#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 0.60 -0.21 -4.53 5.85 -1.99 -3.01 115.31 112.02 2qw4 h LEU 33 Ca 0.00 -0.94 0.04 0.00 0.84 0.00 0.00 57.88 57.82 2qw4 h LEU 33 Cb 0.00 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 40.80 2qw4 h LEU 33 CO 0.00 1.51 -0.02 0.25 -0.34 0.00 0.00 178.44 179.84 2qw4 h LEU 34 N -0.19 -0.13 -0.32 2.25 5.85 -1.96 0.35 115.31 121.16 2qw4 h LEU 34 Ca -0.19 0.05 0.07 0.00 0.84 0.00 0.00 57.88 58.66 2qw4 h LEU 34 Cb 1.83 0.10 -0.08 0.00 0.37 0.00 0.00 40.66 42.89 2qw4 h LEU 34 CO 0.19 -0.04 -0.25 0.74 -0.34 0.00 0.00 178.44 178.75 2qw4 h THR 35 N 0.04 0.36 -0.63 1.05 2.02 -2.00 0.84 112.91 114.59 2qw4 h THR 35 Ca 0.10 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.30 2qw4 h THR 35 Cb 0.14 0.36 -0.03 0.00 -1.74 0.00 0.00 68.15 66.88 2qw4 h THR 35 CO -0.19 0.00 0.41 0.28 0.37 0.00 0.00 175.52 176.40 2qw4 h SER 36 N -0.21 0.67 -0.33 4.18 0.02 -1.24 0.10 113.55 116.74 2qw4 h SER 36 Ca 0.16 -0.01 -0.11 0.00 -0.84 0.00 0.00 61.79 60.99 2qw4 h SER 36 Cb 0.47 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.84 2qw4 h SER 36 CO -0.44 0.47 -0.24 -0.07 -1.14 0.00 0.00 176.83 175.41 2qw4 h LEU 37 N 0.78 0.77 -0.23 5.07 3.38 0.18 -1.25 115.31 124.01 2qw4 h LEU 37 Ca 0.24 -0.44 0.03 0.00 0.09 0.00 0.00 57.88 57.81 2qw4 h LEU 37 Cb 0.02 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 2qw4 h LEU 37 CO -0.06 1.05 0.03 0.58 0.09 0.00 0.00 178.44 180.13 2qw4 h VAL 38 N 0.51 0.88 -0.96 1.22 2.07 -0.29 -1.59 116.25 118.08 2qw4 h VAL 38 Ca 0.06 -0.04 0.07 0.00 0.82 0.00 0.00 66.70 67.61 2qw4 h VAL 38 Cb 0.79 0.75 -0.06 0.00 -1.52 0.00 0.00 31.29 31.25 2qw4 h VAL 38 CO 0.06 0.02 0.62 0.03 0.02 0.00 0.00 177.57 178.32 2qw4 h ARG 39 N 0.11 1.06 -0.21 1.57 -0.00 -0.65 -1.58 114.38 114.69 2qw4 h ARG 39 Ca 0.10 -0.06 -0.13 0.00 -0.50 0.00 0.00 59.98 59.39 2qw4 h ARG 39 Cb 0.11 -0.24 0.00 0.00 0.00 0.00 0.00 29.97 29.84 2qw4 h ARG 39 CO -0.15 0.70 -0.37 0.00 0.00 0.00 0.00 179.97 180.15 2qw4 h ALA 40 N 1.49 0.33 -0.74 0.04 0.00 -0.94 -1.41 119.26 118.03 2qw4 h ALA 40 Ca 0.42 -0.44 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 2qw4 h ALA 40 Cb 0.21 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2qw4 h ALA 40 CO -0.17 0.41 0.21 1.25 0.00 0.00 0.00 179.25 180.95 2qw4 h HIS 41 N 0.31 1.21 0.02 0.00 -0.00 -0.79 -2.89 115.15 113.00 2qw4 h HIS 41 Ca 0.01 -0.13 -0.00 0.00 -0.00 0.00 0.00 60.37 60.25 2qw4 h HIS 41 Cb 0.97 -0.35 0.00 0.00 -0.00 0.00 0.00 27.41 28.03 2qw4 h HIS 41 CO 0.09 0.96 -0.01 -0.07 -0.00 0.00 0.00 177.93 178.90 2qw4 h LEU 42 N 1.10 -0.02 -0.67 0.26 3.38 -1.29 -2.26 115.31 115.82 2qw4 h LEU 42 Ca 0.23 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2qw4 h LEU 42 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2qw4 h LEU 42 CO -0.00 0.51 0.58 0.44 0.09 0.00 0.00 178.44 180.06 2qw4 h ASP 43 N -1.00 0.00 0.00 -0.43 3.32 -1.37 -1.36 116.42 115.57 2qw4 h ASP 43 Ca -0.00 0.00 -0.42 0.00 0.02 0.00 0.00 57.03 56.63 2qw4 h ASP 43 Cb 0.09 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.58 2qw4 h ASP 43 CO 0.00 0.00 -2.28 -1.54 -1.72 0.00 0.00 179.24 173.70 2qw4 n SER 44 N -2.22 1.94 -4.77 6.45 3.41 -1.09 -5.00 113.62 112.34 2qw4 n SER 44 Ca -0.01 0.36 -0.33 0.00 -0.26 0.00 0.00 58.87 58.63 2qw4 n SER 44 Cb 0.59 -0.85 0.04 0.00 -0.26 0.00 0.00 64.21 63.74 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 -5.37 2.22 -0.42 5.00 0.00 -0.51 -4.79 107.32 103.45 2qw4 s GLY 45 Ca -0.37 0.60 -0.27 0.00 0.00 0.00 0.00 44.72 44.68 2qw4 s GLY 45 CO 0.51 0.95 2.01 -4.14 0.00 0.00 0.00 173.10 172.44 2qw4 s PRO 46 N -3.99 2.85 0.64 2.90 0.02 -1.26 -4.91 135.00 131.25 2qw4 s PRO 46 Ca 0.68 1.30 -0.17 0.00 0.02 0.00 0.00 61.00 62.84 2qw4 s PRO 46 Cb -0.21 -4.36 -0.01 0.00 0.02 0.00 0.00 34.50 29.94 2qw4 s PRO 46 CO 0.40 -2.44 1.16 -1.54 -0.33 0.00 0.00 177.00 174.26 2qw4 s SER 47 N 8.30 4.99 0.60 2.53 1.04 -1.26 -4.82 113.70 125.08 2qw4 s SER 47 Ca 0.84 2.23 0.31 0.00 0.48 0.00 0.00 55.95 59.80 2qw4 s SER 47 Cb -0.20 -2.58 1.88 0.00 0.10 0.00 0.00 66.02 65.22 2qw4 s SER 47 CO 0.29 -1.72 2.26 0.71 0.98 0.00 0.00 173.24 175.77 2qw4 h THR 48 N 0.37 0.47 0.00 2.02 1.35 -2.00 -2.32 112.91 112.80 2qw4 h THR 48 Ca -0.49 -0.02 0.00 0.00 -0.55 0.00 0.00 66.41 65.36 2qw4 h THR 48 Cb 1.28 1.01 0.00 0.00 -1.73 0.00 0.00 68.15 68.71 2qw4 h THR 48 CO 0.54 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.81 2qw4 n ALA 49 N -2.30 -0.09 -3.45 6.62 0.00 -1.26 -3.68 120.51 116.36 2qw4 n ALA 49 Ca -0.03 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.10 2qw4 n ALA 49 Cb 0.08 0.32 -0.07 0.00 0.00 0.00 0.00 19.45 19.78 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 -2.18 2.76 -0.92 0.00 4.76 -0.88 -4.98 118.16 116.71 2qw4 n LYS 50 Ca 0.00 -4.62 -0.29 0.00 -2.87 0.00 0.00 58.31 50.54 2qw4 n LYS 50 Cb 0.00 -2.32 0.22 0.00 -1.84 0.00 0.00 35.03 31.09 2qw4 n LYS 50 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2qw4 s LEU 51 N -2.28 0.94 -0.24 -0.35 1.43 -1.19 -4.76 118.68 112.22 2qw4 s LEU 51 Ca 0.35 1.11 -0.04 0.00 -1.03 0.00 0.00 54.13 54.53 2qw4 s LEU 51 Cb 0.08 -3.06 0.10 0.00 0.03 0.00 0.00 46.19 43.34 2qw4 s LEU 51 CO -0.03 -3.83 0.18 -0.62 0.23 0.00 0.00 176.35 172.28 2qw4 s ASP 52 N -3.27 2.34 0.00 2.29 3.68 -0.38 -4.96 116.67 116.37 2qw4 s ASP 52 Ca 0.68 -0.75 0.25 0.00 2.13 0.00 0.00 52.55 54.85 2qw4 s ASP 52 Cb -0.18 0.03 0.50 0.00 -1.45 0.00 0.00 42.92 41.82 2qw4 s ASP 52 CO 0.59 -0.38 1.41 -1.22 0.13 0.00 0.00 175.17 175.70 2qw4 n TYR 53 N 5.29 0.00 0.14 -5.34 4.02 -1.26 -2.44 117.16 117.57 2qw4 n TYR 53 Ca -0.05 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 57.87 2qw4 n TYR 53 Cb 0.46 -0.11 0.20 0.00 -0.02 0.00 0.00 39.34 39.88 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 -0.67 0.19 -0.00 7.72 3.41 -1.26 -0.03 113.62 122.98 2qw4 n SER 54 Ca 0.10 0.41 0.02 0.00 -0.26 0.00 0.00 58.87 59.14 2qw4 n SER 54 Cb 0.37 -0.32 -0.02 0.00 -0.26 0.00 0.00 64.21 63.98 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 -1.83 5.34 -0.68 4.33 5.02 -1.26 -5.07 118.16 124.01 2qw4 n LYS 55 Ca -0.00 -0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.97 2qw4 n LYS 55 Cb 0.44 -0.71 0.17 0.00 -0.02 0.00 0.00 35.03 34.91 2qw4 n LYS 55 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2qw4 n PHE 56 N -1.13 0.63 -3.23 2.13 7.35 0.95 -4.95 117.46 119.21 2qw4 n PHE 56 Ca 0.01 0.38 -0.03 0.00 -0.76 0.00 0.00 57.45 57.04 2qw4 n PHE 56 Cb 0.06 -1.98 -0.03 0.00 0.35 0.00 0.00 39.48 37.88 2qw4 n PHE 56 CO 0.00 0.00 0.00 -1.14 -0.76 0.00 0.00 176.76 174.86 2qw4 s GLN 57 N -4.55 0.48 -0.32 -4.13 2.00 -1.26 -5.03 119.66 106.84 2qw4 s GLN 57 Ca 0.66 0.38 -0.27 0.00 -2.00 0.00 0.00 55.36 54.13 2qw4 s GLN 57 Cb -0.23 -0.03 -0.06 0.00 0.80 0.00 0.00 33.01 33.49 2qw4 s GLN 57 CO 0.59 -0.99 2.30 -1.91 -0.50 0.00 0.00 175.29 174.78 2qw4 n GLU 58 N 5.39 1.60 -4.54 1.67 4.07 -1.26 -4.61 120.64 122.96 2qw4 n GLU 58 Ca 0.02 0.32 -0.34 0.00 -0.06 0.00 0.00 57.16 57.10 2qw4 n GLU 58 Cb 0.51 -3.32 -0.11 0.00 -0.06 0.00 0.00 31.44 28.46 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 9.88 3.29 -0.25 4.31 1.43 -1.26 -5.01 118.68 131.06 2qw4 s LEU 59 Ca 1.00 0.02 0.02 0.00 -1.03 0.00 0.00 54.13 54.14 2qw4 s LEU 59 Cb -0.27 -1.73 -0.18 0.00 0.03 0.00 0.00 46.19 44.04 2qw4 s LEU 59 CO 0.32 0.35 -0.19 0.52 0.23 0.00 0.00 176.35 177.58 2qw4 n VAL 60 N 2.31 1.50 -4.73 -1.59 0.31 -1.26 -4.99 118.33 109.88 2qw4 n VAL 60 Ca -0.18 -0.59 -0.30 0.00 -0.01 0.00 0.00 64.34 63.26 2qw4 n VAL 60 Cb 0.53 -1.39 -0.13 0.00 -0.91 0.00 0.00 33.84 31.94 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 -6.49 2.42 1.00 7.52 1.43 -1.26 -5.14 118.68 118.16 2qw4 s LEU 61 Ca -0.33 -0.51 -0.13 0.00 -1.03 