#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qw4 n ALA 31 N 0.00 0.00 -0.02 3.55 0.00 -1.26 -4.79 120.51 117.99 2qw4 n ALA 31 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 2qw4 n ALA 31 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 2qw4 n ALA 31 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2qw4 h ASN 32 N 0.04 0.16 0.04 0.00 -0.73 -2.05 -2.87 115.58 110.17 2qw4 h ASN 32 Ca 0.00 -0.17 0.02 0.00 1.87 0.00 0.00 56.30 58.02 2qw4 h ASN 32 Cb 0.00 -0.04 -0.04 0.00 0.27 0.00 0.00 38.32 38.51 2qw4 h ASN 32 CO 0.00 0.29 -0.21 0.25 -0.37 0.00 0.00 177.43 177.39 2qw4 h LEU 33 N 0.02 -0.61 -0.37 0.34 5.85 -1.98 0.38 115.31 118.95 2qw4 h LEU 33 Ca 0.04 0.08 0.08 0.00 0.84 0.00 0.00 57.88 58.92 2qw4 h LEU 33 Cb 0.18 0.24 -0.08 0.00 0.37 0.00 0.00 40.66 41.37 2qw4 h LEU 33 CO -0.00 -0.28 -0.23 0.25 -0.34 0.00 0.00 178.44 177.84 2qw4 h LEU 34 N -0.36 -0.76 -0.43 2.25 7.12 -1.87 0.42 115.31 121.68 2qw4 h LEU 34 Ca 0.05 0.16 0.07 0.00 0.13 0.00 0.00 57.88 58.29 2qw4 h LEU 34 Cb 0.41 0.39 -0.06 0.00 -0.53 0.00 0.00 40.66 40.87 2qw4 h LEU 34 CO -0.17 -0.26 0.07 0.74 -0.13 0.00 0.00 178.44 178.69 2qw4 h THR 35 N -0.17 0.75 -0.02 1.05 2.02 -1.16 0.22 112.91 115.60 2qw4 h THR 35 Ca 0.18 -0.07 0.03 0.00 0.77 0.00 0.00 66.41 67.33 2qw4 h THR 35 Cb 0.46 0.54 -0.05 0.00 -1.74 0.00 0.00 68.15 67.36 2qw4 h THR 35 CO -0.47 0.04 -0.24 -1.28 0.37 0.00 0.00 175.52 173.93 2qw4 h SER 36 N 0.19 -0.72 -0.56 4.18 0.87 0.12 -0.42 113.55 117.20 2qw4 h SER 36 Ca 0.21 0.10 0.11 0.00 -1.23 0.00 0.00 61.79 60.98 2qw4 h SER 36 Cb 0.27 0.30 -0.09 0.00 -0.44 0.00 0.00 62.40 62.44 2qw4 h SER 36 CO -0.29 -0.31 0.03 -0.07 -0.53 0.00 0.00 176.83 175.67 2qw4 h LEU 37 N -0.37 -0.18 -1.11 2.23 3.38 0.35 -0.75 115.31 118.87 2qw4 h LEU 37 Ca 0.07 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 2qw4 h LEU 37 Cb 0.46 0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.39 2qw4 h LEU 37 CO -0.23 -0.07 0.41 0.58 0.09 0.00 0.00 178.44 179.23 2qw4 h VAL 38 N 0.15 1.22 0.00 1.22 2.07 0.41 -2.18 116.25 119.14 2qw4 h VAL 38 Ca 0.29 -0.54 -0.20 0.00 0.82 0.00 0.00 66.70 67.07 2qw4 h VAL 38 Cb 0.45 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 2qw4 h VAL 38 CO -0.45 0.24 -0.95 0.03 0.02 0.00 0.00 177.57 176.47 2qw4 h ARG 39 N 1.04 0.01 -0.68 1.57 3.08 -0.61 -2.53 114.38 116.26 2qw4 h ARG 39 Ca 0.27 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.31 2qw4 h ARG 39 Cb 0.02 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 2qw4 h ARG 39 CO -0.04 0.95 0.44 0.00 -1.07 0.00 0.00 179.97 180.24 2qw4 h ALA 40 N 1.05 0.86 -0.24 0.04 0.00 -0.64 -2.85 119.26 117.48 2qw4 h ALA 40 Ca -0.01 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2qw4 h ALA 40 Cb 1.67 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 2qw4 h ALA 40 CO 0.12 0.29 0.03 1.25 0.00 0.00 0.00 179.25 180.95 2qw4 h HIS 41 N 0.92 0.43 0.00 0.00 -0.00 -1.28 -3.10 115.15 112.12 2qw4 h HIS 41 Ca 0.25 -0.06 -0.01 0.00 -0.00 0.00 0.00 60.37 60.54 2qw4 h HIS 41 Cb -0.09 -0.12 -0.00 0.00 -0.00 0.00 0.00 27.41 27.20 2qw4 h HIS 41 CO -0.02 0.54 -0.05 -0.07 -0.00 0.00 0.00 177.93 178.32 2qw4 h LEU 42 N 0.19 0.00 -1.34 0.26 3.38 -1.43 -2.84 115.31 113.53 2qw4 h LEU 42 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2qw4 h LEU 42 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2qw4 h LEU 42 CO 0.01 0.05 0.00 0.47 0.09 0.00 0.00 178.44 179.06 2qw4 n ASP 43 N -3.22 1.94 0.00 -0.43 9.92 -1.08 -4.23 116.55 119.44 2qw4 n ASP 43 Ca -0.00 -2.09 0.00 0.00 -0.53 0.00 0.00 54.79 52.17 2qw4 n ASP 43 Cb 0.27 -0.29 0.00 0.00 -0.64 0.00 0.00 41.12 40.46 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 0.37 1.38 -4.77 -2.24 3.41 -1.12 -4.97 113.62 105.68 2qw4 n SER 44 Ca 0.11 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.32 2qw4 n SER 44 Cb 0.34 0.09 -0.01 0.00 -0.26 0.00 0.00 64.21 64.38 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 -2.25 2.95 0.64 5.00 0.00 -1.09 -4.91 107.32 107.66 2qw4 s GLY 45 Ca 0.00 1.29 -0.13 0.00 0.00 0.00 0.00 44.72 45.88 2qw4 s GLY 45 CO 0.00 1.91 1.05 2.56 0.00 0.00 0.00 173.10 178.62 2qw4 s PRO 46 N -2.10 3.21 0.68 2.90 0.04 -1.26 -4.89 135.00 133.59 2qw4 s PRO 46 Ca 0.54 1.01 -0.17 0.00 0.04 0.00 0.00 61.00 62.43 2qw4 s PRO 46 Cb -0.40 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.06 2qw4 s PRO 46 CO 0.52 -0.88 0.53 0.43 0.04 0.00 0.00 177.00 177.64 2qw4 n SER 47 N -2.61 -1.14 0.00 6.66 7.64 -1.26 -4.87 113.62 118.04 2qw4 n SER 47 Ca 0.08 0.64 0.12 0.00 1.01 0.00 0.00 58.87 60.72 2qw4 n SER 47 Cb 0.53 -1.20 0.68 0.00 -1.01 0.00 0.00 64.21 63.21 2qw4 n SER 47 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2qw4 n THR 48 N -2.17 0.14 0.26 0.44 -2.24 -1.26 -2.25 114.28 107.19 2qw4 n THR 48 Ca 0.10 0.03 -0.10 0.00 -2.27 0.00 0.00 64.05 61.82 2qw4 n THR 48 Cb 0.49 -0.63 -0.05 0.00 -2.10 0.00 0.00 70.33 68.05 2qw4 n THR 48 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qw4 h ALA 49 N 3.33 -0.89 0.00 6.98 0.00 -2.02 -3.35 119.26 123.32 2qw4 h ALA 49 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2qw4 h ALA 49 Cb 0.15 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2qw4 h ALA 49 CO 0.00 -0.84 0.00 1.63 0.00 0.00 0.00 179.25 180.04 2qw4 n LYS 50 N -4.38 0.27 -1.52 0.00 4.76 -0.96 -4.60 118.16 111.72 2qw4 n LYS 50 Ca -0.08 0.00 -0.35 0.00 -2.87 0.00 0.00 58.31 55.00 2qw4 n LYS 50 Cb 0.27 -1.11 -0.07 0.00 -1.84 0.00 0.00 35.03 32.28 2qw4 n LYS 50 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2qw4 n LEU 51 N 0.21 3.25 -4.54 -0.35 4.77 -1.25 -4.32 117.00 114.77 2qw4 n LEU 51 Ca 0.00 -2.88 -0.37 0.00 -0.03 0.00 0.00 56.01 52.72 2qw4 n LEU 51 Cb 0.05 -1.37 -0.06 0.00 -2.33 0.00 0.00 43.42 39.72 2qw4 n LEU 51 CO 0.00 -1.31 2.07 -0.67 -1.33 0.00 0.00 177.39 176.15 2qw4 n ASP 52 N 11.30 1.86 -0.83 -1.43 4.64 0.46 -4.82 116.55 127.74 2qw4 n ASP 52 Ca 0.47 -0.36 0.08 0.00 -1.38 0.00 0.00 54.79 53.59 2qw4 n ASP 52 Cb 0.44 -1.44 0.22 0.00 -1.04 0.00 0.00 41.12 39.29 2qw4 n ASP 52 CO 0.00 0.00 0.00 -1.22 -0.82 0.00 0.00 177.20 175.16 2qw4 n TYR 53 N 14.78 0.57 0.24 -0.67 4.02 -1.26 -1.87 117.16 132.96 2qw4 n TYR 53 Ca 0.44 -0.29 0.10 0.00 -0.01 0.00 0.00 57.90 58.14 2qw4 n TYR 53 Cb 0.43 0.00 0.59 0.00 -0.02 0.00 0.00 39.34 40.35 2qw4 n TYR 53 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 2qw4 h SER 54 N 2.68 0.00 -0.12 7.72 4.64 -1.90 -2.93 113.55 123.66 2qw4 h SER 54 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qw4 h SER 54 