4 n ALA 210 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.53 2qw4 n ALA 210 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2qw4 n VAL 211 N -0.32 0.00 -3.88 0.00 0.31 -1.13 -5.13 118.33 108.18 2qw4 n VAL 211 Ca 0.00 0.97 -0.22 0.00 -0.01 0.00 0.00 64.34 65.09 2qw4 n VAL 211 Cb 0.00 -1.49 -0.04 0.00 -0.91 0.00 0.00 33.84 31.39 2qw4 n VAL 211 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2qw4 s SER 219 N -2.96 5.13 0.10 4.52 0.01 -1.26 -5.06 113.70 114.17 2qw4 s SER 219 Ca 0.00 -0.57 -0.22 0.00 1.31 0.00 0.00 55.95 56.47 2qw4 s SER 219 Cb 0.00 -0.90 -0.12 0.00 0.21 0.00 0.00 66.02 65.21 2qw4 s SER 219 CO 0.00 -0.35 1.71 0.00 0.41 0.00 0.00 173.24 175.01 2qw4 h LEU 221 N 0.09 0.39 0.73 0.00 5.85 -1.99 0.77 115.31 121.15 2qw4 h LEU 221 Ca 0.04 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 2qw4 h LEU 221 Cb 0.04 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 2qw4 h LEU 221 CO -0.01 0.05 -0.48 0.28 -0.34 0.00 0.00 178.44 177.94 2qw4 h SER 222 N 0.33 -1.23 -0.82 1.25 0.02 -1.95 0.24 113.55 111.38 2qw4 h SER 222 Ca 0.62 0.07 0.13 0.00 -0.84 0.00 0.00 61.79 61.77 2qw4 h SER 222 Cb 1.68 0.37 -0.06 0.00 0.14 0.00 0.00 62.40 64.53 2qw4 h SER 222 CO -0.29 -0.72 0.54 0.03 -1.14 0.00 0.00 176.83 175.25 2qw4 h ARG 223 N -1.14 0.59 0.02 3.45 3.08 -0.05 0.45 114.38 120.78 2qw4 h ARG 223 Ca -0.09 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 59.83 2qw4 h ARG 223 Cb 0.93 -0.13 0.01 0.00 0.08 0.00 0.00 29.97 30.85 2qw4 h ARG 223 CO 0.07 0.39 -0.36 1.25 -1.07 0.00 0.00 179.97 180.25 2qw4 h LEU 224 N 0.61 0.29 -0.71 3.04 5.85 0.37 -3.25 115.31 121.51 2qw4 h LEU 224 Ca 0.40 -0.82 -0.13 0.00 0.84 0.00 0.00 57.88 58.17 2qw4 h LEU 224 Cb 0.69 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 2qw4 h LEU 224 CO -0.16 1.07 -0.62 -0.07 -0.34 0.00 0.00 178.44 178.32 2qw4 h LEU 225 N -0.47 0.00 -2.11 2.25 3.38 -0.20 -3.13 115.31 115.03 2qw4 h LEU 225 Ca -0.05 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.00 2qw4 h LEU 225 Cb 1.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 2qw4 h LEU 225 CO 0.07 0.62 0.28 1.23 0.09 0.00 0.00 178.44 180.73 2qw4 h GLY 226 N 1.99 0.00 2.00 0.83 0.00 -0.15 0.14 103.07 107.88 2qw4 h GLY 226 Ca -0.01 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.27 2qw4 h GLY 226 CO 0.08 0.00 -0.24 0.50 0.00 0.00 0.00 176.54 176.88 2qw4 h LYS 227 N 0.00 0.00 -0.91 4.80 1.79 -1.57 -3.33 116.57 117.34 2qw4 h LYS 227 Ca 0.14 0.00 0.07 0.00 -2.18 0.00 0.00 60.65 58.67 2qw4 h LYS 227 Cb 0.69 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 