0.00 0.00 54.13 52.12 2qw4 s LEU 61 Cb 0.09 -1.41 0.19 0.00 0.03 0.00 0.00 46.19 45.08 2qw4 s LEU 61 CO 0.62 0.25 1.11 -2.84 0.23 0.00 0.00 176.35 175.72 2qw4 s PRO 62 N -1.42 0.44 0.00 1.29 0.02 -1.26 -5.05 135.00 129.03 2qw4 s PRO 62 Ca 0.13 0.35 0.00 0.00 0.02 0.00 0.00 61.00 61.50 2qw4 s PRO 62 Cb -0.10 -1.75 0.00 0.00 0.02 0.00 0.00 34.50 32.66 2qw4 s PRO 62 CO 0.04 -2.68 0.00 0.72 -0.33 0.00 0.00 177.00 174.75 2qw4 n HIS 63 N -4.11 -1.10 -3.47 6.54 8.25 -1.26 -5.15 115.22 114.91 2qw4 n HIS 63 Ca 0.06 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.38 2qw4 n HIS 63 Cb 0.58 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.65 2qw4 n HIS 63 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 2qw4 s PHE 64 N 1.46 -0.58 0.17 4.41 -0.12 -1.26 -5.13 117.98 116.93 2qw4 s PHE 64 Ca 0.00 0.65 0.00 0.00 -0.05 0.00 0.00 56.93 57.53 2qw4 s PHE 64 Cb 0.00 0.48 0.00 0.00 -0.63 0.00 0.00 43.02 42.87 2qw4 s PHE 64 CO 0.00 -0.74 0.00 0.41 -0.05 0.00 0.00 175.22 174.84 2qw4 n GLY 65 N 0.19 -2.84 3.36 1.99 0.00 -1.26 -4.92 105.19 101.71 2qw4 n GLY 65 Ca -0.18 -1.34 -0.31 0.00 0.00 0.00 0.00 46.02 44.19 2qw4 n GLY 65 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qw4 n LYS 66 N -2.59 -1.59 -1.32 1.61 4.76 -1.26 -4.95 118.16 112.82 2qw4 n LYS 66 Ca -0.02 -0.44 -0.36 0.00 -2.87 0.00 0.00 58.31 54.61 2qw4 n LYS 66 Cb 0.18 -1.86 0.07 0.00 -1.84 0.00 0.00 35.03 31.57 2qw4 n LYS 66 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2qw4 n GLU 67 N -2.82 0.40 -2.16 1.97 4.71 -1.26 -5.07 120.64 116.41 2qw4 n GLU 67 Ca 0.03 0.18 -0.10 0.00 -0.01 0.00 0.00 57.16 57.25 2qw4 n GLU 67 Cb 0.59 -1.90 0.01 0.00 -1.01 0.00 0.00 31.44 29.13 2qw4 n GLU 67 CO 0.00 0.00 0.00 -0.40 0.09 0.00 0.00 177.13 176.82 2qw4 n ASP 68 N -0.46 1.31 -0.34 1.62 3.85 -1.26 -5.04 116.55 116.22 2qw4 n ASP 68 Ca 0.11 -1.73 -0.03 0.00 -0.71 0.00 0.00 54.79 52.43 2qw4 n ASP 68 Cb 0.49 -0.10 0.09 0.00 -1.35 0.00 0.00 41.12 40.26 2qw4 n ASP 68 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2qw4 h ALA 69 N 0.52 1.17 0.02 2.12 0.00 -2.00 -3.01 119.26 118.09 2qw4 h ALA 69 Ca -0.13 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 2qw4 h ALA 69 Cb 0.53 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2qw4 h ALA 69 CO 0.20 0.60 -0.01 0.78 0.00 0.00 0.00 179.25 180.82 2qw4 h GLY 70 N 1.26 -0.02 -0.40 0.00 0.00 -1.98 0.45 103.07 102.37 2qw4 h GLY 70 Ca 0.33 0.01 0.30 0.00 0.00 0.00 0.00 47.33 47.98 2qw4 h GLY 70 CO -0.07 -0.01 0.65 -0.55 0.00 0.00 0.00 176.54 176.57 2qw4 h ASP 71 N -0.06 0.49 0.44 0.19 3.32 -1.91 0.21 116.42 119.10 2qw4 h ASP 71 Ca -0.00 0.13 -0.31 0.00 0.02 0.00 0.00 57.03 56.88 2qw4 h ASP 71 Cb 0.05 0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 2qw4 h ASP 71 CO 0.00 -0.02 -1.55 0.58 -1.72 0.00 0.00 179.24 176.53 2qw4 h VAL 72 N 0.37 1.12 -0.72 -1.35 2.07 -1.36 -2.82 116.25 113.56 2qw4 h VAL 72 Ca 0.68 -2.77 -0.07 0.00 0.82 0.00 0.00 66.70 65.36 2qw4 h VAL 72 Cb 1.66 2.73 -0.03 0.00 -1.52 0.00 0.00 31.29 34.14 2qw4 h VAL 72 CO -0.44 0.81 0.18 -0.61 0.02 0.00 0.00 177.57 177.52 2qw4 h GLN 73 N 0.06 1.15 -0.37 1.57 5.75 0.41 -1.33 115.11 122.37 2qw4 h GLN 73 Ca -0.25 -0.27 -0.13 0.00 -0.15 0.00 0.00 58.65 57.85 2qw4 h GLN 73 Cb 2.01 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 30.40 2qw4 h GLN 73 CO 0.15 1.01 -0.28 0.37 -2.65 0.00 0.00 178.83 177.43 2qw4 h GLN 74 N 1.09 0.77 0.41 1.69 4.15 -0.77 0.31 115.11 122.77 2qw4 h GLN 74 Ca 0.23 -0.34 -0.01 0.00 0.77 0.00 0.00 58.65 59.30 2qw4 h GLN 74 Cb 0.37 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.02 2qw4 h GLN 74 CO 0.00 0.96 -0.40 0.35 -1.93 0.00 0.00 178.83 177.81 2qw4 h PHE 75 N 0.66 -1.10 -0.34 3.99 3.57 -1.12 0.16 116.94 122.75 2qw4 h PHE 75 Ca 0.08 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.59 2qw4 h PHE 75 Cb 0.81 0.43 -0.02 0.00 2.79 0.00 0.00 35.95 39.96 2qw4 h PHE 75 CO 0.04 -0.56 0.23 1.88 -2.23 0.00 0.00 178.31 177.67 2qw4 h TYR 76 N -0.83 0.43 -0.01 0.41 0.05 -1.23 -2.59 116.97 113.20 2qw4 h TYR 76 Ca -0.04 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.76 2qw4 h TYR 76 Cb 0.74 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 38.32 2qw4 h TYR 76 CO -0.22 0.28 -0.10 -0.44 -1.05 0.00 0.00 178.16 176.63 2qw4 h ASP 77 N 0.46 -0.32 -0.67 3.88 5.19 0.18 0.69 116.42 125.82 2qw4 h ASP 77 Ca 0.13 0.04 0.09 0.00 -0.62 0.00 0.00 57.03 56.67 2qw4 h ASP 77 Cb -0.05 0.12 -0.10 0.00 0.18 0.00 0.00 39.33 39.48 2qw4 h ASP 77 CO -0.03 -0.10 -0.29 0.18 -3.12 0.00 0.00 179.24 175.89 2qw4 n LEU 78 N -3.09 -0.49 -0.07 1.55 7.99 0.51 0.41 117.00 123.81 2qw4 n LEU 78 Ca -0.01 1.18 -0.10 0.00 -0.01 0.00 0.00 56.01 57.06 2qw4 n LEU 78 Cb 0.07 -0.25 -0.03 0.00 -0.11 0.00 0.00 43.42 43.10 2qw4 n LEU 78 CO 0.02 -1.04 0.91 -0.07 -1.51 0.00 0.00 177.39 175.70 2qw4 h LEU 79 N 0.00 0.31 -1.04 2.23 4.07 -0.86 -1.06 115.31 118.96 2qw4 h LEU 79 Ca 0.21 -0.11 0.11 0.00 0.08 0.00 0.00 57.88 58.17 2qw4 h LEU 79 Cb 0.38 -0.08 -0.08 0.00 1.08 0.00 0.00 40.66 41.96 2qw4 h LEU 79 CO -0.66 0.33 0.63 -1.28 -1.08 0.00 0.00 178.44 176.38 2qw4 h SER 80 N 0.26 0.92 0.68 -0.43 0.87 0.53 -1.61 113.55 114.77 2qw4 h SER 80 Ca 0.08 0.04 -0.25 0.00 -1.23 0.00 0.00 61.79 60.44 2qw4 h SER 80 Cb 0.10 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 61.91 2qw4 h SER 80 CO -0.01 0.50 -1.13 1.23 -0.53 0.00 0.00 176.83 176.89 2qw4 h GLY 81 N 0.99 0.25 1.41 5.77 0.00 -0.78 -3.06 103.07 107.65 2qw4 h GLY 81 Ca 0.48 -0.59 -0.03 0.00 0.00 0.00 0.00 47.33 47.20 2qw4 h GLY 81 CO -0.25 0.51 0.20 1.76 0.00 0.00 0.00 176.54 178.77 2qw4 h SER 82 N 0.07 0.69 -0.53 0.19 0.02 -0.42 -0.80 113.55 112.78 2qw4 h SER 82 Ca -0.09 -0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 60.77 2qw4 h SER 82 Cb 1.84 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 64.18 2qw4 h SER 82 CO 0.18 0.63 0.33 0.25 -1.14 0.00 0.00 176.83 177.07 2qw4 h LEU 83 N 0.75 0.63 -0.90 5.07 5.85 -1.26 0.53 115.31 125.98 2qw4 h LEU 83 Ca 0.18 -0.05 -0.06 0.00 0.84 0.00 0.00 57.88 58.79 2qw4 h LEU 83 Cb 0.16 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 2qw4 h LEU 83 CO -0.02 0.49 0.13 -0.33 -0.34 0.00 0.00 178.44 178.38 2qw4 h GLU 84 N 0.71 0.95 0.26 1.25 4.39 -1.30 0.25 114.58 121.08 2qw4 h GLU 84 Ca 0.19 -0.21 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 2qw4 h GLU 84 Cb -0.03 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.49 2qw4 h GLU 84 CO -0.04 0.85 -0.13 0.28 -1.16 0.00 0.00 179.01 178.82 2qw4 h VAL 85 N 0.90 0.69 -0.71 3.13 2.07 -0.83 -2.35 116.25 119.15 2qw4 h VAL 85 Ca 0.19 -0.82 0.13 0.00 0.82 0.00 0.00 66.70 67.02 2qw4 h VAL 85 Cb 0.34 1.08 -0.09 0.00 -1.52 0.00 0.00 31.29 31.10 2qw4 h VAL 85 CO 0.00 0.15 0.28 0.40 0.02 0.00 0.00 177.57 178.42 2qw4 h ILE 86 N -0.84 0.69 -0.29 4.57 2.04 -0.86 0.43 117.51 123.25 2qw4 h ILE 86 Ca -0.04 -0.15 0.03 0.00 1.00 0.00 0.00 64.86 65.71 2qw4 h ILE 86 Cb 0.51 0.22 -0.05 0.00 -0.74 0.00 0.00 36.82 36.76 2qw4 h ILE 86 CO 0.06 0.08 -0.35 -0.09 0.00 0.00 0.00 178.15 177.85 2qw4 h ARG 87 N 0.44 -0.21 -0.59 2.37 9.65 -0.53 0.91 114.38 126.41 2qw4 h ARG 87 Ca 0.38 0.01 0.12 0.00 -1.10 0.00 0.00 59.98 59.40 2qw4 h ARG 87 Cb 0.54 0.05 -0.03 0.00 -1.39 0.00 0.00 29.97 29.14 2qw4 h ARG 87 CO -0.37 -0.14 0.40 0.87 2.80 0.00 0.00 179.97 183.53 2qw4 h LYS 88 N -0.22 0.28 0.14 0.20 1.57 -0.54 -0.50 116.57 117.50 2qw4 h LYS 88 Ca 0.05 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 2qw4 h LYS 88 Cb 0.35 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.60 2qw4 h LYS 88 CO -0.39 0.18 -0.07 2.35 -0.57 0.00 0.00 179.45 180.96 2qw4 h TRP 89 N 0.29 -0.18 -0.85 -1.35 7.01 -0.42 -3.12 115.95 117.33 2qw4 h TRP 89 Ca 0.28 -0.00 0.07 0.00 2.11 0.00 0.00 58.89 61.35 