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 2qw4 h SER 54 CO 0.00 0.19 0.00 0.29 -0.87 0.00 0.00 176.83 176.44 2qw4 n LYS 55 N -3.65 1.32 -2.13 4.77 5.02 -1.26 -5.02 118.16 117.22 2qw4 n LYS 55 Ca -0.01 -1.49 -0.41 0.00 -2.02 0.00 0.00 58.31 54.38 2qw4 n LYS 55 Cb 0.32 -1.26 -0.03 0.00 -0.02 0.00 0.00 35.03 34.04 2qw4 n LYS 55 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2qw4 s PHE 56 N -1.05 3.15 -0.07 2.13 5.36 -1.11 -4.93 117.98 121.46 2qw4 s PHE 56 Ca 0.18 1.15 -0.01 0.00 -0.96 0.00 0.00 56.93 57.29 2qw4 s PHE 56 Cb 0.11 -3.70 0.03 0.00 -0.34 0.00 0.00 43.02 39.13 2qw4 s PHE 56 CO 0.17 -2.20 0.00 -1.14 -1.46 0.00 0.00 175.22 170.58 2qw4 s GLN 57 N -0.33 0.57 -0.78 10.12 0.74 -1.26 -5.02 119.66 123.70 2qw4 s GLN 57 Ca 0.57 0.12 -0.26 0.00 0.05 0.00 0.00 55.36 55.84 2qw4 s GLN 57 Cb -0.39 -0.93 -0.00 0.00 1.10 0.00 0.00 33.01 32.79 2qw4 s GLN 57 CO 0.41 -0.29 1.65 -2.00 -0.55 0.00 0.00 175.29 174.50 2qw4 s GLU 58 N 1.93 2.93 -0.07 1.67 2.56 -1.26 -4.59 118.70 121.87 2qw4 s GLU 58 Ca 0.04 -0.11 -0.04 0.00 0.00 0.00 0.00 54.97 54.86 2qw4 s GLU 58 Cb -0.12 -4.63 -0.04 0.00 2.00 0.00 0.00 34.13 31.34 2qw4 s GLU 58 CO -0.05 -2.61 0.13 -0.51 -0.56 0.00 0.00 175.26 171.66 2qw4 s LEU 59 N 7.66 4.24 -0.24 2.70 1.43 -1.26 -4.98 118.68 128.21 2qw4 s LEU 59 Ca 0.55 0.36 -0.12 0.00 -1.03 0.00 0.00 54.13 53.89 2qw4 s LEU 59 Cb -0.08 -2.23 -0.16 0.00 0.03 0.00 0.00 46.19 43.75 2qw4 s LEU 59 CO 0.09 0.35 -0.13 0.52 0.23 0.00 0.00 176.35 177.41 2qw4 n VAL 60 N 1.59 1.55 -3.75 -1.59 0.31 -1.26 -4.94 118.33 110.24 2qw4 n VAL 60 Ca -0.16 -0.36 -0.35 0.00 -0.01 0.00 0.00 64.34 63.45 2qw4 n VAL 60 Cb 0.54 -1.82 -0.08 0.00 -0.91 0.00 0.00 33.84 31.57 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 -7.36 4.24 0.20 7.52 1.43 -1.26 -5.06 118.68 118.38 2qw4 s LEU 61 Ca -0.34 0.28 -0.31 0.00 -1.03 0.00 0.00 54.13 52.73 2qw4 s LEU 61 Cb 0.11 -2.09 -0.10 0.00 0.03 0.00 0.00 46.19 44.13 2qw4 s LEU 61 CO 0.56 0.22 1.57 -2.16 0.23 0.00 0.00 176.35 176.77 2qw4 s PRO 62 N 0.10 4.20 0.75 1.29 0.04 -1.26 -4.98 135.00 135.14 2qw4 s PRO 62 Ca 0.10 2.41 -0.11 0.00 0.04 0.00 0.00 61.00 63.43 2qw4 s PRO 62 Cb -0.11 -3.12 0.04 0.00 0.04 0.00 0.00 34.50 31.34 2qw4 s PRO 62 CO -0.01 -0.60 1.08 -1.58 0.04 0.00 0.00 177.00 175.93 2qw4 s HIS 63 N 0.87 2.99 0.09 0.56 2.46 -1.26 -5.05 115.29 115.94 2qw4 s HIS 63 Ca 0.68 1.23 0.05 0.00 0.47 0.00 0.00 55.06 57.50 2qw4 s HIS 63 Cb -0.45 -3.03 -0.04 0.00 -0.13 0.00 0.00 32.58 28.94 2qw4 s HIS 63 CO 0.35 -1.51 -0.02 -0.59 -2.47 0.00 0.00 174.74 170.49 2qw4 s PHE 64 N -3.14 2.94 0.00 3.88 -0.12 -1.26 -5.08 117.98 115.19 2qw4 s PHE 64 Ca 0.59 -0.05 0.00 0.00 -0.05 0.00 0.00 56.93 57.42 2qw4 s PHE 64 Cb -0.14 -1.52 0.00 0.00 -0.63 0.00 0.00 43.02 40.73 2qw4 s PHE 64 CO 0.54 0.47 0.00 0.41 -0.05 0.00 0.00 175.22 176.59 2qw4 n GLY 65 N 0.63 -1.62 3.63 1.99 0.00 -1.26 -4.98 105.19 103.58 2qw4 n GLY 65 Ca -0.11 -1.68 -0.35 0.00 0.00 0.00 0.00 46.02 43.88 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 0.00 0.40 -2.92 1.61 5.02 -1.26 -5.04 118.16 115.97 2qw4 n LYS 66 Ca 0.00 0.20 -0.31 0.00 -2.02 0.00 0.00 58.31 56.18 2qw4 n LYS 66 Cb 0.00 -2.28 -0.04 0.00 -0.02 0.00 0.00 35.03 32.69 2qw4 n LYS 66 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2qw4 s GLU 67 N -3.58 3.81 0.00 1.97 8.01 -1.26 -5.11 118.70 122.54 2qw4 s GLU 67 Ca 0.73 0.48 0.00 0.00 0.01 0.00 0.00 54.97 56.19 2qw4 s GLU 67 Cb -0.32 -2.41 0.00 0.00 -4.31 0.00 0.00 34.13 27.09 2qw4 s GLU 67 CO 0.51 0.01 0.00 -0.40 0.01 0.00 0.00 175.26 175.39 2qw4 n ASP 68 N -1.12 0.97 0.06 -0.19 3.85 -1.26 -4.99 116.55 113.88 2qw4 n ASP 68 Ca 0.02 -0.37 -0.12 0.00 -0.71 0.00 0.00 54.79 53.62 2qw4 n ASP 68 Cb 0.54 0.00 -0.07 0.00 -1.35 0.00 0.00 41.12 40.24 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 0.26 -0.05 -0.81 2.12 0.00 -1.99 -3.04 119.26 115.74 2qw4 h ALA 69 Ca 0.00 -0.01 0.18 0.00 0.00 0.00 0.00 54.91 55.08 2qw4 h ALA 69 Cb 0.00 0.03 -0.15 0.00 0.00 0.00 0.00 17.79 17.67 2qw4 h ALA 69 CO 0.00 -0.53 -0.15 0.41 0.00 0.00 0.00 179.25 178.98 2qw4 n GLY 70 N -1.12 -1.30 0.15 0.00 0.00 -1.26 0.91 105.19 102.57 2qw4 n GLY 70 Ca -0.07 0.85 -0.09 0.00 0.00 0.00 0.00 46.02 46.71 2qw4 n GLY 70 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2qw4 h ASP 71 N 0.00 -0.24 -0.99 1.61 3.32 -1.94 -1.20 116.42 116.98 2qw4 h ASP 71 Ca 0.42 -0.22 0.20 0.00 0.02 0.00 0.00 57.03 57.45 2qw4 h ASP 71 Cb 0.71 0.06 -0.11 0.00 0.22 0.00 0.00 39.33 40.21 2qw4 h ASP 71 CO -0.82 0.29 0.59 0.58 -1.72 0.00 0.00 179.24 178.15 2qw4 h VAL 72 N -0.98 0.67 -0.37 -1.35 2.07 -1.25 -1.71 116.25 113.33 2qw4 h VAL 72 Ca -0.03 -0.24 -0.13 0.00 0.82 0.00 0.00 66.70 67.11 2qw4 h VAL 72 Cb 0.44 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.10 2qw4 h VAL 72 CO 0.05 0.13 -0.29 -0.61 0.02 0.00 0.00 177.57 176.87 2qw4 h GLN 73 N 0.71 0.85 -0.72 1.57 5.75 0.52 -2.42 115.11 121.37 2qw4 h GLN 73 Ca 0.58 -0.42 0.13 0.00 -0.15 0.00 0.00 58.65 58.79 2qw4 h GLN 73 Cb 0.94 0.00 -0.13 0.00 1.07 0.00 0.00 27.48 29.36 2qw4 h GLN 73 CO -0.40 1.06 -0.29 0.37 -2.65 0.00 0.00 178.83 176.91 2qw4 h GLN 74 N 0.66 -0.08 -0.17 1.69 -0.00 -0.37 -1.00 115.11 115.83 2qw4 h GLN 74 Ca 0.07 0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.73 2qw4 h GLN 74 Cb 0.87 0.02 -0.01 0.00 0.00 0.00 0.00 27.48 28.35 2qw4 h GLN 74 CO 0.08 -0.05 0.11 0.35 0.00 0.00 0.00 178.83 179.31 2qw4 h PHE 75 N -0.08 0.21 -0.12 3.99 3.57 -0.98 -0.46 116.94 123.07 2qw4 h PHE 75 Ca 0.30 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.74 2qw4 h PHE 75 Cb 0.57 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 39.24 2qw4 h PHE 75 CO -0.67 0.13 -0.18 1.88 -2.23 0.00 0.00 178.31 177.24 2qw4 h TYR 76 N 0.22 0.41 -0.49 0.41 0.05 -1.13 -1.75 116.97 114.69 2qw4 h TYR 76 Ca 0.06 -0.14 0.05 0.00 0.05 0.00 0.00 58.73 58.76 2qw4 h TYR 76 Cb -0.02 -0.08 -0.08 0.00 1.01 0.00 0.00 36.73 37.56 2qw4 h TYR 76 CO -0.07 0.79 -0.48 -0.44 -1.05 0.00 0.00 178.16 176.91 2qw4 h ASP 77 N -0.09 -1.66 -0.16 3.88 3.32 -1.04 0.01 116.42 120.68 2qw4 h ASP 77 Ca 0.01 0.23 0.04 0.00 0.02 0.00 0.00 57.03 57.33 2qw4 h ASP 77 Cb 0.75 0.70 -0.07 0.00 0.22 0.00 0.00 39.33 40.93 2qw4 h ASP 77 CO 0.04 -0.30 -0.49 -0.07 -1.72 0.00 0.00 179.24 176.70 2qw4 h LEU 78 N -0.25 -1.56 -0.22 1.55 4.07 -0.99 -0.45 115.31 117.47 2qw4 h LEU 78 Ca 0.08 0.20 0.03 0.00 0.08 0.00 0.00 57.88 58.27 2qw4 h LEU 78 Cb 0.46 0.62 -0.05 0.00 1.08 0.00 0.00 40.66 42.78 2qw4 h LEU 78 CO -0.59 -0.46 -0.36 -0.07 -1.08 0.00 0.00 