31.28 2qw4 h LYS 227 CO -0.00 0.24 0.57 -0.07 -1.08 0.00 0.00 179.45 179.11 2qw4 h LEU 228 N 0.00 0.90 -1.01 2.94 3.38 -0.90 -1.17 115.31 119.45 2qw4 h LEU 228 Ca -0.00 0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.89 2qw4 h LEU 228 Cb 0.45 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2qw4 h LEU 228 CO 0.03 0.57 -0.47 -0.65 0.09 0.00 0.00 178.44 178.02 2qw4 h PRO 229 N 1.03 0.00 -0.60 1.13 0.11 -1.76 -1.97 132.00 129.95 2qw4 h PRO 229 Ca 0.40 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.42 2qw4 h PRO 229 Cb 0.19 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.28 2qw4 h PRO 229 CO -0.18 0.47 0.03 1.49 -0.21 0.00 0.00 178.00 179.60 2qw4 h GLU 230 N 0.00 1.03 -0.05 1.05 4.81 -1.43 -1.48 114.58 118.52 2qw4 h GLU 230 Ca -0.00 -0.31 0.04 0.00 -0.13 0.00 0.00 59.36 58.95 2qw4 h GLU 230 Cb 0.88 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 30.11 2qw4 h GLU 230 CO 0.06 1.00 -0.22 1.25 -0.73 0.00 0.00 179.01 180.37 2qw4 h LEU 231 N 0.93 -0.66 -1.03 1.64 5.85 -1.30 -1.37 115.31 119.36 2qw4 h LEU 231 Ca 0.17 0.10 0.27 0.00 0.84 0.00 0.00 57.88 59.26 2qw4 h LEU 231 Cb 0.51 0.28 -0.13 0.00 0.37 0.00 0.00 40.66 41.70 2qw4 h LEU 231 CO 0.02 -0.28 0.60 -0.09 -0.34 0.00 0.00 178.44 178.35 2qw4 h ARG 232 N -0.32 0.48 -0.00 1.25 9.65 -1.01 -0.79 114.38 123.63 2qw4 h ARG 232 Ca 0.07 -0.03 -0.14 0.00 -1.10 0.00 0.00 59.98 58.78 2qw4 h ARG 232 Cb 0.43 -0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 28.88 2qw4 h ARG 232 CO -0.23 0.32 -0.67 1.15 2.80 0.00 0.00 179.97 183.33 2qw4 h THR 233 N 0.50 1.48 -0.74 0.20 2.02 -0.47 -3.18 112.91 112.72 2qw4 h THR 233 Ca 0.67 -2.30 0.01 0.00 0.77 0.00 0.00 66.41 65.56 2qw4 h THR 233 Cb 1.38 2.24 -0.04 0.00 -1.74 0.00 0.00 68.15 69.99 2qw4 h THR 233 CO -0.50 0.66 0.49 -0.07 0.37 0.00 0.00 175.52 176.47 2qw4 h LEU 234 N 0.01 0.85 -1.70 2.58 -0.00 -0.09 -2.98 115.31 113.97 2qw4 h LEU 234 Ca -0.01 -0.02 -0.02 0.00 -0.00 0.00 0.00 57.88 57.83 2qw4 h LEU 234 Cb 1.19 -0.21 -0.01 0.00 -0.00 0.00 0.00 40.66 41.63 2qw4 h LEU 234 CO 0.09 0.61 -0.04 0.00 -0.00 0.00 0.00 178.44 179.10 2qw4 h THR 236 N 0.14 1.21 -0.78 0.00 2.02 -1.65 -0.13 112.91 113.72 2qw4 h THR 236 Ca 0.03 -0.66 0.18 0.00 0.77 0.00 0.00 66.41 66.73 2qw4 h THR 236 Cb 0.16 1.44 -0.13 0.00 -1.74 0.00 0.00 68.15 67.89 2qw4 h THR 236 CO 0.01 0.19 0.13 1.56 0.37 0.00 0.00 175.52 177.78 2qw4 h GLN 237 N -0.04 0.19 0.12 6.66 4.20 -1.50 0.14 115.11 124.88 2qw4 h GLN 237 Ca 0.03 -0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.75 2qw4 h GLN 237 Cb 