2qw4 h TRP 89 Cb 0.72 0.06 -0.06 0.00 -2.10 0.00 0.00 29.16 27.78 2qw4 h TRP 89 CO -0.00 0.15 0.55 0.00 -2.79 0.00 0.00 178.44 176.35 2qw4 h ALA 90 N 0.27 1.59 -0.98 2.65 0.00 0.30 0.29 119.26 123.39 2qw4 h ALA 90 Ca -0.02 -0.02 0.33 0.00 0.00 0.00 0.00 54.91 55.20 2qw4 h ALA 90 Cb 0.41 -0.23 -0.17 0.00 0.00 0.00 0.00 17.79 17.79 2qw4 h ALA 90 CO 0.03 0.27 0.29 1.49 0.00 0.00 0.00 179.25 181.33 2qw4 h GLU 91 N 0.92 0.05 -0.65 0.00 4.57 -1.07 -1.76 114.58 116.63 2qw4 h GLU 91 Ca 0.37 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.55 2qw4 h GLU 91 Cb 0.26 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.83 2qw4 h GLU 91 CO -0.14 0.03 0.00 1.63 -1.18 0.00 0.00 179.01 179.36 2qw4 n LYS 92 N -5.34 3.25 -3.44 1.92 5.02 0.09 -4.36 118.16 115.30 2qw4 n LYS 92 Ca 0.29 -2.07 -0.43 0.00 -2.02 0.00 0.00 58.31 54.08 2qw4 n LYS 92 Cb 0.97 -1.84 -0.09 0.00 -0.02 0.00 0.00 35.03 34.04 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 -1.95 5.24 -0.33 -0.18 1.01 -0.66 -4.66 121.20 119.67 2qw4 s ILE 93 Ca 0.36 -0.78 -0.43 0.00 0.00 0.00 0.00 60.65 59.81 2qw4 s ILE 93 Cb 0.25 -3.98 -0.18 0.00 0.01 0.00 0.00 42.46 38.57 2qw4 s ILE 93 CO 0.14 -0.38 1.60 -2.65 0.00 0.00 0.00 174.94 173.65 2qw4 n PRO 94 N 5.17 0.56 0.00 2.79 -0.01 -1.26 0.44 135.00 142.69 2qw4 n PRO 94 Ca -0.11 0.21 0.00 0.00 -0.01 0.00 0.00 63.50 63.58 2qw4 n PRO 94 Cb 0.46 -1.79 0.00 0.00 -0.01 0.00 0.00 33.50 32.16 2qw4 n PRO 94 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 2qw4 n GLY 95 N 3.77 2.30 0.14 -1.23 0.00 -1.26 -4.93 105.19 103.98 2qw4 n GLY 95 Ca 0.27 -0.16 -0.10 0.00 0.00 0.00 0.00 46.02 46.04 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 0.37 0.00 1.61 3.57 -0.31 -1.67 116.94 120.51 2qw4 h PHE 96 Ca 0.00 -0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.41 2qw4 h PHE 96 Cb 0.00 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.61 2qw4 h PHE 96 CO 0.00 0.34 -0.35 0.00 -2.23 0.00 0.00 178.31 176.07 2qw4 h ALA 97 N 0.99 1.13 0.00 2.41 0.00 -1.76 -2.51 119.26 119.53 2qw4 h ALA 97 Ca 0.09 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2qw4 h ALA 97 Cb 0.11 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2qw4 h ALA 97 CO -0.01 0.44 0.00 0.39 0.00 0.00 0.00 179.25 180.07 2qw4 n GLU 98 N -3.71 0.61 -2.78 0.00 1.02 -0.65 -4.78 120.64 110.34 2qw4 n GLU 98 Ca -0.01 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 56.93 2qw4 n GLU 98 Cb 0.45 -1.28 0.03 0.00 -0.02 0.00 0.00 31.44 30.62 2qw4 n GLU 98 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2qw4 s LEU 99 N -1.56 3.39 0.52 -4.62 1.43 -0.95 -5.06 118.68 111.84 2qw4 s LEU 99 Ca 0.16 -0.20 -0.20 0.00 -1.03 0.00 0.00 54.13 52.86 2qw4 s LEU 99 Cb 0.07 -2.71 -0.07 0.00 0.03 0.00 0.00 46.19 43.51 2qw4 s LEU 99 CO 0.13 -1.04 1.11 -0.94 0.23 0.00 0.00 176.35 175.83 2qw4 s SER 100 N -4.42 5.92 0.20 2.29 1.04 -1.26 -4.88 113.70 112.58 2qw4 s SER 100 Ca 0.57 2.12 -0.11 0.00 0.48 0.00 0.00 55.95 59.01 2qw4 s SER 100 Cb -0.10 -2.58 0.20 0.00 0.10 0.00 0.00 66.02 63.64 2qw4 s SER 100 CO 0.37 -1.08 1.79 -0.65 0.98 0.00 0.00 173.24 174.64 2qw4 h PRO 101 N 1.36 0.53 -0.76 4.02 0.11 -1.97 -1.66 132.00 133.64 2qw4 h PRO 101 Ca -0.50 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.53 2qw4 h PRO 101 Cb 1.25 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 2qw4 h PRO 101 CO 0.58 0.35 0.30 0.00 -0.21 0.00 0.00 178.00 179.01 2qw4 h ALA 102 N 1.33 1.09 -0.42 -0.75 0.00 -1.99 -2.20 119.26 116.31 2qw4 h ALA 102 Ca 0.27 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 2qw4 h ALA 102 Cb 0.20 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2qw4 h ALA 102 CO -0.19 0.64 -0.09 -0.44 0.00 0.00 0.00 179.25 179.17 2qw4 h ASP 103 N 1.10 0.72 0.04 0.00 3.32 -1.71 0.90 116.42 120.79 2qw4 h ASP 103 Ca 0.25 -0.20 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 2qw4 h ASP 103 Cb 0.22 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.57 2qw4 h ASP 103 CO -0.02 0.85 -0.02 1.56 -1.72 0.00 0.00 179.24 179.89 2qw4 h GLN 104 N 0.67 -0.05 -0.49 3.56 4.20 -1.13 -1.30 115.11 120.58 2qw4 h GLN 104 Ca 0.12 0.00 0.09 0.00 0.06 0.00 0.00 58.65 58.92 2qw4 h GLN 104 Cb 0.55 0.01 -0.10 0.00 0.30 0.00 0.00 27.48 28.24 2qw4 h GLN 104 CO 0.03 0.21 -0.32 -0.44 -0.67 0.00 0.00 178.83 177.64 2qw4 h ASP 105 N -0.30 -1.07 -0.82 1.46 3.32 -1.08 -1.06 116.42 116.87 2qw4 h ASP 105 Ca -0.01 0.20 0.00 0.00 0.02 0.00 0.00 57.03 57.25 2qw4 h ASP 105 Cb 0.28 0.52 -0.04 0.00 0.22 0.00 0.00 39.33 40.31 2qw4 h ASP 105 CO 0.01 -0.30 0.52 0.25 -1.72 0.00 0.00 179.24 178.00 2qw4 h LEU 106 N -0.20 0.95 -0.32 1.55 5.85 -0.59 0.63 115.31 123.18 2qw4 h LEU 106 Ca 0.20 -0.04 -0.14 0.00 0.84 0.00 0.00 57.88 58.75 2qw4 h LEU 106 Cb 0.53 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.32 2qw4 h LEU 106 CO -0.60 0.70 -0.34 -0.07 -0.34 0.00 0.00 178.44 177.79 2qw4 h LEU 107 N 1.11 0.85 -0.03 2.25 3.38 -0.85 0.14 115.31 122.17 2qw4 h LEU 107 Ca 0.30 -0.48 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 2qw4 h LEU 107 Cb -0.10 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.41 2qw4 h LEU 107 CO -0.06 1.16 -0.02 0.25 0.09 0.00 0.00 178.44 179.86 2qw4 h LEU 108 N 0.57 0.06 -1.35 1.67 5.85 -0.79 0.98 115.31 122.30 2qw4 h LEU 108 Ca 0.05 -0.44 0.04 0.00 0.84 0.00 0.00 57.88 58.37 2qw4 h LEU 108 Cb 0.93 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.90 2qw4 h LEU 108 CO 0.08 0.48 0.47 -0.33 -0.34 0.00 0.00 178.44 178.81 2qw4 h GLU 109 N -0.36 0.81 0.00 1.25 5.08 0.24 0.46 114.58 122.06 2qw4 h GLU 109 Ca 0.01 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2qw4 h GLU 109 Cb 0.46 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2qw4 h GLU 109 CO 0.00 0.54 -0.23 0.43 -1.00 0.00 0.00 179.01 178.75 2qw4 n SER 110 N -4.46 0.80 -0.07 1.42 7.64 0.49 -3.95 113.62 115.48 2qw4 n SER 110 Ca 0.09 0.41 0.01 0.00 1.01 0.00 0.00 58.87 60.40 2qw4 n SER 110 Cb 0.15 -0.45 0.01 0.00 -1.01 0.00 0.00 64.21 62.90 2qw4 n SER 110 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qw4 n ALA 111 N -1.81 2.46 -0.10 -0.43 0.00 0.26 -4.78 120.51 116.11 2qw4 n ALA 111 Ca 0.05 -0.44 -0.07 0.00 0.00 0.00 0.00 53.44 52.98 2qw4 n ALA 111 Cb 0.44 -0.07 -0.00 0.00 0.00 0.00 0.00 19.45 19.81 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 0.36 -0.66 -0.28 0.00 3.57 -1.05 0.53 116.94 119.41 2qw4 h PHE 112 Ca 0.00 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.55 2qw4 h PHE 112 Cb 0.08 0.34 -0.01 0.00 2.79 0.00 0.00 35.95 39.15 2qw4 h PHE 112 CO 0.00 -0.32 0.18 -0.07 -2.23 0.00 0.00 178.31 175.87 2qw4 h LEU 113 N -0.20 0.33 -0.34 0.59 4.07 -1.86 0.60 115.31 118.50 2qw4 h LEU 113 Ca 0.17 -0.03 0.07 0.00 0.08 0.00 0.00 57.88 58.18 2qw4 h LEU 113 Cb 0.47 -0.08 -0.07 0.00 1.08 0.00 0.00 40.66 42.06 2qw4 h LEU 113 CO -0.47 0.26 -0.12 -0.33 -1.08 0.00 0.00 178.44 176.70 2qw4 h GLU 114 N 0.37 -0.05 -0.07 1.13 5.08 -1.84 -1.28 114.58 117.92 2qw4 h GLU 114 Ca 0.10 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 2qw4 h GLU 114 Cb -0.02 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 2qw4 h GLU 114 CO -0.02 -0.04 -0.01 -0.07 -1.00 0.00 0.00 179.01 177.87 2qw4 h LEU 115 N -0.05 0.13 -0.69 1.33 3.38 -0.06 -0.02 115.31 119.33 2qw4 h LEU 115 Ca 0.17 -0.35 0.10 0.00 0.09 0.00 0.00 57.88 57.89 2qw4 h LEU 115 Cb 0.31 -0.04 -0.12 0.00 0.09 0.00 0.00 40.66 40.91 2qw4 h LEU 115 CO -0.38 0.46 -0.44 0.15 0.09 0.00 0.00 178.44 178.31 2qw4 h PHE 116 N -0.19 -1.29 -0.49 1.13 3.57 0.31 -0.43 116.94 119.54 2qw4 h PHE 116 Ca 0.02 0.09 -0.02 0.00 3.53 0.00 0.00 57.97 61.59 2qw4 h PHE 116 Cb 0.39 0.66 -0.02 0.00 2.79 0.00 0.00 35.95 39.77 2qw4 h PHE 116 CO 0.05 -0.41 0.23 0.82 -2.23 0.00 0.00 178.31 176.77 2qw4 h ILE 117 N -0.16 1.19 -0.11 