178.44 175.89 2qw4 h LEU 79 N -0.53 -1.18 -1.91 1.67 4.07 -0.89 -2.49 115.31 114.04 2qw4 h LEU 79 Ca 0.06 0.15 -0.02 0.00 0.08 0.00 0.00 57.88 58.15 2qw4 h LEU 79 Cb 0.66 0.48 -0.00 0.00 1.08 0.00 0.00 40.66 42.87 2qw4 h LEU 79 CO -0.44 -0.27 -0.10 0.77 -1.08 0.00 0.00 178.44 177.32 2qw4 h SER 80 N -0.29 0.00 0.16 -0.43 4.64 -0.82 -1.27 113.55 115.54 2qw4 h SER 80 Ca 0.04 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.21 2qw4 h SER 80 Cb 0.40 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.48 2qw4 h SER 80 CO -0.36 0.10 -0.54 1.23 -0.87 0.00 0.00 176.83 176.39 2qw4 h GLY 81 N 1.04 0.45 1.10 -0.77 0.00 -0.66 -3.12 103.07 101.12 2qw4 h GLY 81 Ca -0.00 -0.52 -0.21 0.00 0.00 0.00 0.00 47.33 46.60 2qw4 h GLY 81 CO 0.01 0.46 -0.78 1.76 0.00 0.00 0.00 176.54 178.00 2qw4 h SER 82 N 0.32 0.85 -1.00 0.19 0.02 -0.85 -3.18 113.55 109.91 2qw4 h SER 82 Ca 0.01 -0.67 0.35 0.00 -0.84 0.00 0.00 61.79 60.64 2qw4 h SER 82 Cb 1.05 -0.26 -0.18 0.00 0.14 0.00 0.00 62.40 63.16 2qw4 h SER 82 CO 0.09 1.39 0.29 0.25 -1.14 0.00 0.00 176.83 177.72 2qw4 h LEU 83 N 0.39 -0.06 -0.14 5.07 5.85 -1.43 0.60 115.31 125.58 2qw4 h LEU 83 Ca -0.07 0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.91 2qw4 h LEU 83 Cb 1.42 0.37 -0.01 0.00 0.37 0.00 0.00 40.66 42.82 2qw4 h LEU 83 CO 0.16 -0.39 0.05 -0.33 -0.34 0.00 0.00 178.44 177.59 2qw4 h GLU 84 N 0.01 0.21 -0.32 1.25 4.39 -1.61 -1.06 114.58 117.45 2qw4 h GLU 84 Ca 0.73 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 60.38 2qw4 h GLU 84 Cb 1.74 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 30.35 2qw4 h GLU 84 CO -0.84 0.30 0.16 0.28 -1.16 0.00 0.00 179.01 177.76 2qw4 h VAL 85 N 0.07 1.15 -0.81 3.13 2.07 -0.08 -2.15 116.25 119.63 2qw4 h VAL 85 Ca 0.05 -0.42 -0.03 0.00 0.82 0.00 0.00 66.70 67.11 2qw4 h VAL 85 Cb 0.17 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 30.74 2qw4 h VAL 85 CO -0.00 0.16 0.37 0.40 0.02 0.00 0.00 177.57 178.51 2qw4 h ILE 86 N 0.39 1.26 -0.43 4.57 2.04 -0.20 -1.23 117.51 123.91 2qw4 h ILE 86 Ca 0.11 -0.74 0.00 0.00 1.00 0.00 0.00 64.86 65.23 2qw4 h ILE 86 Cb 0.10 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.41 2qw4 h ILE 86 CO -0.02 0.31 0.27 -0.09 0.00 0.00 0.00 178.15 178.63 2qw4 h ARG 87 N 1.15 0.57 -0.04 2.37 2.43 -1.01 0.21 114.38 120.06 2qw4 h ARG 87 Ca 0.27 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.35 2qw4 h ARG 87 Cb 0.15 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 2qw4 h ARG 87 CO -0.03 0.40 -0.20 0.87 -1.51 0.00 0.00 179.97 179.50 2qw4 h LYS 88 N 0.57 0.07 -0.13 0.20 1.57 -0.88 -1.04 116.57 116.93 2qw4 h LYS 88 Ca 0.16 -0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.81 2qw4 h LYS 88 Cb -0.03 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.27 2qw4 h LYS 88 CO -0.03 0.27 -0.36 2.35 -0.57 0.00 0.00 179.45 181.11 2qw4 h TRP 89 N 0.06 0.61 -0.63 -1.35 7.01 -0.91 -3.06 115.95 117.68 2qw4 h TRP 89 Ca 0.01 -0.24 0.12 0.00 2.11 0.00 0.00 58.89 60.89 2qw4 h TRP 89 Cb 0.40 -0.11 -0.12 0.00 -2.10 0.00 0.00 29.16 27.23 2qw4 h TRP 89 CO 0.00 0.98 -0.25 0.00 -2.79 0.00 0.00 178.44 176.38 2qw4 h ALA 90 N 0.52 0.21 -0.33 2.65 0.00 0.21 -2.55 119.26 119.96 2qw4 h ALA 90 Ca -0.01 0.22 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 2qw4 h ALA 90 Cb 0.98 0.65 -0.02 0.00 0.00 0.00 0.00 17.79 19.40 2qw4 h ALA 90 CO 0.08 -0.54 0.12 0.93 0.00 0.00 0.00 179.25 179.84 2qw4 h GLU 91 N -0.08 0.46 0.00 0.00 4.39 -1.12 -0.34 114.58 117.89 2qw4 h GLU 91 Ca 0.28 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.92 2qw4 h GLU 91 Cb 0.53 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 2qw4 h GLU 91 CO -0.69 0.40 0.00 1.63 -1.16 0.00 0.00 179.01 179.19 2qw4 n LYS 92 N -4.40 0.86 -2.88 2.33 5.02 -0.97 -4.44 118.16 113.70 2qw4 n LYS 92 Ca 0.02 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.89 2qw4 n LYS 92 Cb 0.14 -1.38 -0.04 0.00 -0.02 0.00 0.00 35.03 33.74 2qw4 n LYS 92 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2qw4 s ILE 93 N -2.00 4.86 0.08 -0.18 1.01 -0.14 -4.72 121.20 120.12 2qw4 s ILE 93 Ca 0.31 1.64 -0.31 0.00 0.00 0.00 0.00 60.65 62.29 2qw4 s ILE 93 Cb 0.14 -4.14 -0.07 0.00 0.01 0.00 0.00 42.46 38.40 2qw4 s ILE 93 CO 0.24 -0.00 1.42 -2.84 0.00 0.00 0.00 174.94 173.76 2qw4 s PRO 94 N 2.35 4.30 0.00 2.79 0.02 -1.26 -1.14 135.00 142.05 2qw4 s PRO 94 Ca 0.38 2.08 0.00 0.00 0.02 0.00 0.00 61.00 63.48 2qw4 s PRO 94 Cb -0.16 -3.37 0.00 0.00 0.02 0.00 0.00 34.50 30.99 2qw4 s PRO 94 CO 0.11 -0.51 0.00 0.41 -0.33 0.00 0.00 177.00 176.68 2qw4 n GLY 95 N 3.59 2.94 0.21 0.52 0.00 -1.26 -4.91 105.19 106.27 2qw4 n GLY 95 Ca 0.12 -0.23 -0.05 0.00 0.00 0.00 0.00 46.02 45.86 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 0.54 0.00 1.61 3.57 -1.42 0.42 116.94 121.66 2qw4 h PHE 96 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 2qw4 h PHE 96 Cb 0.00 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 38.57 2qw4 h PHE 96 CO 0.00 0.30 0.00 0.00 -2.23 0.00 0.00 178.31 176.38 2qw4 n ALA 97 N -2.28 1.81 0.22 2.41 0.00 -1.26 -2.66 120.51 118.74 2qw4 n ALA 97 Ca 0.04 -0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.53 2qw4 n ALA 97 Cb 0.09 -1.27 0.24 0.00 0.00 0.00 0.00 19.45 18.51 2qw4 n ALA 97 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2qw4 n GLU 98 N -1.41 2.54 -2.47 0.00 4.71 0.13 -4.92 120.64 119.21 2qw4 n GLU 98 Ca 0.06 -2.33 -0.24 0.00 -0.01 0.00 0.00 57.16 54.64 2qw4 n GLU 98 Cb 0.17 -1.52 0.05 0.00 -1.01 0.00 0.00 31.44 29.12 2qw4 n GLU 98 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 2qw4 s LEU 99 N -1.40 3.11 0.59 -4.62 1.43 -1.09 -5.05 118.68 111.65 2qw4 s LEU 99 Ca 0.41 0.26 -0.18 0.00 -1.03 0.00 0.00 54.13 53.58 2qw4 s LEU 99 Cb 0.23 -3.04 -0.03 0.00 0.03 0.00 0.00 46.19 43.38 2qw4 s LEU 99 CO 0.32 -1.29 1.14 -0.94 0.23 0.00 0.00 176.35 175.81 2qw4 s SER 100 N -4.44 5.40 0.47 2.29 1.04 -1.26 -4.79 113.70 112.42 2qw4 s SER 100 Ca 0.58 2.15 0.19 0.00 0.48 0.00 0.00 55.95 59.35 2qw4 s SER 100 Cb -0.10 -2.57 1.20 0.00 0.10 0.00 0.00 66.02 64.64 2qw4 s SER 100 CO 0.41 -1.43 1.97 -0.65 0.98 0.00 0.00 173.24 174.52 2qw4 h PRO 101 N 0.73 0.22 -0.09 4.02 0.11 -1.97 -0.37 132.00 134.66 2qw4 h PRO 101 Ca -0.49 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 2qw4 h PRO 101 Cb 1.26 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 2qw4 h PRO 101 CO 0.55 0.15 -0.04 0.00 -0.21 0.00 0.00 178.00 178.45 2qw4 h ALA 102 N 1.70 0.13 -0.57 -0.75 0.00 -1.99 -1.20 119.26 116.59 2qw4 h ALA 102 Ca 0.29 