0.28 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 27.97 2qw4 h GLN 237 CO 0.00 0.13 -0.44 0.78 -0.67 0.00 0.00 178.83 178.63 2qw4 h GLY 238 N 0.20 -0.89 0.01 3.46 0.00 -0.78 0.02 103.07 105.08 2qw4 h GLY 238 Ca 0.45 0.52 0.09 0.00 0.00 0.00 0.00 47.33 48.40 2qw4 h GLY 238 CO -0.60 -0.27 -0.15 1.41 0.00 0.00 0.00 176.54 176.93 2qw4 h LEU 239 N -0.67 -0.53 -2.01 3.11 3.38 0.02 0.39 115.31 118.99 2qw4 h LEU 239 Ca 0.02 0.15 0.16 0.00 0.09 0.00 0.00 57.88 58.30 2qw4 h LEU 239 Cb 0.69 0.33 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 2qw4 h LEU 239 CO -0.25 -0.19 0.44 1.56 0.09 0.00 0.00 178.44 180.10 2qw4 h GLN 240 N -0.04 0.00 0.13 1.13 4.20 -0.48 0.12 115.11 120.17 2qw4 h GLN 240 Ca 0.22 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.62 2qw4 h GLN 240 Cb 0.38 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.16 2qw4 h GLN 240 CO -0.50 0.00 -1.60 -0.09 -0.67 0.00 0.00 178.83 175.97 2qw4 h ARG 241 N 0.00 0.28 -0.67 1.46 9.65 0.16 -2.98 114.38 122.28 2qw4 h ARG 241 Ca 0.26 -0.48 -0.02 0.00 -1.10 0.00 0.00 59.98 58.65 2qw4 h ARG 241 Cb 1.14 0.18 -0.03 0.00 -1.39 0.00 0.00 29.97 29.87 2qw4 h ARG 241 CO -0.00 1.15 0.34 0.82 2.80 0.00 0.00 179.97 185.08 2qw4 h ILE 242 N 0.08 1.22 0.65 1.20 5.03 -0.39 -2.74 117.51 122.56 2qw4 h ILE 242 Ca -0.27 -0.58 -0.02 0.00 -0.12 0.00 0.00 64.86 63.87 2qw4 h ILE 242 Cb 2.04 0.37 -0.01 0.00 -3.03 0.00 0.00 36.82 36.19 2qw4 h ILE 242 CO 0.16 0.24 -0.49 0.15 -0.68 0.00 0.00 178.15 177.53 2qw4 h PHE 243 N 0.92 -1.34 -0.98 1.37 3.57 -0.86 -1.06 116.94 118.56 2qw4 h PHE 243 Ca 0.23 -0.00 0.28 0.00 3.53 0.00 0.00 57.97 62.01 2qw4 h PHE 243 Cb 0.08 0.50 -0.14 0.00 2.79 0.00 0.00 35.95 39.18 2qw4 h PHE 243 CO -0.00 -0.70 0.53 -0.92 -2.23 0.00 0.00 178.31 174.99 2qw4 h TYR 244 N -1.10 0.87 -0.32 0.41 3.20 -1.60 -0.98 116.97 117.45 2qw4 h TYR 244 Ca -0.08 0.04 -0.09 0.00 3.14 0.00 0.00 58.73 61.73 2qw4 h TYR 244 Cb 0.91 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.95 2qw4 h TYR 244 CO -0.18 -0.10 -0.16 -0.07 -1.64 0.00 0.00 178.16 176.02 2qw4 h LEU 245 N 0.39 0.69 -1.99 2.82 3.38 -1.06 -2.64 115.31 116.91 2qw4 h LEU 245 Ca 0.67 -0.41 -0.00 0.00 0.09 0.00 0.00 57.88 58.23 2qw4 h LEU 245 Cb 1.43 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.99 2qw4 h LEU 245 CO -0.57 0.94 -0.01 0.11 0.09 0.00 0.00 178.44 179.01 2qw4 h LYS 246 N 0.43 0.00 0.00 1.13 1.57 0.02 0.31 116.57 120.03 2qw4 h LYS 246 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2qw4 h LYS 246 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.00 