1.41 2.04 -1.01 -2.59 117.51 118.27 2qw4 h ILE 117 Ca 0.21 -0.54 -0.01 0.00 1.00 0.00 0.00 64.86 65.52 2qw4 h ILE 117 Cb 0.55 0.65 -0.00 0.00 -0.74 0.00 0.00 36.82 37.28 2qw4 h ILE 117 CO -0.76 0.21 0.03 0.25 0.00 0.00 0.00 178.15 177.88 2qw4 h LEU 118 N 0.65 0.17 -0.56 1.44 5.85 -0.50 0.18 115.31 122.54 2qw4 h LEU 118 Ca 0.17 -0.21 -0.05 0.00 0.84 0.00 0.00 57.88 58.63 2qw4 h LEU 118 Cb 0.12 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 2qw4 h LEU 118 CO -0.02 0.33 0.16 0.03 -0.34 0.00 0.00 178.44 178.60 2qw4 h ARG 119 N -0.01 0.87 0.75 1.25 3.08 -1.11 0.10 114.38 119.31 2qw4 h ARG 119 Ca 0.04 -0.20 -0.04 0.00 0.07 0.00 0.00 59.98 59.85 2qw4 h ARG 119 Cb 0.23 -0.12 0.01 0.00 0.08 0.00 0.00 29.97 30.16 2qw4 h ARG 119 CO -0.00 0.80 -0.36 1.25 -1.07 0.00 0.00 179.97 180.59 2qw4 h LEU 120 N 0.78 -0.85 -0.96 3.04 5.85 -1.44 -2.76 115.31 118.97 2qw4 h LEU 120 Ca 0.18 0.01 0.28 0.00 0.84 0.00 0.00 57.88 59.19 2qw4 h LEU 120 Cb 0.30 0.22 -0.14 0.00 0.37 0.00 0.00 40.66 41.41 2qw4 h LEU 120 CO -0.00 -0.52 0.47 0.00 -0.34 0.00 0.00 178.44 178.05 2qw4 h ALA 121 N -1.03 1.71 -0.07 1.25 0.00 -0.87 -0.96 119.26 119.29 2qw4 h ALA 121 Ca -0.10 0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 2qw4 h ALA 121 Cb 0.79 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2qw4 h ALA 121 CO 0.17 -0.48 -0.54 -0.92 0.00 0.00 0.00 179.25 177.48 2qw4 h TYR 122 N 0.34 0.24 0.00 0.00 3.20 -0.59 -3.33 116.97 116.83 2qw4 h TYR 122 Ca 0.66 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 62.45 2qw4 h TYR 122 Cb 1.41 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.63 2qw4 h TYR 122 CO -0.09 0.69 -0.73 2.89 -1.64 0.00 0.00 178.16 179.28 2qw4 n ARG 123 N -3.92 2.53 -2.26 1.82 1.85 -0.87 -4.97 116.66 110.85 2qw4 n ARG 123 Ca -0.02 -0.02 -0.36 0.00 -1.00 0.00 0.00 57.85 56.45 2qw4 n ARG 123 Cb 0.56 -1.12 -0.00 0.00 -1.05 0.00 0.00 32.46 30.85 2qw4 n ARG 123 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 2qw4 s SER 124 N -2.36 5.96 -0.74 2.89 0.01 -0.42 -4.76 113.70 114.28 2qw4 s SER 124 Ca 0.03 2.24 -0.11 0.00 1.31 0.00 0.00 55.95 59.42 2qw4 s SER 124 Cb 0.09 -2.59 0.19 0.00 0.21 0.00 0.00 66.02 63.92 2qw4 s SER 124 CO 0.52 -1.06 0.65 -0.54 0.41 0.00 0.00 173.24 173.21 2qw4 s LYS 125 N -2.98 3.25 0.36 12.44 1.02 -1.09 -4.92 119.74 127.82 2qw4 s LYS 125 Ca 0.68 -2.38 0.04 0.00 0.02 0.00 0.00 55.97 54.33 2qw4 s LYS 125 Cb -0.26 -4.23 0.67 0.00 -0.52 0.00 0.00 37.83 33.49 2qw4 s LYS 125 CO 0.31 -1.26 1.97 -1.00 -0.92 0.00 0.00 175.35 174.45 2qw4 h PRO 126 N 7.74 0.67 -0.43 -1.68 0.13 -1.92 -0.05 132.00 136.46 2qw4 h PRO 126 Ca 0.03 -0.07 0.05 0.00 -0.87 0.00 0.00 66.00 65.13 2qw4 h PRO 126 Cb 1.03 -0.13 -0.04 0.00 0.13 0.00 0.00 31.00 31.98 2qw4 h PRO 126 CO 0.77 0.51 0.18 0.78 -0.23 0.00 0.00 178.00 180.02 2qw4 h GLY 127 N 0.77 0.58 1.06 1.56 0.00 -1.92 0.83 103.07 105.95 2qw4 h GLY 127 Ca 0.17 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.39 2qw4 h GLY 127 CO -0.02 0.06 -0.03 1.18 0.00 0.00 0.00 176.54 177.72 2qw4 n GLU 128 N -4.97 0.77 -2.44 4.80 1.02 -1.11 -4.90 120.64 113.80 2qw4 n GLU 128 Ca 0.03 -0.13 -0.13 0.00 -0.02 0.00 0.00 57.16 56.91 2qw4 n GLU 128 Cb 0.14 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.07 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 1.19 -0.09 3.76 0.62 0.00 0.29 -4.92 105.19 106.03 2qw4 n GLY 129 Ca 0.18 -0.31 -0.36 0.00 0.00 0.00 0.00 46.02 45.53 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 -4.88 3.53 -0.18 1.61 1.02 -0.06 -0.36 119.74 120.42 2qw4 s LYS 130 Ca 0.08 -0.26 -0.04 0.00 0.02 0.00 0.00 55.97 55.77 2qw4 s LYS 130 Cb -0.03 -3.12 -0.02 0.00 -0.52 0.00 0.00 37.83 34.13 2qw4 s LYS 130 CO 0.10 0.59 -0.04 -0.51 -0.92 0.00 0.00 175.35 174.57 2qw4 s LEU 131 N -0.52 3.13 -0.31 3.17 1.43 0.58 -2.67 118.68 123.48 2qw4 s LEU 131 Ca 0.11 -0.23 -0.00 0.00 -1.03 0.00 0.00 54.13 52.98 2qw4 s LEU 131 Cb -0.12 -1.77 0.06 0.00 0.03 0.00 0.00 46.19 44.40 2qw4 s LEU 131 CO 0.02 0.10 0.00 -0.63 0.23 0.00 0.00 176.35 176.07 2qw4 s ILE 132 N 0.80 2.78 0.60 -0.59 1.01 -1.26 -1.48 121.20 123.06 2qw4 s ILE 132 Ca -0.01 -1.61 -0.05 0.00 0.00 0.00 0.00 60.65 58.98 2qw4 s ILE 132 Cb -0.14 -2.68 0.02 0.00 0.01 0.00 0.00 42.46 39.66 2qw4 s ILE 132 CO 0.02 -0.20 0.90 -0.36 0.00 0.00 0.00 174.94 175.29 2qw4 s PHE 133 N 1.17 3.17 0.27 3.97 0.40 0.72 -4.63 117.98 123.05 2qw4 s PHE 133 Ca -0.03 0.54 -0.03 0.00 -0.60 0.00 0.00 56.93 56.81 2qw4 s PHE 133 Cb -0.20 -2.79 0.34 0.00 0.51 0.00 0.00 43.02 40.88 2qw4 s PHE 133 CO -0.03 -0.90 1.85 0.00 0.70 0.00 0.00 175.22 176.85 2qw4 n SER 135 N -4.32 0.03 0.00 0.00 3.41 -1.26 -4.29 113.62 107.19 2qw4 n SER 135 Ca 0.07 0.51 0.00 0.00 -0.26 0.00 0.00 58.87 59.19 2qw4 n SER 135 Cb 0.15 -0.52 0.00 0.00 -0.26 0.00 0.00 64.21 63.59 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 -0.88 0.81 3.77 5.00 0.00 0.26 -4.89 105.19 109.25 2qw4 n GLY 136 Ca 0.01 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 -0.10 0.00 0.00 0.00 173.32 173.22 2qw4 n LEU 137 N 0.00 4.89 -4.18 0.99 7.94 -1.25 -1.25 117.00 124.13 2qw4 n LEU 137 Ca 0.00 1.20 -0.33 0.00 -1.11 0.00 0.00 56.01 55.77 2qw4 n LEU 137 Cb 0.00 -1.62 -0.16 0.00 0.53 0.00 0.00 43.42 42.18 2qw4 n LEU 137 CO 0.00 0.09 -0.49 -0.69 -1.11 0.00 0.00 177.39 175.19 2qw4 s VAL 138 N -1.14 2.41 0.15 1.96 1.01 -1.02 -0.20 120.40 123.58 2qw4 s VAL 138 Ca 0.55 -0.83 0.08 0.00 0.00 0.00 0.00 61.98 61.78 2qw4 s VAL 138 Cb -0.47 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.84 2qw4 s VAL 138 CO 0.62 0.51 -0.19 -0.76 0.00 0.00 0.00 175.10 175.29 2qw4 s LEU 139 N 1.21 2.41 0.57 3.92 1.02 -0.55 -3.82 118.68 123.44 2qw4 s LEU 139 Ca 0.02 -0.82 -0.14 0.00 0.02 0.00 0.00 54.13 53.21 2qw4 s LEU 139 Cb -0.14 -0.82 -0.06 0.00 0.02 0.00 0.00 46.19 45.19 2qw4 s LEU 139 CO -0.08 -0.02 1.01 -2.28 0.02 0.00 0.00 176.35 175.00 2qw4 s HIS 140 N -1.87 3.49 0.23 0.29 5.65 -1.26 -0.31 115.29 121.51 2qw4 s HIS 140 Ca 0.13 1.39 -0.10 0.00 0.25 0.00 0.00 55.06 56.73 2qw4 s HIS 140 Cb -0.07 -2.78 0.34 0.00 -1.18 0.00 0.00 32.58 28.90 2qw4 s HIS 140 CO 0.06 -0.58 1.62 -0.09 -0.65 0.00 0.00 174.74 175.10 2qw4 h ARG 141 N 0.29 0.03 0.00 2.88 2.43 -1.05 -1.57 114.38 117.39 2qw4 h ARG 141 Ca -0.45 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 2qw4 h ARG 141 Cb 1.19 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 2qw4 h ARG 141 CO 0.61 0.02 0.00 1.28 -1.51 0.00 0.00 179.97 180.38 2qw4 n LEU 142 N -5.43 0.37 0.07 3.80 4.77 -1.26 -1.83 117.00 117.50 2qw4 n LEU 142 Ca 0.11 0.57 0.12 0.00 -0.03 0.00 0.00 56.01 56.78 2qw4 n LEU 142 Cb 0.40 -0.50 0.20 0.00 -2.33 0.00 0.00 43.42 41.19 2qw4 n LEU 142 CO 0.03 -0.32 0.43 1.56 -1.33 0.00 0.00 177.39 177.76 2qw4 h GLN 143 N 0.00 0.00 0.00 3.23 4.20 -1.64 -3.33 115.11 117.57 2qw4 h GLN 143 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2qw4 h GLN 143 Cb 0.40 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.18 2qw4 h GLN 143 CO 0.00 0.00 -1.28 0.00 -0.67 0.00 0.00 178.83 176.88 2qw4 h ALA 145 N 2.25 1.46 0.00 0.00 0.00 -1.64 0.19 119.26 121.52 2qw4 h ALA 145 Ca 0.00 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 2qw4 h ALA 145 Cb 0.88 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2qw4 h ALA 145 CO 0.00 0.43 -0.28 -0.09 0.00 0.00 0.00 179.25 179.31 2qw4 h ARG 146 N 0.71 0.00 0.01 0.00 9.65 -1.81 -0.97 114.38 121.97 2qw4 h ARG 146 Ca 0.18 0.00 -0.41 0.00 -1.10 0.00 0.00 59.98 58.64 2qw4 h ARG 146 Cb 0.09 0.00 -0.06 0.00 -1.39 0.00 0.00 29.97 28.61 2qw4 h ARG 146 CO -0.02 0.28 -2.38 0.41 2.80 0.00 0.00 179.97 181.06 2qw4 n GLY 147 N -0.32 -0.46 0.15 2.80 0.00 -0.58 -4.26 105.19 102.52 2qw4 n GLY 147 Ca -0.01 -0.14 0.13 0.00 0.00 0.00 0.00 46.02 46.00 2qw4 n GLY 147 