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 2qw4 h ALA 102 Cb 0.83 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 2qw4 h ALA 102 CO -0.06 -0.10 0.34 -0.44 0.00 0.00 0.00 179.25 178.99 2qw4 h ASP 103 N -0.16 0.67 -0.08 0.00 5.19 -1.73 0.32 116.42 120.63 2qw4 h ASP 103 Ca 0.02 -0.03 -0.01 0.00 -0.62 0.00 0.00 57.03 56.39 2qw4 h ASP 103 Cb 0.49 -0.17 -0.00 0.00 0.18 0.00 0.00 39.33 39.83 2qw4 h ASP 103 CO 0.01 0.52 0.01 1.56 -3.12 0.00 0.00 179.24 178.22 2qw4 h GLN 104 N 0.78 0.14 -0.84 3.56 4.20 -1.00 -0.20 115.11 121.75 2qw4 h GLN 104 Ca 0.21 -0.04 0.03 0.00 0.06 0.00 0.00 58.65 58.90 2qw4 h GLN 104 Cb -0.03 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.69 2qw4 h GLN 104 CO -0.04 0.38 0.55 -0.44 -0.67 0.00 0.00 178.83 178.61 2qw4 h ASP 105 N -0.12 0.91 0.09 1.46 3.32 -0.72 -0.90 116.42 120.46 2qw4 h ASP 105 Ca 0.02 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 2qw4 h ASP 105 Cb 0.32 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.66 2qw4 h ASP 105 CO 0.00 0.63 -0.04 0.25 -1.72 0.00 0.00 179.24 178.36 2qw4 h LEU 106 N 1.07 -0.10 -0.19 1.55 5.85 -0.15 0.12 115.31 123.46 2qw4 h LEU 106 Ca 0.33 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 59.01 2qw4 h LEU 106 Cb -0.01 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 2qw4 h LEU 106 CO -0.11 -0.02 0.12 -0.07 -0.34 0.00 0.00 178.44 178.03 2qw4 h LEU 107 N -0.18 0.22 0.02 2.25 3.38 -0.93 -1.77 115.31 118.30 2qw4 h LEU 107 Ca -0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2qw4 h LEU 107 Cb 0.15 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 2qw4 h LEU 107 CO 0.02 0.17 -0.02 -0.07 0.09 0.00 0.00 178.44 178.63 2qw4 h LEU 108 N 0.25 -0.05 -1.92 1.67 3.38 -0.97 -2.41 115.31 115.26 2qw4 h LEU 108 Ca 0.07 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 2qw4 h LEU 108 Cb -0.02 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 2qw4 h LEU 108 CO -0.01 -0.03 -0.12 -0.33 0.09 0.00 0.00 178.44 178.04 2qw4 h GLU 109 N -0.04 0.00 -0.00 1.13 5.08 -0.65 -2.00 114.58 118.10 2qw4 h GLU 109 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2qw4 h GLU 109 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 2qw4 h GLU 109 CO -0.00 0.12 -0.50 0.43 -1.00 0.00 0.00 179.01 178.05 2qw4 n SER 110 N -3.89 0.60 -0.00 1.42 7.64 -0.68 -4.16 113.62 114.55 2qw4 n SER 110 Ca -0.02 -0.38 0.04 0.00 1.01 0.00 0.00 58.87 59.52 2qw4 n SER 110 Cb 0.21 0.28 -0.06 0.00 -1.01 0.00 0.00 64.21 63.64 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 -1.39 2.66 0.08 -0.43 0.00 -0.91 -4.81 120.51 115.70 2qw4 n ALA 111 Ca 0.06 -0.23 -0.16 0.00 0.00 0.00 0.00 53.44 53.12 2qw4 n ALA 111 Cb 0.34 -0.31 -0.10 0.00 0.00 0.00 0.00 19.45 19.38 2qw4 n ALA 111 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2qw4 h PHE 112 N 0.00 -1.53 0.02 0.00 3.57 -1.54 0.25 116.94 117.71 2qw4 h PHE 112 Ca 0.00 0.05 0.03 0.00 3.53 0.00 0.00 57.97 61.58 2qw4 h PHE 112 Cb 0.33 0.66 -0.05 0.00 2.79 0.00 0.00 35.95 39.69 2qw4 h PHE 112 CO 0.00 -0.57 -0.31 1.25 -2.23 0.00 0.00 178.31 176.45 2qw4 h LEU 113 N -0.70 -0.91 -0.44 0.59 5.85 -1.87 0.69 115.31 118.53 2qw4 h LEU 113 Ca 0.00 0.12 0.09 0.00 0.84 0.00 0.00 57.88 58.93 2qw4 h LEU 113 Cb 0.72 0.36 -0.09 0.00 0.37 0.00 0.00 40.66 42.03 2qw4 h LEU 113 CO -0.32 -0.38 -0.15 -0.33 -0.34 0.00 0.00 178.44 176.92 2qw4 h GLU 114 N -0.47 -0.05 -0.04 1.25 5.08 -1.78 -0.66 114.58 117.90 2qw4 h GLU 114 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2qw4 h GLU 114 Cb 0.55 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.81 2qw4 h GLU 114 CO -0.24 -0.04 0.03 -0.07 -1.00 0.00 0.00 179.01 177.69 2qw4 h LEU 115 N -0.06 0.05 -0.35 1.33 3.38 0.51 0.18 115.31 120.34 2qw4 h LEU 115 Ca 0.21 -0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.23 2qw4 h LEU 115 Cb 0.38 -0.01 -0.09 0.00 0.09 0.00 0.00 40.66 41.03 2qw4 h LEU 115 CO -0.48 0.06 -0.39 0.15 0.09 0.00 0.00 178.44 177.86 2qw4 h PHE 116 N 0.03 -1.13 0.37 1.13 3.57 0.64 0.60 116.94 122.15 2qw4 h PHE 116 Ca 0.01 0.06 -0.00 0.00 3.53 0.00 0.00 57.97 61.57 2qw4 h PHE 116 Cb 0.02 0.55 -0.03 0.00 2.79 0.00 0.00 35.95 39.28 2qw4 h PHE 116 CO -0.07 -0.43 -0.43 0.82 -2.23 0.00 0.00 178.31 175.97 2qw4 h ILE 117 N -0.33 0.14 0.06 1.41 2.04 -0.86 0.15 117.51 120.11 2qw4 h ILE 117 Ca 0.14 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.02 2qw4 h ILE 117 Cb 0.58 0.14 -0.04 0.00 -0.74 0.00 0.00 36.82 36.75 2qw4 h ILE 117 CO -0.53 0.00 -0.25 0.25 0.00 0.00 0.00 178.15 177.62 2qw4 h LEU 118 N -0.83 -0.74 0.17 1.44 5.85 -0.86 0.91 115.31 121.25 2qw4 h LEU 118 Ca -0.03 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 2qw4 h LEU 118 Cb 0.76 0.29 0.00 0.00 0.37 0.00 0.00 40.66 42.08 2qw4 h LEU 118 CO -0.10 -0.33 -0.09 0.03 -0.34 0.00 0.00 178.44 177.61 2qw4 h ARG 119 N -0.43 -0.23 -0.69 1.25 3.08 -0.86 0.13 114.38 116.63 2qw4 h ARG 119 Ca 0.05 0.02 0.15 0.00 0.07 0.00 0.00 59.98 60.26 2qw4 h ARG 119 Cb 0.48 0.05 -0.11 0.00 0.08 0.00 0.00 29.97 30.47 2qw4 h ARG 119 CO -0.18 -0.15 0.06 1.25 -1.07 0.00 0.00 179.97 179.87 2qw4 h LEU 120 N -0.24 -0.20 -1.19 3.04 5.85 -0.38 -1.05 115.31 121.13 2qw4 h LEU 120 Ca -0.02 0.16 -0.07 0.00 0.84 0.00 0.00 57.88 58.79 2qw4 h LEU 120 Cb 0.18 0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 2qw4 h LEU 120 CO 0.03 -0.11 -0.24 0.00 -0.34 0.00 0.00 178.44 177.78 2qw4 h ALA 121 N 1.62 1.33 -0.18 1.25 0.00 0.18 -2.88 119.26 120.58 2qw4 h ALA 121 Ca 0.38 -0.29 -0.18 0.00 0.00 0.00 0.00 54.91 54.81 2qw4 h ALA 121 Cb 0.64 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 2qw4 h ALA 121 CO -0.56 0.46 -0.63 -0.92 0.00 0.00 0.00 179.25 177.60 2qw4 h TYR 122 N 0.23 0.83 0.00 0.00 3.20 0.56 -3.24 116.97 118.55 2qw4 h TYR 122 Ca 0.04 -0.32 0.00 0.00 3.14 0.00 0.00 58.73 61.58 2qw4 h TYR 122 Cb 0.56 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.68 2qw4 h TYR 122 CO 0.01 1.10 -0.61 2.89 -1.64 0.00 0.00 178.16 179.91 2qw4 n ARG 123 N -3.94 0.17 -2.78 1.82 1.85 -1.02 -4.96 116.66 107.80 2qw4 n ARG 123 Ca -0.04 0.04 -0.36 0.00 -1.00 0.00 0.00 57.85 56.49 2qw4 n ARG 123 Cb 0.66 -1.59 -0.06 0.00 -1.05 0.00 0.00 32.46 30.41 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 -3.66 7.20 -0.83 2.89 0.01 -1.10 -4.81 113.70 113.40 2qw4 s SER 124 Ca 0.08 1.80 -0.06 0.00 1.31 0.00 0.00 55.95 59.08 2qw4 s SER 124 Cb 0.15 -2.57 0.21 0.00 0.21 0.00 0.00 66.02 64.03 2qw4 s SER 124 CO 0.72 -0.17 0.72 -0.54 0.41 0.00 0.00 173.24 174.38 2qw4 s LYS 125 N -2.39 3.28 0.57 12.44 1.02 -0.64 -4.90 119.74 129.12 2qw4 s