2qw4 h LYS 246 CO 0.05 0.01 0.00 -0.07 -0.57 0.00 0.00 179.45 178.87 2qw4 h LEU 247 N 0.00 0.00 0.00 2.94 3.38 -0.89 -2.87 115.31 117.87 2qw4 h LEU 247 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2qw4 h LEU 247 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2qw4 h LEU 247 CO 0.00 0.00 -1.58 -0.62 0.09 0.00 0.00 178.44 176.33 2qw4 n GLU 248 N -2.61 0.63 0.00 1.13 -0.58 0.06 -4.98 120.64 114.28 2qw4 n GLU 248 Ca 0.02 -0.07 0.00 0.00 -0.42 0.00 0.00 57.16 56.69 2qw4 n GLU 248 Cb 0.30 -1.64 0.00 0.00 -0.57 0.00 0.00 31.44 29.53 2qw4 n GLU 248 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2qw4 n ASP 249 N -2.41 0.00 0.00 1.62 2.03 -0.94 -4.88 116.55 111.96 2qw4 n ASP 249 Ca -0.02 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.29 2qw4 n ASP 249 Cb 0.56 -0.01 0.00 0.00 -0.72 0.00 0.00 41.12 40.95 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 0.00 0.00 -4.26 -2.67 4.77 -1.26 -3.47 117.00 110.11 2qw4 n LEU 250 Ca 0.00 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.66 2qw4 n LEU 250 Cb 0.00 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 40.93 2qw4 n LEU 250 CO 0.00 0.00 -0.55 0.68 -1.33 0.00 0.00 177.39 176.19 2qw4 s VAL 251 N -1.41 2.20 0.46 4.08 -7.23 -1.26 -4.98 120.40 112.25 2qw4 s VAL 251 Ca 0.00 -0.99 -0.25 0.00 -1.81 0.00 0.00 61.98 58.93 2qw4 s VAL 251 Cb 0.00 -1.83 -0.08 0.00 0.56 0.00 0.00 36.38 35.03 2qw4 s VAL 251 CO 0.00 0.56 1.43 -2.84 -0.31 0.00 0.00 175.10 173.94 2qw4 s PRO 252 N 0.12 3.66 0.70 4.82 0.02 -1.23 -4.97 135.00 138.12 2qw4 s PRO 252 Ca -0.11 2.43 -0.12 0.00 0.02 0.00 0.00 61.00 63.21 2qw4 s PRO 252 Cb -0.16 -2.64 0.02 0.00 0.02 0.00 0.00 34.50 31.74 2qw4 s PRO 252 CO 0.06 -0.84 1.07 -1.25 -0.33 0.00 0.00 177.00 175.71 2qw4 s PRO 253 N -2.47 2.78 0.51 5.54 0.04 -1.26 -4.99 135.00 135.14 2qw4 s PRO 253 Ca 0.61 1.10 -0.23 0.00 0.04 0.00 0.00 61.00 62.52 2qw4 s PRO 253 Cb -0.44 -1.96 -0.06 0.00 0.04 0.00 0.00 34.50 32.08 2qw4 s PRO 253 CO 0.56 -1.23 1.32 -2.14 0.04 0.00 0.00 177.00 175.55 2qw4 s PRO 254 N -4.77 3.40 0.54 0.56 0.02 -1.26 -4.87 135.00 128.63 2qw4 s PRO 254 Ca 0.61 2.15 0.23 0.00 0.02 0.00 0.00 61.00 64.00 2qw4 s PRO 254 Cb -0.16 -2.37 1.44 0.00 0.02 0.00 0.00 34.50 33.43 2qw4 s PRO 254 CO 0.51 -0.95 2.08 -1.00 -0.33 0.00 0.00 177.00 177.31 2qw4 h PRO 255 N 1.78 0.00 0.41 5.54 0.13 -1.99 -0.18 132.00 137.69 2qw4 h PRO 255 Ca -0.50 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.61 2qw4 h PRO 255 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2qw4 h PRO 255 CO 0.59 0.00 -0.20 -0.84 -0.23 