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2qw4 h PHE 148 N -0.58 0.00 -0.85 1.61 -1.00 -0.74 -3.48 116.94 111.90 2qw4 h PHE 148 Ca -0.61 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.17 2qw4 h PHE 148 Cb 1.72 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.28 2qw4 h PHE 148 CO -0.02 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.09 2qw4 n GLY 149 N 1.12 0.91 0.40 -1.45 0.00 -0.37 -3.02 105.19 102.78 2qw4 n GLY 149 Ca 0.05 -0.82 0.22 0.00 0.00 0.00 0.00 46.02 45.46 2qw4 n GLY 149 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2qw4 h ASP 150 N 0.47 0.00 -1.02 1.61 5.19 -1.96 -2.95 116.42 117.76 2qw4 h ASP 150 Ca 0.00 0.00 0.25 0.00 -0.62 0.00 0.00 57.03 56.66 2qw4 h ASP 150 Cb 0.00 0.00 -0.09 0.00 0.18 0.00 0.00 39.33 39.42 2qw4 h ASP 150 CO 0.00 0.00 0.66 -0.25 -3.12 0.00 0.00 179.24 176.53 2qw4 h TRP 151 N 0.00 0.64 0.00 4.55 7.01 -1.89 0.23 115.95 126.49 2qw4 h TRP 151 Ca 0.24 0.02 -0.07 0.00 2.11 0.00 0.00 58.89 61.19 2qw4 h TRP 151 Cb 1.27 -0.19 -0.01 0.00 -2.10 0.00 0.00 29.16 28.13 2qw4 h TRP 151 CO 0.00 0.09 -0.31 0.97 -2.79 0.00 0.00 178.44 176.39 2qw4 h ILE 152 N 0.41 1.06 -0.26 2.65 6.09 -1.69 -1.63 117.51 124.13 2qw4 h ILE 152 Ca 0.57 -1.13 -0.14 0.00 -1.37 0.00 0.00 64.86 62.79 2qw4 h ILE 152 Cb 1.43 1.64 -0.01 0.00 0.47 0.00 0.00 36.82 40.34 2qw4 h ILE 152 CO -0.27 0.30 -0.41 0.44 -3.07 0.00 0.00 178.15 175.14 2qw4 h ASP 153 N 0.00 0.67 0.54 2.19 3.32 -0.78 -2.38 116.42 119.99 2qw4 h ASP 153 Ca -0.00 -0.30 -0.18 0.00 0.02 0.00 0.00 57.03 56.57 2qw4 h ASP 153 Cb 0.61 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 2qw4 h ASP 153 CO 0.04 1.00 -0.78 -1.28 -1.72 0.00 0.00 179.24 176.50 2qw4 h SER 154 N 0.51 0.22 -0.10 6.45 0.87 -1.19 0.56 113.55 120.88 2qw4 h SER 154 Ca 0.04 -0.16 -0.05 0.00 -1.23 0.00 0.00 61.79 60.39 2qw4 h SER 154 Cb 0.93 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.83 2qw4 h SER 154 CO 0.08 0.91 -0.14 0.40 -0.53 0.00 0.00 176.83 177.56 2qw4 h ILE 155 N 0.11 1.38 -0.83 2.23 2.04 -1.26 -2.58 117.51 118.60 2qw4 h ILE 155 Ca -0.03 -1.36 -0.01 0.00 1.00 0.00 0.00 64.86 64.45 2qw4 h ILE 155 Cb 1.36 2.05 -0.04 0.00 -0.74 0.00 0.00 36.82 39.45 2qw4 h ILE 155 CO 0.12 0.39 0.47 -0.07 0.00 0.00 0.00 178.15 179.05 2qw4 h LEU 156 N -0.17 1.04 -0.20 1.44 3.38 -1.16 0.32 115.31 119.96 2qw4 h LEU 156 Ca 0.01 -0.09 0.06 0.00 0.09 0.00 0.00 57.88 57.94 2qw4 h LEU 156 Cb 0.69 -0.26 -0.07 0.00 0.09 0.00 0.00 40.66 41.11 2qw4 h LEU 156 CO 0.03 0.83 -0.33 0.00 0.09 0.00 0.00 178.44 179.06 2qw4 h ALA 157 N 1.25 -0.34 -0.05 1.53 0.00 -0.94 -0.42 119.26 120.29 2qw4 h ALA 157 Ca 0.29 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.20 2qw4 h ALA 157 Cb 0.02 0.64 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2qw4 h ALA 157 CO -0.05 -0.79 -0.17 0.35 0.00 0.00 0.00 179.25 178.59 2qw4 h PHE 158 N -0.36 0.08 -0.32 0.00 3.57 -0.99 -2.20 116.94 116.72 2qw4 h PHE 158 Ca 0.11 -0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.47 2qw4 h PHE 158 Cb 0.55 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.26 2qw4 h PHE 158 CO -0.45 0.25 -0.33 1.03 -2.23 0.00 0.00 178.31 176.59 2qw4 h SER 159 N 0.07 0.85 1.10 0.41 0.87 0.29 -1.54 113.55 115.60 2qw4 h SER 159 Ca 0.01 -0.47 0.00 0.00 -1.23 0.00 0.00 61.79 60.10 2qw4 h SER 159 Cb 0.35 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.07 2qw4 h SER 159 CO 0.02 1.14 0.00 0.08 -0.53 0.00 0.00 176.83 177.55 2qw4 h ARG 160 N 0.57 0.00 0.08 2.24 0.11 -0.65 -1.89 114.38 114.83 2qw4 h ARG 160 Ca 0.05 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.13 2qw4 h ARG 160 Cb 0.91 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.99 2qw4 h ARG 160 CO 0.08 0.00 -0.04 1.03 0.10 0.00 0.00 179.97 181.14 2qw4 h SER 161 N 0.00 -0.09 -0.88 0.08 0.87 -0.96 -2.91 113.55 109.66 2qw4 h SER 161 Ca 0.00 -0.51 0.19 0.00 -1.23 0.00 0.00 61.79 60.24 2qw4 h SER 161 Cb 0.55 0.02 -0.17 0.00 -0.44 0.00 0.00 62.40 62.37 2qw4 h SER 161 CO 0.00 0.58 -0.16 -0.07 -0.53 0.00 0.00 176.83 176.64 2qw4 h LEU 162 N -0.87 -0.73 -1.62 2.23 3.38 -1.24 -2.08 115.31 114.39 2qw4 h LEU 162 Ca -0.01 0.26 -0.02 0.00 0.09 0.00 0.00 57.88 58.20 2qw4 h LEU 162 Cb 0.60 0.52 -0.01 0.00 0.09 0.00 0.00 40.66 41.85 2qw4 h LEU 162 CO 0.02 -0.29 0.03 0.45 0.09 0.00 0.00 178.44 178.74 2qw4 h HIS 163 N 0.01 0.27 -0.65 1.13 3.86 -1.31 -2.36 115.15 116.10 2qw4 h HIS 163 Ca 0.45 -0.01 -0.07 0.00 -1.16 0.00 0.00 60.37 59.57 2qw4 h HIS 163 Cb 0.73 -0.08 -0.03 0.00 1.06 0.00 0.00 27.41 29.09 2qw4 h HIS 163 CO -0.64 0.26 0.12 0.77 0.86 0.00 0.00 177.93 179.30 2qw4 h SER 164 N 0.27 1.02 0.04 2.45 0.02 -1.17 0.42 113.55 116.60 2qw4 h SER 164 Ca 0.07 -0.25 0.00 0.00 -0.84 0.00 0.00 61.79 60.76 2qw4 h SER 164 Cb 0.14 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.41 2qw4 h SER 164 CO -0.00 1.01 0.00 0.18 -1.14 0.00 0.00 176.83 176.88 2qw4 n LEU 165 N -4.26 0.00 -3.99 5.07 4.32 -0.89 -4.89 117.00 112.36 2qw4 n LEU 165 Ca 0.04 0.34 -0.40 0.00 -0.02 0.00 0.00 56.01 55.97 2qw4 n LEU 165 Cb 0.28 -0.34 0.01 0.00 -1.62 0.00 0.00 43.42 41.75 2qw4 n LEU 165 CO 0.42 -0.32 -0.19 0.18 -1.22 0.00 0.00 177.39 176.26 2qw4 n LEU 166 N -1.34 -0.72 -4.63 2.23 4.77 0.14 -4.86 117.00 112.58 2qw4 n LEU 166 Ca 0.01 -1.20 -0.42 0.00 -0.03 0.00 0.00 56.01 54.36 2qw4 n LEU 166 Cb 0.02 -1.62 -0.04 0.00 -2.33 0.00 0.00 43.42 39.44 2qw4 n LEU 166 CO 0.01 0.69 0.67 -0.69 -1.33 0.00 0.00 177.39 176.74 2qw4 s VAL 167 N -3.36 4.77 0.59 4.08 1.01 -1.26 -5.04 120.40 121.19 2qw4 s VAL 167 Ca 0.35 1.42 -0.09 0.00 0.00 0.00 0.00 61.98 63.66 2qw4 s VAL 167 Cb -0.19 -4.17 -0.03 0.00 0.00 0.00 0.00 36.38 31.99 2qw4 s VAL 167 CO 0.95 -0.21 0.96 1.51 0.00 0.00 0.00 175.10 178.32 2qw4 s ASP 168 N 1.50 6.09 0.23 3.32 1.47 -1.26 -4.82 116.67 123.20 2qw4 s ASP 168 Ca 0.35 1.19 -0.15 0.00 1.18 0.00 0.00 52.55 55.12 2qw4 s ASP 168 Cb -0.14 -2.28 0.27 0.00 -0.34 0.00 0.00 42.92 40.43 2qw4 s ASP 168 CO 0.11 -0.86 1.57 0.58 0.68 0.00 0.00 175.17 177.24 2qw4 h VAL 169 N -0.20 0.08 -0.20 2.11 2.07 -1.99 -2.04 116.25 116.08 2qw4 h VAL 169 Ca -0.45 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 2qw4 h VAL 169 Cb 1.21 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 2qw4 h VAL 169 CO 0.62 0.00 0.05 -0.65 0.02 0.00 0.00 177.57 177.61 2qw4 h PRO 170 N -0.04 0.32 0.06 1.57 0.11 -1.97 -0.50 132.00 131.56 2qw4 h PRO 170 Ca 0.35 -0.08 0.01 0.00 0.11 0.00 0.00 66.00 66.39 2qw4 h PRO 170 Cb 0.61 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 31.65 2qw4 h PRO 170 CO -0.90 0.44 -0.30 0.00 -0.21 0.00 0.00 178.00 177.03 2qw4 h ALA 171 N 0.86 -0.81 -1.12 -0.75 0.00 -1.77 -1.12 119.26 114.55 2qw4 h ALA 171 Ca 0.06 -0.06 0.43 0.00 0.00 0.00 0.00 54.91 55.34 2qw4 h ALA 171 Cb 0.27 0.71 -0.16 0.00 0.00 0.00 0.00 17.79 18.60 2qw4 h ALA 171 CO 0.00 -0.88 0.65 0.35 0.00 0.00 0.00 179.25 179.37 2qw4 h PHE 172 N -0.43 0.73 -0.28 0.00 3.57 -1.35 0.18 116.94 119.36 2qw4 h PHE 172 Ca -0.00 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.43 2qw4 h PHE 172 Cb 0.43 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 2qw4 h PHE 172 CO -0.39 -0.40 -0.24 0.00 -2.23 0.00 0.00 178.31 175.05 2qw4 h ALA 173 N 1.87 1.06 -0.03 2.41 0.00 0.20 -1.64 119.26 123.13 2qw4 h ALA 173 Ca 0.85 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 55.40 2qw4 h ALA 173 Cb 2.39 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 20.05 2qw4 h ALA 173 CO -0.66 0.57 -0.02 0.00 0.00 0.00 0.00 179.25 179.14 2qw4 h LEU 175 N -0.37 -0.90 -0.27 0.00 3.38 -0.62 0.31 115.31 116.84 2qw4 h LEU 175 Ca 0.01 0.12 0.05 0.00 0.09 0.00 0.00 57.88 58.15 2qw4 h LEU 175 Cb 0.47 0.37 -0.05 0.00 0.09 0.00 0.00 40.66 41.54 2qw4 h LEU 175 CO 0.00 -0.19 -0.04 0.77 0.09 0.00 0.00 