LYS 125 Ca 0.54 -2.84 0.26 0.00 0.02 0.00 0.00 55.97 53.95 2qw4 s LYS 125 Cb -0.16 -4.09 1.67 0.00 -0.52 0.00 0.00 37.83 34.72 2qw4 s LYS 125 CO 0.21 -1.24 2.22 -1.00 -0.92 0.00 0.00 175.35 174.62 2qw4 h PRO 126 N 6.86 0.00 0.10 -1.68 0.13 -1.93 -2.05 132.00 133.44 2qw4 h PRO 126 Ca 0.10 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.22 2qw4 h PRO 126 Cb 0.92 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.05 2qw4 h PRO 126 CO 0.81 0.00 -0.06 0.78 -0.23 0.00 0.00 178.00 179.30 2qw4 h GLY 127 N 0.02 -0.41 1.01 1.56 0.00 -1.92 -2.93 103.07 100.40 2qw4 h GLY 127 Ca -0.00 0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.50 2qw4 h GLY 127 CO 0.00 -0.15 0.00 1.18 0.00 0.00 0.00 176.54 177.57 2qw4 n GLU 128 N -2.55 0.13 -1.81 4.80 1.02 -1.05 -4.79 120.64 116.39 2qw4 n GLU 128 Ca -0.02 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.04 2qw4 n GLU 128 Cb 0.07 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 29.97 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 -0.74 0.42 3.51 0.62 0.00 -1.01 -4.95 105.19 103.03 2qw4 n GLY 129 Ca 0.03 -0.56 -0.34 0.00 0.00 0.00 0.00 46.02 45.14 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 -3.78 3.72 -0.06 1.61 1.02 -0.80 -0.04 119.74 121.41 2qw4 s LYS 130 Ca 0.00 -0.47 -0.04 0.00 0.02 0.00 0.00 55.97 55.48 2qw4 s LYS 130 Cb 0.00 -3.07 -0.04 0.00 -0.52 0.00 0.00 37.83 34.20 2qw4 s LYS 130 CO 0.00 0.14 0.12 -0.51 -0.92 0.00 0.00 175.35 174.18 2qw4 s LEU 131 N 0.67 4.18 -0.11 3.17 1.43 0.30 -1.61 118.68 126.70 2qw4 s LEU 131 Ca 0.00 0.33 -0.01 0.00 -1.03 0.00 0.00 54.13 53.42 2qw4 s LEU 131 Cb -0.14 -2.24 0.03 0.00 0.03 0.00 0.00 46.19 43.87 2qw4 s LEU 131 CO 0.02 0.33 -0.05 -0.63 0.23 0.00 0.00 176.35 176.26 2qw4 s ILE 132 N -1.13 0.85 0.39 -0.59 1.01 -1.26 -1.41 121.20 119.06 2qw4 s ILE 132 Ca 0.20 -0.23 0.01 0.00 0.00 0.00 0.00 60.65 60.62 2qw4 s ILE 132 Cb -0.12 -0.94 -0.02 0.00 0.01 0.00 0.00 42.46 41.39 2qw4 s ILE 132 CO 0.10 0.29 0.60 -0.36 0.00 0.00 0.00 174.94 175.57 2qw4 s PHE 133 N 1.77 3.37 -1.46 3.97 0.40 0.35 -4.71 117.98 121.66 2qw4 s PHE 133 Ca 0.04 0.28 0.24 0.00 -0.60 0.00 0.00 56.93 56.89 2qw4 s PHE 133 Cb -0.13 -2.08 1.23 0.00 0.51 0.00 0.00 43.02 42.56 2qw4 s PHE 133 CO -0.07 -0.09 1.80 0.00 0.70 0.00 0.00 175.22 177.56 2qw4 n SER 135 N -1.27 3.11 0.00 0.00 3.41 -1.26 -4.36 113.62 113.25 2qw4 n SER 135 Ca 0.12 -2.44 0.00 0.00 -0.26 0.00 0.00 58.87 56.29 2qw4 n SER 135 Cb 0.19 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.54 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 0.05 0.01 3.74 5.00 0.00 -0.84 -4.84 105.19 108.32 2qw4 n GLY 136 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 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 4.47 -0.17 0.99 2.96 -1.22 -0.40 118.68 125.30 2qw4 s LEU 137 Ca 0.00 2.26 -0.02 0.00 -0.22 0.00 0.00 54.13 56.15 2qw4 s LEU 137 Cb 0.00 -3.61 -0.01 0.00 0.50 0.00 0.00 46.19 43.06 2qw4 s LEU 137 CO 0.00 -0.34 -0.07 -0.69 -1.32 0.00 0.00 176.35 173.93 2qw4 s VAL 138 N -0.31 3.35 -0.03 1.68 1.01 -0.78 -0.50 120.40 124.81 2qw4 s VAL 138 Ca 0.51 -0.53 0.04 0.00 0.00 0.00 0.00 61.98 62.00 2qw4 s VAL 138 Cb -0.33 -2.47 -0.00 0.00 0.00 0.00 0.00 36.38 33.57 2qw4 s VAL 138 CO 0.38 0.47 -0.15 -0.76 0.00 0.00 0.00 175.10 175.05 2qw4 s LEU 139 N 0.85 1.91 0.26 3.92 1.02 -0.50 -3.68 118.68 122.46 2qw4 s LEU 139 Ca -0.02 -0.31 -0.30 0.00 0.02 0.00 0.00 54.13 53.53 2qw4 s LEU 139 Cb -0.15 -0.85 -0.09 0.00 0.02 0.00 0.00 46.19 45.11 2qw4 s LEU 139 CO 0.01 0.14 1.04 -2.28 0.02 0.00 0.00 176.35 175.28 2qw4 s HIS 140 N -0.00 3.74 0.00 0.29 5.65 -1.26 -0.54 115.29 123.16 2qw4 s HIS 140 Ca -0.02 1.79 0.00 0.00 0.25 0.00 0.00 55.06 57.08 2qw4 s HIS 140 Cb -0.10 -3.17 0.00 0.00 -1.18 0.00 0.00 32.58 28.14 2qw4 s HIS 140 CO 0.01 -0.15 0.00 -2.13 -0.65 0.00 0.00 174.74 171.82 2qw4 n ARG 141 N 1.32 0.00 -0.02 2.88 0.63 0.94 0.83 116.66 123.24 2qw4 n ARG 141 Ca -0.01 0.00 0.13 0.00 -0.92 0.00 0.00 57.85 57.05 2qw4 n ARG 141 Cb 0.46 0.00 0.57 0.00 0.45 0.00 0.00 32.46 33.94 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 -2.96 1.13 -0.10 6.15 4.77 -1.26 -0.94 117.00 123.79 2qw4 n LEU 142 Ca 0.00 -0.41 -0.23 0.00 -0.03 0.00 0.00 56.01 55.34 2qw4 n LEU 142 Cb 0.00 -0.03 -0.12 0.00 -2.33 0.00 0.00 43.42 40.95 2qw4 n LEU 142 CO 0.00 0.21 -0.82 0.00 -1.33 0.00 0.00 177.39 175.45 2qw4 n GLN 143 N -0.09 0.61 0.20 3.23 6.02 0.24 -4.34 117.38 123.24 2qw4 n GLN 143 Ca 0.19 0.44 0.09 0.00 -0.01 0.00 0.00 57.00 57.71 2qw4 n GLN 143 Cb 0.28 -1.67 0.63 0.00 1.02 0.00 0.00 30.24 30.49 2qw4 n GLN 143 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2qw4 n ALA 145 N -2.55 1.09 0.03 0.00 0.00 -0.12 -0.82 120.51 118.15 2qw4 n ALA 145 Ca -0.01 0.10 -0.17 0.00 0.00 0.00 0.00 53.44 53.36 2qw4 n ALA 145 Cb 0.16 -1.18 -0.14 0.00 0.00 0.00 0.00 19.45 18.29 2qw4 n ALA 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qw4 h ARG 146 N 0.00 0.22 0.00 0.00 3.08 -1.54 -0.97 114.38 115.16 2qw4 h ARG 146 Ca 0.00 -0.38 -0.06 0.00 0.07 0.00 0.00 59.98 59.61 2qw4 h ARG 146 Cb 0.03 0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 2qw4 h ARG 146 CO 0.00 1.05 -0.34 0.78 -1.07 0.00 0.00 179.97 180.38 2qw4 h GLY 147 N 1.78 0.00 1.28 0.04 0.00 -1.57 -3.41 103.07 101.20 2qw4 h GLY 147 Ca -0.31 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 46.75 2qw4 h GLY 147 CO 0.13 0.00 -1.13 0.74 0.00 0.00 0.00 176.54 176.28 2qw4 h PHE 148 N -1.00 0.96 -0.05 5.60 -1.00 -1.17 -3.48 116.94 116.79 2qw4 h PHE 148 Ca -0.09 -0.56 0.00 0.00 2.81 0.00 0.00 57.97 60.12 2qw4 h PHE 148 Cb 1.07 -0.09 0.00 0.00 3.61 0.00 0.00 35.95 40.54 2qw4 h PHE 148 CO 0.23 1.40 0.00 0.41 -1.61 0.00 0.00 178.31 178.74 2qw4 n GLY 149 N 1.22 -0.69 0.45 -1.45 0.00 -0.37 -3.79 105.19 100.56 2qw4 n GLY 149 Ca -0.12 -1.15 0.30 0.00 0.00 0.00 0.00 46.02 45.06 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 4.39 0.30 -0.79 1.61 5.19 -1.96 -2.32 116.42 122.86 2qw4 h ASP 150 Ca 0.00 0.09 0.07 0.00 -0.62 0.00 0.00 57.03 56.57 2qw4 h ASP 150 Cb 0.00 0.05 -0.10 0.00 0.18 0.00 0.00 39.33 39.46 2qw4 h ASP 150 CO 0.00 -0.02 -0.48 -0.25 -3.12 0.00 0.00 179.24 175.37 2qw4 h TRP 151 N 0.22 -1.55 -0.99 4.55 7.01 -1.96 -2.42 115.95 120.82 2qw4 h TRP 151 Ca 0.68 0.10 0.32 0.00 2.11 0.00 0.00 58.89 62.10 2qw4 h TRP 151 Cb 2.04 0.78 -0.15 0.00 -2.10 0.00 0.00 29.16 29.73 2qw4 h TRP 151 CO -0.00 -0.31 0.52 0.97 -2.79 0.00 0.00 178.44 176.82 2qw4 h ILE 152 N -0.03 0.28 -0.64 2.65 6.09 -1.64 1.12 117.51 125.35 2qw4 h ILE 152 