0.00 0.00 178.00 177.32 2qw4 h ILE 256 N 0.00 0.55 0.00 -3.56 3.07 -2.01 -2.99 117.51 112.57 2qw4 h ILE 256 Ca 0.12 -0.41 -0.11 0.00 1.55 0.00 0.00 64.86 66.01 2qw4 h ILE 256 Cb 0.52 0.74 -0.02 0.00 -0.27 0.00 0.00 36.82 37.79 2qw4 h ILE 256 CO -0.00 0.07 -0.53 0.40 -1.05 0.00 0.00 178.15 177.04 2qw4 h ILE 257 N -0.81 1.32 -0.51 0.16 1.08 -1.89 -3.13 117.51 113.74 2qw4 h ILE 257 Ca -0.06 -1.86 -0.11 0.00 -0.39 0.00 0.00 64.86 62.44 2qw4 h ILE 257 Cb 0.54 2.02 -0.02 0.00 -3.07 0.00 0.00 36.82 36.30 2qw4 h ILE 257 CO 0.09 0.52 -0.11 -0.78 -0.69 0.00 0.00 178.15 177.18 2qw4 h ASP 258 N 0.00 0.97 -0.52 1.72 3.58 -1.05 -1.34 116.42 119.78 2qw4 h ASP 258 Ca -0.01 -0.36 -0.02 0.00 0.42 0.00 0.00 57.03 57.07 2qw4 h ASP 258 Cb 0.98 -0.27 -0.03 0.00 1.72 0.00 0.00 39.33 41.74 2qw4 h ASP 258 CO 0.07 1.11 0.28 0.50 -2.88 0.00 0.00 179.24 178.31 2qw4 h LYS 259 N 0.83 0.77 0.05 0.28 3.64 -1.46 0.17 116.57 120.85 2qw4 h LYS 259 Ca 0.13 -0.09 -0.27 0.00 -1.27 0.00 0.00 60.65 59.16 2qw4 h LYS 259 Cb 0.67 -0.15 0.02 0.00 -0.41 0.00 0.00 32.23 32.37 2qw4 h LYS 259 CO 0.05 0.59 -1.07 0.82 -2.27 0.00 0.00 179.45 177.56 2qw4 h ILE 260 N 0.77 1.30 -0.14 2.00 2.04 -1.58 -2.94 117.51 118.96 2qw4 h ILE 260 Ca 0.20 -2.31 0.05 0.00 1.00 0.00 0.00 64.86 63.79 2qw4 h ILE 260 Cb 0.06 2.54 -0.06 0.00 -0.74 0.00 0.00 36.82 38.61 2qw4 h ILE 260 CO -0.03 0.71 -0.30 0.15 0.00 0.00 0.00 178.15 178.68 2qw4 h PHE 261 N 0.29 -0.81 -0.01 1.37 3.57 -0.99 -2.67 116.94 117.68 2qw4 h PHE 261 Ca -0.15 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.39 2qw4 h PHE 261 Cb 1.74 0.38 -0.00 0.00 2.79 0.00 0.00 35.95 40.86 2qw4 h PHE 261 CO 0.11 -0.38 0.15 0.52 -2.23 0.00 0.00 178.31 176.49 2qw4 h MET 262 N -0.36 0.00 -5.30 1.11 2.86 -0.59 -3.35 114.93 109.29 2qw4 h MET 262 Ca 0.10 0.00 -0.64 0.00 -2.06 0.00 0.00 59.70 57.10 2qw4 h MET 262 Cb 0.52 0.00 -0.15 0.00 0.06 0.00 0.00 31.60 32.03 2qw4 h MET 262 CO -0.35 0.00 0.49 -0.51 1.06 0.00 0.00 176.91 177.60 2qw4 s ASP 263 N -4.90 6.20 -0.14 1.22 1.01 -1.01 -4.94 116.67 114.11 2qw4 s ASP 263 Ca -0.04 -1.12 -0.30 0.00 0.71 0.00 0.00 52.55 51.80 2qw4 s ASP 263 Cb 0.11 -2.40 0.13 0.00 1.01 0.00 0.00 42.92 41.77 2qw4 s ASP 263 CO 0.36 -1.37 1.02 0.42 0.21 0.00 0.00 175.17 175.81 2qw4 s THR 264 N 3.78 0.00 -1.90 -1.27 -4.23 -1.26 -4.97 115.64 105.79 2qw4 s THR 264 Ca 0.21 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.72 2qw4 s THR 264 Cb -0.17 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.67 2qw4 s THR 264 CO 0.08 0.00 0.47 0.00 -0.54 0.00 0.00 174.62 174.64