178.44 179.07 2qw4 h SER 176 N -0.18 -0.20 -0.62 -0.43 4.64 -1.45 -0.76 113.55 114.55 2qw4 h SER 176 Ca 0.04 0.07 0.12 0.00 -0.47 0.00 0.00 61.79 61.55 2qw4 h SER 176 Cb 0.28 0.15 -0.12 0.00 -0.31 0.00 0.00 62.40 62.40 2qw4 h SER 176 CO -0.29 -0.07 -0.22 0.00 -0.87 0.00 0.00 176.83 175.38 2qw4 h ALA 177 N 1.26 0.28 -1.00 5.18 0.00 -1.00 -0.06 119.26 123.92 2qw4 h ALA 177 Ca 0.13 0.22 0.08 0.00 0.00 0.00 0.00 54.91 55.34 2qw4 h ALA 177 Cb 0.19 0.58 -0.07 0.00 0.00 0.00 0.00 17.79 18.49 2qw4 h ALA 177 CO -0.26 -0.50 0.64 -0.07 0.00 0.00 0.00 179.25 179.06 2qw4 h LEU 178 N -0.06 1.01 -1.32 0.00 3.38 0.67 0.12 115.31 119.12 2qw4 h LEU 178 Ca 0.29 0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.33 2qw4 h LEU 178 Cb 0.50 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 2qw4 h LEU 178 CO -0.67 0.62 0.50 0.58 0.09 0.00 0.00 178.44 179.56 2qw4 h VAL 179 N 1.13 1.06 0.04 1.22 2.07 0.34 -2.95 116.25 119.17 2qw4 h VAL 179 Ca 0.45 -0.29 -0.10 0.00 0.82 0.00 0.00 66.70 67.57 2qw4 h VAL 179 Cb 0.25 0.13 0.01 0.00 -1.52 0.00 0.00 31.29 30.16 2qw4 h VAL 179 CO -0.19 0.16 -0.42 0.25 0.02 0.00 0.00 177.57 177.38 2qw4 h LEU 180 N 0.85 0.30 -8.20 2.57 5.85 -0.19 -3.43 115.31 113.05 2qw4 h LEU 180 Ca 0.32 -0.88 -0.68 0.00 0.84 0.00 0.00 57.88 57.48 2qw4 h LEU 180 Cb 0.18 -0.09 -0.18 0.00 0.37 0.00 0.00 40.66 40.93 2qw4 h LEU 180 CO -0.10 1.14 0.20 -0.63 -0.34 0.00 0.00 178.44 178.71 2qw4 s ILE 181 N -2.73 4.72 -0.01 4.05 1.01 0.31 -4.85 121.20 123.70 2qw4 s ILE 181 Ca -0.15 -0.81 -0.29 0.00 0.00 0.00 0.00 60.65 59.40 2qw4 s ILE 181 Cb 0.00 -4.52 0.08 0.00 0.01 0.00 0.00 42.46 38.04 2qw4 s ILE 181 CO 0.77 -1.17 0.74 0.28 0.00 0.00 0.00 174.94 175.56 2qw4 s THR 182 N 2.98 0.00 0.34 2.92 -1.32 -1.26 -4.67 115.64 114.63 2qw4 s THR 182 Ca 0.14 0.00 -0.29 0.00 -1.21 0.00 0.00 61.69 60.33 2qw4 s THR 182 Cb -0.22 -1.00 -0.11 0.00 -1.51 0.00 0.00 72.50 69.66 2qw4 s THR 182 CO 0.08 0.00 1.52 -0.62 -2.21 0.00 0.00 174.62 173.39 2qw4 s ASP 183 N -1.73 6.36 -0.01 8.08 2.15 -1.26 -5.00 116.67 125.27 2qw4 s ASP 183 Ca -0.05 3.01 0.02 0.00 0.43 0.00 0.00 52.55 55.96 2qw4 s ASP 183 Cb -0.00 -2.66 -0.00 0.00 -0.30 0.00 0.00 42.92 39.96 2qw4 s ASP 183 CO 0.01 -0.88 -0.07 -0.13 -0.17 0.00 0.00 175.17 173.92 2qw4 s ARG 184 N -1.51 0.60 -0.22 4.34 1.81 -1.26 -5.10 118.95 117.61 2qw4 s ARG 184 Ca 0.56 -0.24 -0.28 0.00 -1.72 0.00 0.00 55.73 54.05 2qw4 s ARG 184 Cb -0.47 -0.58 -0.05 0.00 -0.45 0.00 0.00 34.95 33.40 2qw4 s ARG 184 CO 0.57 0.14 2.18 -1.58 -0.68 0.00 0.00 175.30 175.93 2qw4 s HIS 185 N -0.09 1.22 0.00 -0.53 5.65 -1.26 -1.71 115.29 118.57 2qw4 s HIS 185 Ca 0.02 0.53 0.00 0.00 0.25 0.00 0.00 55.06 55.86 2qw4 s HIS 185 Cb -0.04 -3.95 0.00 0.00 -1.18 0.00 0.00 32.58 27.41 2qw4 s HIS 185 CO -0.00 -4.02 0.00 0.41 -0.65 0.00 0.00 174.74 170.48 2qw4 n GLY 186 N 5.71 1.11 3.72 1.59 0.00 -1.26 -5.08 105.19 110.98 2qw4 n GLY 186 Ca 0.29 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.89 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 0.00 4.37 0.18 0.99 1.43 -0.69 -4.90 118.68 120.07 2qw4 s LEU 187 Ca 0.00 2.66 -0.06 0.00 -1.03 0.00 0.00 54.13 55.70 2qw4 s LEU 187 Cb 0.00 -3.60 0.09 0.00 0.03 0.00 0.00 46.19 42.71 2qw4 s LEU 187 CO 0.00 -0.82 1.53 1.56 0.23 0.00 0.00 176.35 178.85 2qw4 h GLN 188 N 6.37 0.73 -2.51 1.70 4.20 -1.97 -3.38 115.11 120.25 2qw4 h GLN 188 Ca -0.43 -0.39 -0.60 0.00 0.06 0.00 0.00 58.65 57.29 2qw4 h GLN 188 Cb 1.21 0.01 -0.41 0.00 0.30 0.00 0.00 27.48 28.59 2qw4 h GLN 188 CO 0.89 1.01 -0.69 0.39 -0.67 0.00 0.00 178.83 179.75 2qw4 n GLU 189 N -4.03 1.81 0.11 1.46 1.02 -1.26 -4.95 120.64 114.79 2qw4 n GLU 189 Ca -0.02 -4.27 0.02 0.00 -0.02 0.00 0.00 57.16 52.87 2qw4 n GLU 189 Cb 0.54 -2.08 0.38 0.00 -0.02 0.00 0.00 31.44 30.26 2qw4 n GLU 189 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2qw4 h PRO 190 N 4.75 0.24 -0.55 3.49 0.11 -1.98 -2.52 132.00 135.55 2qw4 h PRO 190 Ca 0.17 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 66.16 2qw4 h PRO 190 Cb 0.75 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.80 2qw4 h PRO 190 CO 0.70 0.40 0.10 0.00 -0.21 0.00 0.00 178.00 178.98 2qw4 h ARG 191 N 0.23 0.90 -0.49 1.05 -0.00 -1.96 -0.01 114.38 114.09 2qw4 h ARG 191 Ca 0.04 -0.24 0.09 0.00 -0.50 0.00 0.00 59.98 59.37 2qw4 h ARG 191 Cb 0.41 -0.11 -0.07 0.00 0.00 0.00 0.00 29.97 30.20 2qw4 h ARG 191 CO 0.02 0.87 0.08 0.00 0.00 0.00 0.00 179.97 180.94 2qw4 h ARG 192 N 0.79 0.20 0.07 0.04 2.47 -1.88 0.18 114.38 116.24 2qw4 h ARG 192 Ca 0.17 -0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.87 2qw4 h ARG 192 Cb 0.40 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 28.67 2qw4 h ARG 192 CO 0.01 0.13 -0.03 0.28 0.56 0.00 0.00 179.97 180.92 2qw4 h VAL 193 N 0.20 1.17 -0.92 2.04 2.07 -1.44 -2.81 116.25 116.57 2qw4 h VAL 193 Ca 0.25 -0.90 0.18 0.00 0.82 0.00 0.00 66.70 67.04 2qw4 h VAL 193 Cb 0.34 1.75 -0.08 0.00 -1.52 0.00 0.00 31.29 31.78 2qw4 h VAL 193 CO -0.34 0.22 0.59 -0.08 0.02 0.00 0.00 177.57 177.99 2qw4 h GLU 194 N -0.51 0.58 -0.29 1.57 4.81 -0.63 -0.22 114.58 119.89 2qw4 h GLU 194 Ca -0.01 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.16 2qw4 h GLU 194 Cb 0.44 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 2qw4 h GLU 194 CO 0.02 0.39 0.09 1.49 -0.73 0.00 0.00 179.01 180.26 2qw4 h GLU 195 N 0.60 0.45 -0.41 1.92 4.57 -0.86 -2.78 114.58 118.07 2qw4 h GLU 195 Ca 0.49 -0.10 -0.11 0.00 -1.18 0.00 0.00 59.36 58.45 2qw4 h GLU 195 Cb 0.93 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.45 2qw4 h GLU 195 CO -0.23 0.51 -0.19 1.25 -1.18 0.00 0.00 179.01 179.17 2qw4 h LEU 196 N 0.31 0.88 -2.00 1.64 5.85 -1.07 -2.89 115.31 118.02 2qw4 h LEU 196 Ca 0.09 -0.40 0.12 0.00 0.84 0.00 0.00 57.88 58.54 2qw4 h LEU 196 Cb 0.25 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 2qw4 h LEU 196 CO -0.00 1.08 0.30 -0.61 -0.34 0.00 0.00 178.44 178.88 2qw4 h GLN 197 N 0.68 0.00 0.06 1.25 4.15 -1.03 -0.62 115.11 119.60 2qw4 h GLN 197 Ca 0.09 0.00 -0.27 0.00 0.77 0.00 0.00 58.65 59.24 2qw4 h GLN 197 Cb 0.75 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.41 2qw4 h GLN 197 CO 0.06 0.00 -1.37 -0.91 -1.93 0.00 0.00 178.83 174.68 2qw4 h ASN 198 N 0.00 0.19 -0.47 -0.69 2.35 -1.34 -2.07 115.58 113.55 2qw4 h ASN 198 Ca 0.20 -0.25 -0.05 0.00 -0.55 0.00 0.00 56.30 55.64 2qw4 h ASN 198 Cb 0.80 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 39.09 2qw4 h ASN 198 CO -0.00 1.21 0.09 0.03 -1.65 0.00 0.00 177.43 177.11 2qw4 h ARG 199 N 0.03 0.77 0.26 0.81 3.08 -1.22 -0.74 114.38 117.38 2qw4 h ARG 199 Ca -0.17 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 59.68 2qw4 h ARG 199 Cb 1.93 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 31.88 2qw4 h ARG 199 CO 0.14 0.77 -0.15 0.82 -1.07 0.00 0.00 179.97 180.48 2qw4 h ILE 200 N 0.65 0.68 -0.45 2.04 2.04 -1.17 -1.15 117.51 120.16 2qw4 h ILE 200 Ca 0.15 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.14 2qw4 h ILE 200 Cb 0.36 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 2qw4 h ILE 200 CO 0.01 0.00 0.34 0.00 0.00 0.00 0.00 178.15 178.50 2qw4 h ALA 201 N 0.34 2.36 -0.10 1.87 0.00 -1.36 -1.43 119.26 120.93 2qw4 h ALA 201 Ca -0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2qw4 h ALA 201 Cb 0.32 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2qw4 h ALA 201 CO 0.04 -0.57 0.00 0.77 0.00 0.00 0.00 179.25 179.48 2qw4 h SER 202 N 0.00 0.16 -0.60 0.00 0.02 0.10 -2.20 113.55 111.03 2qw4 h SER 202 Ca 0.21 -0.31 0.05 0.00 -0.84 0.00 0.00 61.79 60.90 2qw4 h SER 202 Cb 0.90 -0.04 -0.05 0.00 0.14 0.00 0.00 62.40 63.34 2qw4 h SER 202 CO -0.00 0.43 0.34 0.00 -1.14 0.00 0.00 176.83 176.45 2qw4 h LEU 204 N 0.64 -0.19 -1.36 0.00 5.85 -1.34 0.58 115.31 119.49 