Ca 0.13 -0.10 -0.01 0.00 -1.37 0.00 0.00 64.86 63.51 2qw4 h ILE 152 Cb 0.35 -0.03 -0.03 0.00 0.47 0.00 0.00 36.82 37.58 2qw4 h ILE 152 CO -0.75 0.05 0.37 0.44 -3.07 0.00 0.00 178.15 175.19 2qw4 h ASP 153 N 0.29 0.76 -0.76 2.19 3.32 -1.63 0.48 116.42 121.07 2qw4 h ASP 153 Ca 0.72 -0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.67 2qw4 h ASP 153 Cb 1.63 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.95 2qw4 h ASP 153 CO -0.63 0.60 0.27 0.28 -1.72 0.00 0.00 179.24 178.04 2qw4 h SER 154 N 0.88 1.08 -0.51 6.45 0.02 0.12 -0.05 113.55 121.54 2qw4 h SER 154 Ca 0.23 -0.19 -0.01 0.00 -0.84 0.00 0.00 61.79 60.98 2qw4 h SER 154 Cb -0.02 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.22 2qw4 h SER 154 CO -0.04 0.98 0.27 0.40 -1.14 0.00 0.00 176.83 177.30 2qw4 h ILE 155 N 1.12 1.18 -0.24 3.27 2.04 -0.59 -2.34 117.51 121.96 2qw4 h ILE 155 Ca 0.25 -0.47 -0.17 0.00 1.00 0.00 0.00 64.86 65.47 2qw4 h ILE 155 Cb 0.27 0.56 -0.00 0.00 -0.74 0.00 0.00 36.82 36.91 2qw4 h ILE 155 CO -0.01 0.19 -0.55 -0.07 0.00 0.00 0.00 178.15 177.71 2qw4 h LEU 156 N 0.68 0.80 -0.58 1.44 3.38 -0.45 0.82 115.31 121.40 2qw4 h LEU 156 Ca 0.18 -0.43 0.09 0.00 0.09 0.00 0.00 57.88 57.81 2qw4 h LEU 156 Cb 0.07 -0.23 -0.11 0.00 0.09 0.00 0.00 40.66 40.48 2qw4 h LEU 156 CO -0.03 1.19 -0.43 0.00 0.09 0.00 0.00 178.44 179.26 2qw4 h ALA 157 N 0.83 -0.32 0.43 1.53 0.00 -0.98 0.19 119.26 120.94 2qw4 h ALA 157 Ca 0.01 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2qw4 h ALA 157 Cb 1.12 0.96 -0.01 0.00 0.00 0.00 0.00 17.79 19.86 2qw4 h ALA 157 CO 0.11 -0.82 -0.30 0.35 0.00 0.00 0.00 179.25 178.58 2qw4 h PHE 158 N -0.23 -0.81 -1.03 0.00 3.57 -1.05 -1.89 116.94 115.51 2qw4 h PHE 158 Ca 0.18 -0.00 0.28 0.00 3.53 0.00 0.00 57.97 61.96 2qw4 h PHE 158 Cb 0.56 0.30 -0.13 0.00 2.79 0.00 0.00 35.95 39.47 2qw4 h PHE 158 CO -0.71 -0.46 0.62 1.03 -2.23 0.00 0.00 178.31 176.56 2qw4 h SER 159 N -0.72 0.56 -0.01 0.41 0.87 -0.43 0.39 113.55 114.62 2qw4 h SER 159 Ca -0.04 0.14 -0.00 0.00 -1.23 0.00 0.00 61.79 60.66 2qw4 h SER 159 Cb 0.61 0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.63 2qw4 h SER 159 CO 0.02 0.01 0.00 -0.09 -0.53 0.00 0.00 176.83 176.24 2qw4 h ARG 160 N 0.44 0.01 -0.12 2.24 2.43 -0.05 -2.92 114.38 116.41 2qw4 h ARG 160 Ca 0.67 -0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.88 2qw4 h ARG 160 Cb 1.50 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 31.01 2qw4 h ARG 160 CO -0.48 0.20 -0.13 1.03 -1.51 0.00 0.00 179.97 179.08 2qw4 h SER 161 N -0.18 -0.40 -0.91 -3.80 0.87 0.46 -0.42 113.55 109.17 2qw4 h SER 161 Ca 0.00 0.08 0.13 0.00 -1.23 0.00 0.00 61.79 60.77 2qw4 h SER 161 Cb 0.19 0.20 -0.14 0.00 -0.44 0.00 0.00 62.40 62.21 2qw4 h SER 161 CO -0.00 -0.17 -0.43 -0.07 -0.53 0.00 0.00 176.83 175.63 2qw4 h LEU 162 N -0.16 -1.57 -0.91 2.23 3.38 -1.11 -2.06 115.31 115.10 2qw4 h LEU 162 Ca 0.09 0.30 -0.08 0.00 0.09 0.00 0.00 57.88 58.28 2qw4 h LEU 162 Cb 0.28 0.78 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 2qw4 h LEU 162 CO -0.22 -0.28 -0.36 0.45 0.09 0.00 0.00 178.44 178.12 2qw4 h HIS 163 N -0.04 0.00 -0.56 1.13 3.86 -1.03 -2.61 115.15 115.89 2qw4 h HIS 163 Ca 0.28 0.00 0.11 0.00 -1.16 0.00 0.00 60.37 59.60 2qw4 h HIS 163 Cb 0.55 0.00 -0.10 0.00 1.06 0.00 0.00 27.41 28.93 2qw4 h HIS 163 CO -0.87 0.36 -0.04 1.03 0.86 0.00 0.00 177.93 179.27 2qw4 h SER 164 N 0.00 -0.32 0.40 2.45 0.87 -0.40 -0.47 113.55 116.07 2qw4 h SER 164 Ca -0.00 0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.70 2qw4 h SER 164 Cb 0.90 0.27 0.00 0.00 -0.44 0.00 0.00 62.40 63.13 2qw4 h SER 164 CO 0.05 -0.12 0.00 0.18 -0.53 0.00 0.00 176.83 176.40 2qw4 n LEU 165 N -5.30 0.00 -4.00 2.23 4.77 -0.99 -4.90 117.00 108.81 2qw4 n LEU 165 Ca 0.07 0.39 -0.30 0.00 -0.03 0.00 0.00 56.01 56.14 2qw4 n LEU 165 Cb 0.31 -0.39 -0.02 0.00 -2.33 0.00 0.00 43.42 40.99 2qw4 n LEU 165 CO 0.12 -0.19 -0.25 0.18 -1.33 0.00 0.00 177.39 175.92 2qw4 n LEU 166 N -1.39 -1.84 -4.66 2.23 4.32 -0.19 -4.87 117.00 110.61 2qw4 n LEU 166 Ca 0.05 -1.10 -0.42 0.00 -0.02 0.00 0.00 56.01 54.52 2qw4 n LEU 166 Cb 0.15 -2.05 -0.03 0.00 -1.62 0.00 0.00 43.42 39.87 2qw4 n LEU 166 CO 0.13 0.49 1.41 -0.69 -1.22 0.00 0.00 177.39 177.51 2qw4 s VAL 167 N -3.91 3.42 0.98 4.08 1.01 -1.25 -4.98 120.40 119.74 2qw4 s VAL 167 Ca 0.14 0.55 -0.15 0.00 0.00 0.00 0.00 61.98 62.52 2qw4 s VAL 167 Cb -0.06 -3.36 0.18 0.00 0.00 0.00 0.00 36.38 33.15 2qw4 s VAL 167 CO 0.92 -0.04 1.19 1.51 0.00 0.00 0.00 175.10 178.67 2qw4 s ASP 168 N 3.46 2.93 0.03 3.32 1.47 -1.26 -4.78 116.67 121.84 2qw4 s ASP 168 Ca 0.76 0.68 -0.25 0.00 1.18 0.00 0.00 52.55 54.92 2qw4 s ASP 168 Cb -0.36 -1.03 -0.17 0.00 -0.34 0.00 0.00 42.92 41.02 2qw4 s ASP 168 CO 0.32 -2.88 1.44 0.58 0.68 0.00 0.00 175.17 175.31 2qw4 h VAL 169 N -1.73 0.92 -1.00 2.11 2.07 -1.99 -1.15 116.25 115.47 2qw4 h VAL 169 Ca -0.47 -0.48 0.14 0.00 0.82 0.00 0.00 66.70 66.71 2qw4 h VAL 169 Cb 1.30 1.21 -0.09 0.00 -1.52 0.00 0.00 31.29 32.18 2qw4 h VAL 169 CO 0.50 0.11 0.62 -0.65 0.02 0.00 0.00 177.57 178.17 2qw4 h PRO 170 N -0.47 0.90 -0.23 1.57 0.11 -1.96 0.19 132.00 132.10 2qw4 h PRO 170 Ca -0.02 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.97 2qw4 h PRO 170 Cb 0.36 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.26 2qw4 h PRO 170 CO 0.04 0.60 -0.10 0.00 -0.21 0.00 0.00 178.00 178.32 2qw4 h ALA 171 N 1.56 0.33 -0.89 -0.75 0.00 -1.90 -1.84 119.26 115.78 2qw4 h ALA 171 Ca 0.52 -0.30 0.05 0.00 0.00 0.00 0.00 54.91 55.18 2qw4 h ALA 171 Cb 0.59 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.24 2qw4 h ALA 171 CO -0.30 0.17 0.56 0.35 0.00 0.00 0.00 179.25 180.04 2qw4 h PHE 172 N 0.20 1.05 -0.78 0.00 3.57 -0.68 0.43 116.94 120.73 2qw4 h PHE 172 Ca 0.05 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.63 2qw4 h PHE 172 Cb 0.60 -0.35 -0.06 0.00 2.79 0.00 0.00 35.95 38.94 2qw4 h PHE 172 CO 0.06 0.57 0.47 0.00 -2.23 0.00 0.00 178.31 177.19 2qw4 h ALA 173 N 1.39 1.05 -0.14 2.41 0.00 -0.18 0.15 119.26 123.94 2qw4 h ALA 173 Ca 0.37 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.18 2qw4 h ALA 173 Cb 0.08 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2qw4 h ALA 173 CO -0.14 0.21 -0.28 0.00 0.00 0.00 0.00 179.25 179.04 2qw4 h LEU 175 N 0.04 0.57 0.15 0.00 7.12 0.14 0.80 115.31 124.13 2qw4 h LEU 175 Ca 0.00 -0.06 -0.30 0.00 0.13 0.00 0.00 57.88 57.65 2qw4 h LEU 175 Cb 0.87 -0.15 0.02 0.00 -0.53 0.00 0.00 40.66 40.88 2qw4 h LEU 175 CO 0.06 0.52 -1.32 0.77 -0.13 0.00 0.00 178.44 178.35 2qw4 