2qw4 h LEU 204 Ca 0.26 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.95 2qw4 h LEU 204 Cb 0.13 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 2qw4 h LEU 204 CO -0.15 -0.11 -0.11 0.11 -0.34 0.00 0.00 178.44 177.83 2qw4 h LYS 205 N -0.15 0.29 0.00 1.25 1.79 -0.99 -0.89 116.57 117.87 2qw4 h LYS 205 Ca 0.01 -0.07 -0.13 0.00 -2.18 0.00 0.00 60.65 58.28 2qw4 h LYS 205 Cb 0.16 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.75 2qw4 h LYS 205 CO -0.04 0.41 -0.71 1.49 -1.08 0.00 0.00 179.45 179.52 2qw4 h GLU 206 N 0.28 0.00 -0.03 3.15 4.81 -0.22 -2.16 114.58 120.41 2qw4 h GLU 206 Ca 0.06 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.26 2qw4 h GLU 206 Cb 0.38 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.76 2qw4 h GLU 206 CO 0.02 0.57 -0.09 1.25 -0.73 0.00 0.00 179.01 180.02 2qw4 h HIS 207 N 0.00 0.14 -0.65 0.92 2.76 0.96 -1.58 115.15 117.70 2qw4 h HIS 207 Ca -0.03 -0.06 0.01 0.00 -2.20 0.00 0.00 60.37 58.10 2qw4 h HIS 207 Cb 1.49 -0.02 -0.04 0.00 1.55 0.00 0.00 27.41 30.39 2qw4 h HIS 207 CO 0.00 0.72 0.42 -0.39 -1.30 0.00 0.00 177.93 177.39 2qw4 h VAL 208 N -0.48 1.14 -0.21 5.26 -1.51 -1.30 -2.74 116.25 116.42 2qw4 h VAL 208 Ca -0.00 -0.29 0.05 0.00 -1.23 0.00 0.00 66.70 65.22 2qw4 h VAL 208 Cb 0.73 0.21 -0.07 0.00 -2.13 0.00 0.00 31.29 30.03 2qw4 h VAL 208 CO 0.02 0.16 -0.46 0.00 -1.23 0.00 0.00 177.57 176.05 2qw4 h ALA 209 N 1.25 -0.64 0.00 5.19 0.00 -1.40 -1.52 119.26 122.15 2qw4 h ALA 209 Ca 0.25 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 2qw4 h ALA 209 Cb -0.06 0.89 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 2qw4 h ALA 209 CO -0.07 -0.96 0.01 0.00 0.00 0.00 0.00 179.25 178.23 2qw4 n ALA 210 N -2.99 1.55 -2.72 0.00 0.00 -0.60 -2.01 120.51 113.75 2qw4 n ALA 210 Ca -0.04 -0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.42 2qw4 n ALA 210 Cb 0.36 -1.98 0.01 0.00 0.00 0.00 0.00 19.45 17.84 2qw4 n ALA 210 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qw4 s VAL 211 N 1.98 -0.14 -0.07 0.00 0.11 -0.57 -4.97 120.40 116.74 2qw4 s VAL 211 Ca 0.00 -0.01 0.10 0.00 -2.93 0.00 0.00 61.98 59.14 2qw4 s VAL 211 Cb 0.00 0.00 0.16 0.00 -1.53 0.00 0.00 36.38 35.01 2qw4 s VAL 211 CO 0.00 0.00 1.05 0.00 -3.33 0.00 0.00 175.10 172.82 2qw4 n ALA 212 N 3.53 2.08 -3.00 1.54 0.00 -1.22 -4.96 120.51 118.47 2qw4 n ALA 212 Ca 0.06 -1.86 0.00 0.00 0.00 0.00 0.00 53.44 51.63 2qw4 n ALA 212 Cb 0.64 -0.31 0.00 0.00 0.00 0.00 0.00 19.45 19.78 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 -0.88 3.63 0.00 0.00 0.00 -0.85 -5.11 105.19 101.98 2qw4 n GLY 213 Ca 0.09 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.11 2qw4 n GLY 213 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qw4 n PRO 217 N 0.00 -0.18 -3.03 1.61 -0.04 -1.26 -4.88 135.00 127.21 2qw4 n PRO 217 Ca 0.00 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.35 2qw4 n PRO 217 Cb 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.43 2qw4 n PRO 217 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qw4 n ALA 218 N -1.05 0.26 0.00 0.55 0.00 -1.26 -4.97 120.51 114.03 2qw4 n ALA 218 Ca 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 53.44 52.55 2qw4 n ALA 218 Cb 0.00 0.61 0.00 0.00 0.00 0.00 0.00 19.45 20.06 2qw4 n ALA 218 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2qw4 n SER 219 N -1.89 0.00 -0.13 0.00 7.64 -1.26 -4.44 113.62 113.54 2qw4 n SER 219 Ca -0.02 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.74 2qw4 n SER 219 Cb 0.27 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.44 2qw4 n SER 219 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qw4 h LEU 221 N 0.61 0.00 -0.66 0.00 -0.00 -1.94 -2.72 115.31 110.60 2qw4 h LEU 221 Ca 0.08 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.95 2qw4 h LEU 221 Cb 0.76 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.38 2qw4 h LEU 221 CO 0.06 0.00 0.37 -1.28 -0.00 0.00 0.00 178.44 177.59 2qw4 h SER 222 N 0.00 0.82 0.50 0.17 0.87 -1.83 0.37 113.55 114.46 2qw4 h SER 222 Ca 0.00 -0.09 -0.02 0.00 -1.23 0.00 0.00 61.79 60.45 2qw4 h SER 222 Cb 0.87 -0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 62.62 2qw4 h SER 222 CO 0.00 0.67 -0.29 0.03 -0.53 0.00 0.00 176.83 176.71 2qw4 h ARG 223 N 0.90 -0.72 0.00 2.24 3.08 -1.39 0.48 114.38 118.97 2qw4 h ARG 223 Ca 0.23 0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.33 2qw4 h ARG 223 Cb 0.02 0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.24 2qw4 h ARG 223 CO -0.04 -0.48 0.00 -0.11 -1.07 0.00 0.00 179.97 178.27 2qw4 n LEU 224 N -5.43 0.00 0.33 3.04 7.94 -1.17 -2.52 117.00 119.20 2qw4 n LEU 224 Ca -0.12 0.86 0.19 0.00 -1.11 0.00 0.00 56.01 55.84 2qw4 n LEU 224 Cb 0.33 -0.36 1.04 0.00 0.53 0.00 0.00 43.42 44.95 2qw4 n LEU 224 CO 0.35 -0.36 1.15 -0.07 -1.11 0.00 0.00 177.39 177.34 2qw4 h LEU 225 N 0.00 0.00 -1.94 -1.96 3.38 -0.32 1.05 115.31 115.52 2qw4 h LEU 225 Ca 0.00 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.07 2qw4 h LEU 225 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2qw4 h LEU 225 CO 0.00 0.00 0.45 1.23 0.09 0.00 0.00 178.44 180.21 2qw4 h GLY 226 N 0.00 0.00 0.92 0.83 0.00 -0.59 -2.00 103.07 102.23 2qw4 h GLY 226 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 2qw4 h GLY 226 CO 0.00 0.00 -0.10 0.50 0.00 0.00 0.00 176.54 176.94 2qw4 h LYS 227 N 0.00 0.63 -1.05 4.80 1.79 0.11 -3.37 116.57 119.49 2qw4 h LYS 227 Ca 0.17 -0.25 0.35 0.00 -2.18 0.00 0.00 60.65 58.73 2qw4 h LYS 227 Cb 1.06 -0.03 -0.15 0.00 -1.58 0.00 0.00 32.23 31.53 2qw4 h LYS 227 CO -0.00 0.83 0.61 -0.07 -1.08 0.00 0.00 179.45 179.74 2qw4 h LEU 228 N 0.40 0.45 0.68 2.94 3.38 -1.52 -1.64 115.31 120.02 2qw4 h LEU 228 Ca 0.08 0.19 -0.03 0.00 0.09 0.00 0.00 57.88 58.20 2qw4 h LEU 228 Cb 0.61 0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.51 2qw4 h LEU 228 CO 0.04 -0.17 -0.33 1.55 0.09 0.00 0.00 178.44 179.62 2qw4 h PRO 229 N 0.25 -0.88 -0.62 1.13 0.13 -1.77 -3.25 132.00 126.99 2qw4 h PRO 229 Ca 0.75 0.06 0.15 0.00 -0.87 0.00 0.00 66.00 66.09 2qw4 h PRO 229 Cb 1.86 0.20 -0.03 0.00 0.13 0.00 0.00 31.00 33.16 2qw4 h PRO 229 CO -0.59 -0.57 0.43 0.93 -0.23 0.00 0.00 178.00 177.97 2qw4 h GLU 230 N -0.97 0.18 -1.03 0.86 5.08 -1.52 1.93 114.58 119.11 2qw4 h GLU 230 Ca -0.09 -0.01 0.26 0.00 -1.00 0.00 0.00 59.36 58.52 2qw4 h GLU 230 Cb 0.72 -0.04 -0.12 0.00 0.50 0.00 0.00 28.75 29.81 2qw4 h GLU 230 CO 0.15 0.12 0.62 1.25 -1.00 0.00 0.00 179.01 180.16 2qw4 h LEU 231 N 0.18 0.58 -0.34 1.33 5.85 -1.57 -2.52 115.31 118.83 2qw4 h LEU 231 Ca 0.30 0.12 -0.05 0.00 0.84 0.00 0.00 57.88 59.09 2qw4 h LEU 231 Cb 0.92 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.97 2qw4 h LEU 231 CO -0.05 0.08 0.03 0.03 -0.34 0.00 0.00 178.44 178.19 2qw4 h ARG 232 N 0.50 0.58 -0.63 1.25 -0.00 0.30 -0.72 114.38 115.65 2qw4 h ARG 232 Ca 0.64 -0.17 0.11 0.00 -0.50 0.00 0.00 59.98 60.06 2qw4 h ARG 232 Cb 1.38 -0.06 -0.08 0.00 0.00 0.00 0.00 29.97 31.20 2qw4 h ARG 232 CO -0.43 0.68 0.19 1.15 0.00 0.00 0.00 179.97 181.56 2qw4 h THR 233 N 0.40 0.68 0.00 2.04 2.02 -1.52 -0.59 112.91 115.93 2qw4 h THR 233 Ca 0.10 -0.11 -0.04 0.00 0.77 0.00 0.00 66.41 67.13 2qw4 h THR 233 Cb 0.40 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 67.12 2qw4 h THR 233 CO 0.01 0.06 -0.18 -0.07 0.37 0.00 0.00 175.52 175.72 2qw4 h LEU 234 N 0.33 0.00 -0.28 2.58 4.07 -0.97 -2.26 115.31 118.79 2qw4 h LEU 234 Ca 0.33 0.00 -0.16 0.00 0.08 0.00 0.00 57.88 58.13 2qw4 h LEU 234 Cb 0.48 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.22 2qw4 h LEU 234 CO -0.38 0.18 -0.45 0.00 -1.08 0.00 0.00 178.44 176.71 2qw4 h THR 236 N 0.55 0.59 -1.15 0.00 2.02 -0.81 0.40 112.91 114.51 2qw4 h THR 236 Ca 0.02 -0.00 0.32 0.00 0.77 0.00 0.00 66.41 67.53 2qw4 h THR 