h SER 176 N 0.63 0.70 -0.75 1.25 4.64 -0.94 -2.84 113.55 116.24 2qw4 h SER 176 Ca 0.15 -0.71 0.00 0.00 -0.47 0.00 0.00 61.79 60.77 2qw4 h SER 176 Cb 0.13 -0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 61.96 2qw4 h SER 176 CO -0.02 1.54 0.48 0.00 -0.87 0.00 0.00 176.83 177.96 2qw4 h ALA 177 N 0.37 1.43 -0.05 5.18 0.00 -1.26 0.21 119.26 125.14 2qw4 h ALA 177 Ca -0.19 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 2qw4 h ALA 177 Cb 2.01 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 19.49 2qw4 h ALA 177 CO 0.24 0.51 -0.16 -0.07 0.00 0.00 0.00 179.25 179.77 2qw4 h LEU 178 N 1.03 0.07 -0.96 0.00 3.38 -0.84 -0.14 115.31 117.84 2qw4 h LEU 178 Ca 0.27 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 58.13 2qw4 h LEU 178 Cb -0.09 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2qw4 h LEU 178 CO -0.06 0.24 -0.39 0.58 0.09 0.00 0.00 178.44 178.90 2qw4 h VAL 179 N 0.07 1.30 0.07 1.22 2.07 -0.72 -3.29 116.25 116.97 2qw4 h VAL 179 Ca 0.01 -1.46 -0.15 0.00 0.82 0.00 0.00 66.70 65.92 2qw4 h VAL 179 Cb 0.32 1.63 0.02 0.00 -1.52 0.00 0.00 31.29 31.74 2qw4 h VAL 179 CO 0.02 0.44 -0.62 0.25 0.02 0.00 0.00 177.57 177.68 2qw4 h LEU 180 N 0.22 0.43 -7.74 2.57 5.85 -0.88 -3.42 115.31 112.33 2qw4 h LEU 180 Ca 0.02 -0.87 -0.78 0.00 0.84 0.00 0.00 57.88 57.09 2qw4 h LEU 180 Cb 0.78 -0.14 -0.28 0.00 0.37 0.00 0.00 40.66 41.40 2qw4 h LEU 180 CO 0.06 1.26 0.11 -0.63 -0.34 0.00 0.00 178.44 178.90 2qw4 s ILE 181 N -2.75 5.46 0.08 4.05 1.01 -0.15 -4.82 121.20 124.08 2qw4 s ILE 181 Ca -0.14 -2.74 -0.09 0.00 0.00 0.00 0.00 60.65 57.68 2qw4 s ILE 181 Cb 0.01 -4.37 0.00 0.00 0.01 0.00 0.00 42.46 38.12 2qw4 s ILE 181 CO 0.81 -1.04 0.20 0.28 0.00 0.00 0.00 174.94 175.18 2qw4 s THR 182 N -0.16 0.13 0.13 2.92 -1.32 -1.26 -4.64 115.64 111.43 2qw4 s THR 182 Ca 0.20 -1.08 -0.31 0.00 -1.21 0.00 0.00 61.69 59.29 2qw4 s THR 182 Cb -0.11 -1.22 -0.10 0.00 -1.51 0.00 0.00 72.50 69.56 2qw4 s THR 182 CO -0.08 -0.60 1.79 -0.62 -2.21 0.00 0.00 174.62 172.90 2qw4 s ASP 183 N -2.65 6.44 0.08 8.08 3.68 -1.26 -5.00 116.67 126.05 2qw4 s ASP 183 Ca 0.02 2.74 0.07 0.00 2.13 0.00 0.00 52.55 57.51 2qw4 s ASP 183 Cb 0.03 -2.57 -0.03 0.00 -1.45 0.00 0.00 42.92 38.90 2qw4 s ASP 183 CO -0.09 -0.98 -0.18 -0.13 0.13 0.00 0.00 175.17 173.92 2qw4 s ARG 184 N 2.50 1.02 0.18 4.34 1.81 -1.26 -5.11 118.95 122.43 2qw4 s ARG 184 Ca 0.79 -1.05 -0.31 0.00 -1.72 0.00 0.00 55.73 53.44 2qw4 s ARG 184 Cb -0.46 -1.17 -0.11 0.00 -0.45 0.00 0.00 34.95 32.77 2qw4 s ARG 184 CO 0.35 0.27 1.60 -1.58 -0.68 0.00 0.00 175.30 175.26 2qw4 s HIS 185 N -1.16 3.01 0.00 -0.53 5.65 -1.26 -2.73 115.29 118.27 2qw4 s HIS 185 Ca 0.03 0.59 0.00 0.00 0.25 0.00 0.00 55.06 55.93 2qw4 s HIS 185 Cb -0.10 -3.98 0.00 0.00 -1.18 0.00 0.00 32.58 27.33 2qw4 s HIS 185 CO 0.03 -3.59 0.00 0.41 -0.65 0.00 0.00 174.74 170.95 2qw4 n GLY 186 N 3.65 0.84 3.71 1.59 0.00 -1.26 -5.05 105.19 108.66 2qw4 n GLY 186 Ca 0.14 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 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 4.38 0.32 0.99 1.43 -1.10 -4.93 118.68 119.77 2qw4 s LEU 187 Ca 0.00 1.74 0.10 0.00 -1.03 0.00 0.00 54.13 54.94 2qw4 s LEU 187 Cb 0.00 -3.57 0.55 0.00 0.03 0.00 0.00 46.19 43.19 2qw4 s LEU 187 CO 0.00 -0.28 1.73 1.56 0.23 0.00 0.00 176.35 179.59 2qw4 h GLN 188 N 6.67 0.07 -2.06 1.70 4.20 -1.97 -3.32 115.11 120.40 2qw4 h GLN 188 Ca -0.41 -0.03 -0.51 0.00 0.06 0.00 0.00 58.65 57.75 2qw4 h GLN 188 Cb 1.22 -0.00 -0.41 0.00 0.30 0.00 0.00 27.48 28.59 2qw4 h GLN 188 CO 0.76 0.51 -1.01 0.39 -0.67 0.00 0.00 178.83 178.81 2qw4 n GLU 189 N -4.00 1.75 -0.36 1.46 1.02 -1.26 -4.97 120.64 114.29 2qw4 n GLU 189 Ca -0.02 -3.88 0.05 0.00 -0.02 0.00 0.00 57.16 53.30 2qw4 n GLU 189 Cb 0.48 -1.88 0.13 0.00 -0.02 0.00 0.00 31.44 30.15 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 2.99 -0.00 0.00 3.49 0.11 -1.97 -1.22 132.00 135.40 2qw4 h PRO 190 Ca 0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.22 2qw4 h PRO 190 Cb 0.82 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.93 2qw4 h PRO 190 CO 0.61 -0.00 0.00 -0.09 -0.21 0.00 0.00 178.00 178.31 2qw4 h ARG 191 N -0.00 0.00 0.16 1.05 9.65 -1.95 -1.07 114.38 122.23 2qw4 h ARG 191 Ca 0.46 0.00 -0.31 0.00 -1.10 0.00 0.00 59.98 59.03 2qw4 h ARG 191 Cb 0.71 0.00 0.01 0.00 -1.39 0.00 0.00 29.97 29.30 2qw4 h ARG 191 CO -1.01 0.00 -1.55 -0.09 2.80 0.00 0.00 179.97 180.12 2qw4 h ARG 192 N 0.00 0.35 -0.76 0.20 2.43 -1.66 -2.04 114.38 112.90 2qw4 h ARG 192 Ca 0.00 -0.60 -0.04 0.00 -0.81 0.00 0.00 59.98 58.53 2qw4 h ARG 192 Cb 0.43 0.22 -0.03 0.00 -0.42 0.00 0.00 29.97 30.17 2qw4 h ARG 192 CO 0.00 1.28 0.32 0.28 -1.51 0.00 0.00 179.97 180.34 2qw4 h VAL 193 N -0.07 1.25 -0.26 0.20 2.07 -1.24 -1.79 116.25 116.42 2qw4 h VAL 193 Ca -0.31 -0.78 0.00 0.00 0.82 0.00 0.00 66.70 66.43 2qw4 h VAL 193 Cb 1.96 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 32.06 2qw4 h VAL 193 CO 0.14 0.32 0.16 -0.08 0.02 0.00 0.00 177.57 178.13 2qw4 h GLU 194 N 1.10 0.34 -0.33 1.57 4.81 -1.22 -0.89 114.58 119.96 2qw4 h GLU 194 Ca 0.26 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.42 2qw4 h GLU 194 Cb 0.20 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 2qw4 h GLU 194 CO -0.02 0.26 0.07 1.49 -0.73 0.00 0.00 179.01 180.07 2qw4 h GLU 195 N 0.33 0.53 -0.35 1.92 4.22 -1.19 -1.67 114.58 118.36 2qw4 h GLU 195 Ca 0.09 -0.13 0.05 0.00 0.08 0.00 0.00 59.36 59.45 2qw4 h GLU 195 Cb -0.01 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.13 2qw4 h GLU 195 CO -0.02 0.60 0.08 1.25 -2.18 0.00 0.00 179.01 178.74 2qw4 h LEU 196 N 0.37 0.04 -1.00 1.64 5.85 -0.98 -1.50 115.31 119.72 2qw4 h LEU 196 Ca 0.10 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.92 2qw4 h LEU 196 Cb 0.32 0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.35 2qw4 h LEU 196 CO 0.00 0.06 0.65 -0.61 -0.34 0.00 0.00 178.44 178.20 2qw4 h GLN 197 N 0.21 1.21 0.00 1.25 4.15 -0.92 -1.59 115.11 119.42 2qw4 h GLN 197 Ca 0.17 -0.07 -0.08 0.00 0.77 0.00 0.00 58.65 59.44 2qw4 h GLN 197 Cb 0.18 -0.27 -0.01 0.00 0.21 0.00 0.00 27.48 27.59 2qw4 h GLN 197 CO -0.21 0.80 -0.36 -0.91 -1.93 0.00 0.00 178.83 176.22 2qw4 h ASN 198 N 1.24 0.00 -0.12 -0.69 4.21 -0.34 0.48 115.58 120.36 2qw4 h ASN 198 Ca 0.41 0.00 -0.18 0.00 1.21 0.00 0.00 56.30 57.74 2qw4 h ASN 198 Cb 0.05 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 37.25 2qw4 h ASN 198 CO -0.14 0.36 -0.62 0.03 -1.29 0.00 0.00 177.43 175.78 2qw4 h ARG 199 N 0.00 0.63 -0.33 0.81 3.08 -0.58 -0.18 114.38 