236 Cb 1.05 0.59 -0.07 0.00 -1.74 0.00 0.00 68.15 67.98 2qw4 h THR 236 CO 0.10 0.00 0.80 1.56 0.37 0.00 0.00 175.52 178.35 2qw4 h GLN 237 N -0.57 0.13 -0.32 6.66 4.20 -1.49 0.44 115.11 124.16 2qw4 h GLN 237 Ca -0.06 -0.01 -0.15 0.00 0.06 0.00 0.00 58.65 58.50 2qw4 h GLN 237 Cb 0.43 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.18 2qw4 h GLN 237 CO 0.10 0.09 -0.38 0.78 -0.67 0.00 0.00 178.83 178.74 2qw4 h GLY 238 N 0.13 0.89 1.81 3.46 0.00 -0.59 -1.86 103.07 106.91 2qw4 h GLY 238 Ca 0.59 -0.95 -0.19 0.00 0.00 0.00 0.00 47.33 46.78 2qw4 h GLY 238 CO -0.12 0.85 -0.85 1.41 0.00 0.00 0.00 176.54 177.83 2qw4 h LEU 239 N 0.60 0.22 -0.60 3.11 3.38 0.12 -2.14 115.31 119.99 2qw4 h LEU 239 Ca 0.04 -0.18 0.04 0.00 0.09 0.00 0.00 57.88 57.88 2qw4 h LEU 239 Cb 0.97 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.60 2qw4 h LEU 239 CO 0.09 0.97 0.35 1.56 0.09 0.00 0.00 178.44 181.50 2qw4 h GLN 240 N 0.10 0.65 -0.64 1.13 4.20 -0.23 0.13 115.11 120.45 2qw4 h GLN 240 Ca -0.04 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.65 2qw4 h GLN 240 Cb 1.47 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 29.07 2qw4 h GLN 240 CO 0.13 0.43 0.42 0.00 -0.67 0.00 0.00 178.83 179.13 2qw4 h ARG 241 N 0.67 0.82 0.29 1.46 2.47 -0.82 -1.14 114.38 118.13 2qw4 h ARG 241 Ca 0.26 -0.05 -0.01 0.00 -1.26 0.00 0.00 59.98 58.91 2qw4 h ARG 241 Cb 0.09 -0.19 0.00 0.00 -1.65 0.00 0.00 29.97 28.23 2qw4 h ARG 241 CO -0.14 0.54 -0.14 0.82 0.56 0.00 0.00 179.97 181.62 2qw4 h ILE 242 N 0.85 0.73 -0.97 2.04 2.04 -0.92 -1.46 117.51 119.81 2qw4 h ILE 242 Ca 0.24 -0.55 0.09 0.00 1.00 0.00 0.00 64.86 65.64 2qw4 h ILE 242 Cb -0.08 1.02 -0.12 0.00 -0.74 0.00 0.00 36.82 36.90 2qw4 h ILE 242 CO -0.06 0.11 -0.57 0.33 0.00 0.00 0.00 178.15 177.96 2qw4 n PHE 243 N -5.13 -0.42 -0.08 1.37 7.35 0.42 0.26 117.46 121.22 2qw4 n PHE 243 Ca -0.10 1.22 -0.06 0.00 -0.76 0.00 0.00 57.45 57.75 2qw4 n PHE 243 Cb 0.25 -0.58 -0.00 0.00 0.35 0.00 0.00 39.48 39.50 2qw4 n PHE 243 CO 0.00 0.00 0.00 -0.92 -0.76 0.00 0.00 176.76 175.08 2qw4 h TYR 244 N 0.00 -0.35 -0.61 -5.13 3.20 -1.06 -1.32 116.97 111.69 2qw4 h TYR 244 Ca 0.16 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.97 2qw4 h TYR 244 Cb 0.40 0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.86 2qw4 h TYR 244 CO -1.00 -0.22 0.02 -0.07 -1.64 0.00 0.00 178.16 175.25 2qw4 h LEU 245 N -0.10 1.03 -2.27 2.82 3.38 -0.04 0.13 115.31 120.28 2qw4 h LEU 245 Ca 0.16 -0.28 0.04 0.00 0.09 0.00 0.00 57.88 57.89 2qw4 h LEU 245 Cb 0.34 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2qw4 h LEU 245 CO -0.38 1.07 0.15 0.50 0.09 0.00 0.00 178.44 179.87 2qw4 h LYS 246 N 0.97 0.00 0.23 1.13 3.64 0.55 -2.33 116.57 120.77 2qw4 h LYS 246 Ca 0.18 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 59.22 2qw4 h LYS 246 Cb 0.53 0.00 0.03 0.00 -0.41 0.00 0.00 32.23 32.38 2qw4 h LYS 246 CO 0.03 0.00 -1.50 -0.07 -2.27 0.00 0.00 179.45 175.64 2qw4 h LEU 247 N 0.00 0.76 -0.65 5.20 3.38 0.13 -3.26 115.31 120.87 2qw4 h LEU 247 Ca 0.06 -0.85 0.00 0.00 0.09 0.00 0.00 57.88 57.18 2qw4 h LEU 247 Cb 0.35 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2qw4 h LEU 247 CO -0.00 1.68 -0.08 -1.84 0.09 0.00 0.00 178.44 178.29 2qw4 n GLU 248 N -3.67 1.26 -4.05 1.13 -0.00 -1.13 -4.97 120.64 109.21 2qw4 n GLU 248 Ca -0.17 -0.65 -0.28 0.00 -0.00 0.00 0.00 57.16 56.06 2qw4 n GLU 248 Cb 1.09 -1.49 -0.03 0.00 -0.00 0.00 0.00 31.44 31.02 2qw4 n GLU 248 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 2qw4 n ASP 249 N -0.31 -0.89 0.00 -1.84 2.03 -0.89 -4.94 116.55 109.71 2qw4 n ASP 249 Ca 0.17 -1.03 0.00 0.00 0.52 0.00 0.00 54.79 54.45 2qw4 n ASP 249 Cb 0.32 -2.85 0.00 0.00 -0.72 0.00 0.00 41.12 37.87 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 -4.42 0.00 -4.74 -2.67 4.77 -1.26 -4.83 117.00 103.85 2qw4 n LEU 250 Ca -0.22 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.34 2qw4 n LEU 250 Cb 0.64 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.70 2qw4 n LEU 250 CO 0.79 0.00 0.87 0.68 -1.33 0.00 0.00 177.39 178.39 2qw4 s VAL 251 N 0.00 3.64 0.86 4.08 -7.23 -1.26 -5.02 120.40 115.46 2qw4 s VAL 251 Ca 0.00 1.38 -0.12 0.00 -1.81 0.00 0.00 61.98 61.43 2qw4 s VAL 251 Cb 0.00 -3.88 0.10 0.00 0.56 0.00 0.00 36.38 33.16 2qw4 s VAL 251 CO 0.00 0.22 1.11 -2.84 -0.31 0.00 0.00 175.10 173.28 2qw4 s PRO 252 N -0.23 1.60 0.73 4.82 0.02 -1.26 -4.95 135.00 135.72 2qw4 s PRO 252 Ca 0.52 0.52 -0.11 0.00 0.02 0.00 0.00 61.00 61.96 2qw4 s PRO 252 Cb -0.32 -1.87 0.03 0.00 0.02 0.00 0.00 34.50 32.36 2qw4 s PRO 252 CO 0.36 -1.93 1.07 -1.25 -0.33 0.00 0.00 177.00 174.92 2qw4 s PRO 253 N -5.17 2.65 0.43 5.54 0.04 -1.26 -5.03 135.00 132.20 2qw4 s PRO 253 Ca 0.62 0.97 -0.23 0.00 0.04 0.00 0.00 61.00 62.40 2qw4 s PRO 253 Cb -0.15 -1.96 -0.08 0.00 0.04 0.00 0.00 34.50 32.35 2qw4 s PRO 253 CO 0.54 -1.31 1.10 -2.14 0.04 0.00 0.00 177.00 175.23 2qw4 s PRO 254 N -5.02 3.95 0.06 0.56 0.02 -1.26 -4.81 135.00 128.50 2qw4 s PRO 254 Ca 0.59 1.61 -0.04 0.00 0.02 0.00 0.00 61.00 63.19 2qw4 s PRO 254 Cb -0.15 -2.44 0.07 0.00 0.02 0.00 0.00 34.50 32.00 2qw4 s PRO 254 CO 0.55 -0.35 0.38 -2.30 -0.33 0.00 0.00 177.00 174.95 2qw4 n PRO 255 N -0.34 -0.05 0.14 5.54 -0.02 -1.26 -1.16 135.00 137.85 2qw4 n PRO 255 Ca 0.06 0.38 -0.10 0.00 -2.02 0.00 0.00 63.50 61.82 2qw4 n PRO 255 Cb 0.49 -0.56 -0.06 0.00 -0.02 0.00 0.00 33.50 33.35 2qw4 n PRO 255 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 2qw4 h ILE 256 N 0.00 0.38 -0.35 4.25 5.03 -1.99 -2.47 117.51 122.36 2qw4 h ILE 256 Ca 0.09 -0.79 0.07 0.00 -0.12 0.00 0.00 64.86 64.12 2qw4 h ILE 256 Cb 0.15 0.63 -0.07 0.00 -3.03 0.00 0.00 36.82 34.50 2qw4 h ILE 256 CO -0.24 0.09 -0.12 0.40 -0.68 0.00 0.00 178.15 177.60 2qw4 h ILE 257 N -1.01 0.59 -0.98 -0.67 1.08 -1.82 0.18 117.51 114.89 2qw4 h ILE 257 Ca -0.04 0.00 0.15 0.00 -0.39 0.00 0.00 64.86 64.57 2qw4 h ILE 257 Cb 0.48 0.59 -0.09 0.00 -3.07 0.00 0.00 36.82 34.73 2qw4 h ILE 257 CO 0.07 0.00 0.61 -0.78 -0.69 0.00 0.00 178.15 177.37 2qw4 h ASP 258 N -0.04 0.82 -0.37 1.72 3.58 -1.22 -1.21 116.42 119.68 2qw4 h ASP 258 Ca 0.17 0.06 -0.01 0.00 0.42 0.00 0.00 57.03 57.67 2qw4 h ASP 258 Cb 0.30 -0.10 -0.02 0.00 1.72 0.00 0.00 39.33 41.24 2qw4 h ASP 258 CO -0.38 0.39 0.20 0.50 -2.88 0.00 0.00 179.24 177.07 2qw4 h LYS 259 N 0.85 0.52 0.07 0.28 3.11 -0.52 -0.83 116.57 120.05 2qw4 h LYS 259 Ca 0.51 -0.06 0.02 0.00 -2.81 0.00 0.00 60.65 58.30 2qw4 h LYS 259 Cb 0.67 -0.10 -0.04 0.00 -1.00 0.00 0.00 32.23 31.76 2qw4 h LYS 259 CO -0.28 0.44 -0.25 0.82 -2.81 0.00 0.00 179.45 177.37 2qw4 h ILE 260 N 0.47 0.44 0.23 2.00 1.08 -0.21 -2.36 117.51 119.17 2qw4 h ILE 260 Ca 0.13 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.60 2qw4 h ILE 260 Cb 0.07 0.44 -0.01 0.00 -3.07 0.00 0.00 36.82 34.25 2qw4 h ILE 260 CO -0.02 0.00 -0.16 0.15 -0.69 0.00 0.00 178.15 177.43 2qw4 h PHE 261 N -0.42 -0.43 -0.64 1.37 3.57 -1.20 -2.85 116.94 116.34 2qw4 h PHE 261 Ca 0.04 -0.00 0.16 0.00 3.53 0.00 0.00 57.97 61.70 2qw4 h PHE 261 Cb 0.47 0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.34 2qw4 h PHE 261 CO -0.25 -0.25 0.45 0.52 -2.23 0.00 0.00 178.31 176.54 2qw4 h MET 262 N -0.40 0.16 -0.27 1.11 2.86 -1.11 -0.95 114.93 116.34 2qw4 h MET 262 Ca -0.02 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 2qw4 h MET 262 Cb 0.34 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.97 2qw4 h MET 262 CO 0.00 0.11 0.00 -0.25 1.06 0.00 0.00 176.91 177.83 2qw4 n ASP 263 N -4.41 0.27 0.00 1.22 9.92 -0.89 -5.10 116.55 117.55 2qw4 n ASP 263 Ca 0.12 -0.71 0.00 0.00 -0.53 0.00 0.00 54.79 53.68 2qw4 n ASP 263 Cb 0.60 -0.13 0.00 0.00 -0.64 0.00 0.00 41.12 40.94 2qw4 n ASP 263 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74