117.82 2qw4 h ARG 199 Ca -0.00 -0.52 -0.03 0.00 0.07 0.00 0.00 59.98 59.50 2qw4 h ARG 199 Cb 0.73 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.87 2qw4 h ARG 199 CO 0.05 1.14 0.09 0.82 -1.07 0.00 0.00 179.97 181.00 2qw4 h ILE 200 N 0.29 1.22 -0.34 2.04 2.04 -1.17 -0.66 117.51 120.92 2qw4 h ILE 200 Ca -0.04 -0.71 0.00 0.00 1.00 0.00 0.00 64.86 65.11 2qw4 h ILE 200 Cb 1.26 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 38.37 2qw4 h ILE 200 CO 0.13 0.24 0.22 0.00 0.00 0.00 0.00 178.15 178.74 2qw4 h ALA 201 N 0.93 0.43 -0.01 1.87 0.00 0.04 -0.22 119.26 122.30 2qw4 h ALA 201 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2qw4 h ALA 201 Cb 0.28 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2qw4 h ALA 201 CO -0.00 -0.11 -0.23 -1.13 0.00 0.00 0.00 179.25 177.77 2qw4 n SER 202 N -4.86 1.03 -0.04 0.00 3.41 -0.09 -1.57 113.62 111.51 2qw4 n SER 202 Ca -0.01 -0.91 -0.16 0.00 -0.26 0.00 0.00 58.87 57.53 2qw4 n SER 202 Cb 0.03 0.11 -0.13 0.00 -0.26 0.00 0.00 64.21 63.96 2qw4 n SER 202 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qw4 h LEU 204 N -0.83 -1.49 -0.86 0.00 5.85 -0.94 0.46 115.31 117.49 2qw4 h LEU 204 Ca -0.04 0.18 0.29 0.00 0.84 0.00 0.00 57.88 59.15 2qw4 h LEU 204 Cb 1.17 0.59 -0.16 0.00 0.37 0.00 0.00 40.66 42.63 2qw4 h LEU 204 CO 0.04 -0.47 0.20 0.29 -0.34 0.00 0.00 178.44 178.15 2qw4 n LYS 205 N -5.45 -0.06 0.02 1.25 4.76 -0.61 -0.33 118.16 117.74 2qw4 n LYS 205 Ca -0.06 1.25 -0.07 0.00 -2.87 0.00 0.00 58.31 56.57 2qw4 n LYS 205 Cb 0.38 -2.08 -0.12 0.00 -1.84 0.00 0.00 35.03 31.36 2qw4 n LYS 205 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 2qw4 h GLU 206 N 0.00 0.00 0.39 1.97 4.81 -1.36 -3.26 114.58 117.14 2qw4 h GLU 206 Ca 0.61 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.82 2qw4 h GLU 206 Cb 1.42 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.81 2qw4 h GLU 206 CO -0.75 0.67 -0.19 1.25 -0.73 0.00 0.00 179.01 179.25 2qw4 h HIS 207 N 0.00 -0.49 0.00 0.92 2.76 0.16 -2.70 115.15 115.80 2qw4 h HIS 207 Ca -0.16 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.00 2qw4 h HIS 207 Cb 1.86 0.16 0.00 0.00 1.55 0.00 0.00 27.41 30.98 2qw4 h HIS 207 CO 0.00 -0.31 0.00 1.33 -1.30 0.00 0.00 177.93 177.65 2qw4 n VAL 208 N -3.56 1.55 0.09 5.26 0.24 -0.80 0.46 118.33 121.57 2qw4 n VAL 208 Ca -0.07 0.59 0.01 0.00 -2.04 0.00 0.00 64.34 62.83 2qw4 n VAL 208 Cb 0.21 -1.58 -0.03 0.00 -1.47 0.00 0.00 33.84 30.97 2qw4 n VAL 208 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2qw4 h ALA 209 N 2.02 0.64 -0.09 2.33 0.00 -1.59 -3.27 119.26 119.30 2qw4 h ALA 209 Ca 0.00 -0.64 -0.17 0.00 0.00 0.00 0.00 54.91 54.10 2qw4 h ALA 209 Cb 0.02 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2qw4 h ALA 209 CO 0.00 0.78 -0.66 0.00 0.00 0.00 0.00 179.25 179.37 2qw4 h ALA 210 N 1.44 0.69 -1.36 0.00 0.00 0.35 -3.51 119.26 116.87 2qw4 h ALA 210 Ca -0.07 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.27 2qw4 h ALA 210 Cb 1.49 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2qw4 h ALA 210 CO 0.06 0.74 0.00 0.28 0.00 0.00 0.00 179.25 180.33 2qw4 n VAL 211 N -3.87 0.00 0.00 0.00 0.31 -1.08 -5.14 118.33 108.56 2qw4 n VAL 211 Ca -0.03 0.28 0.00 0.00 -0.01 0.00 0.00 64.34 64.58 2qw4 n VAL 211 Cb 0.66 -0.83 0.00 0.00 -0.91 0.00 0.00 33.84 32.76 2qw4 n VAL 211 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qw4 h LEU 221 N 0.00 0.43 0.00 0.00 5.85 -1.99 -1.29 115.31 118.31 2qw4 h LEU 221 Ca 0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2qw4 h LEU 221 Cb 0.00 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 40.95 2qw4 h LEU 221 CO 0.00 0.26 -0.20 -1.54 -0.34 0.00 0.00 178.44 176.62 2qw4 n SER 222 N -4.48 0.75 0.10 1.25 3.41 -1.26 0.32 113.62 113.72 2qw4 n SER 222 Ca 0.10 0.42 -0.02 0.00 -0.26 0.00 0.00 58.87 59.11 2qw4 n SER 222 Cb 0.35 -0.48 -0.03 0.00 -0.26 0.00 0.00 64.21 63.79 2qw4 n SER 222 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2qw4 h ARG 223 N 0.00 0.00 0.04 4.33 -0.00 -1.69 -1.74 114.38 115.32 2qw4 h ARG 223 Ca 0.00 0.00 -0.00 0.00 -0.50 0.00 0.00 59.98 59.48 2qw4 h ARG 223 Cb 0.73 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.70 2qw4 h ARG 223 CO 0.00 0.73 -0.02 1.25 0.00 0.00 0.00 179.97 181.93 2qw4 h LEU 224 N 0.00 -0.04 -0.36 3.04 5.85 -0.95 -3.17 115.31 119.67 2qw4 h LEU 224 Ca -0.01 -0.59 0.00 0.00 0.84 0.00 0.00 57.88 58.12 2qw4 h LEU 224 Cb 1.54 0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.58 2qw4 h LEU 224 CO 0.09 0.72 0.00 0.18 -0.34 0.00 0.00 178.44 179.09 2qw4 n LEU 225 N -4.73 0.18 0.22 2.25 4.77 0.15 -1.65 117.00 118.19 2qw4 n LEU 225 Ca -0.07 0.57 0.10 0.00 -0.03 0.00 0.00 56.01 56.58 2qw4 n LEU 225 Cb 0.31 -0.58 0.49 0.00 -2.33 0.00 0.00 43.42 41.31 2qw4 n LEU 225 CO 0.24 -0.55 0.82 1.23 -1.33 0.00 0.00 177.39 177.80 2qw4 h GLY 226 N 0.72 0.00 0.99 -0.72 0.00 -1.28 -3.18 103.07 99.59 2qw4 h GLY 226 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2qw4 h GLY 226 CO 0.00 0.00 0.10 0.50 0.00 0.00 0.00 176.54 177.14 2qw4 h LYS 227 N 0.00 0.20 -0.32 4.80 1.79 -1.39 -3.34 116.57 118.30 2qw4 h LYS 227 Ca -0.00 -0.01 0.03 0.00 -2.18 0.00 0.00 60.65 58.49 2qw4 h LYS 227 Cb 0.69 -0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 31.26 2qw4 h LYS 227 CO 0.03 0.15 -0.17 1.28 -1.08 0.00 0.00 179.45 179.65 2qw4 n LEU 228 N -4.98 -0.31 0.18 2.94 4.77 -1.20 0.16 117.00 118.57 2qw4 n LEU 228 Ca -0.04 0.57 0.04 0.00 -0.03 0.00 0.00 56.01 56.55 2qw4 n LEU 228 Cb 0.03 -0.09 0.35 0.00 -2.33 0.00 0.00 43.42 41.38 2qw4 n LEU 228 CO 0.34 -0.48 0.68 -0.65 -1.33 0.00 0.00 177.39 175.95 2qw4 h PRO 229 N 0.00 0.00 -0.54 3.23 0.11 -1.82 -1.81 132.00 131.17 2qw4 h PRO 229 Ca 0.07 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.14 2qw4 h PRO 229 Cb 0.15 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.23 2qw4 h PRO 229 CO -0.31 0.40 0.20 0.93 -0.21 0.00 0.00 178.00 179.02 2qw4 h GLU 230 N 0.00 0.81 -0.70 1.05 5.08 -0.47 -1.61 114.58 118.74 2qw4 h GLU 230 Ca -0.00 -0.16 0.06 0.00 -1.00 0.00 0.00 59.36 58.26 2qw4 h GLU 230 Cb 0.80 -0.13 -0.06 0.00 0.50 0.00 0.00 28.75 29.87 2qw4 h GLU 230 CO 0.05 0.72 0.40 1.25 -1.00 0.00 0.00 179.01 180.44 2qw4 h LEU 231 N 0.73 0.60 -0.66 1.33 5.85 -0.93 -1.03 115.31 121.21 2qw4 h LEU 231 Ca 0.18 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.89 2qw4 h LEU 231 Cb 0.22 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 2qw4 h LEU 231 CO -0.01 0.38 0.27 -0.09 -0.34 0.00 0.00 178.44 178.65 2qw4 h ARG 232 N 0.73 0.98 -0.21 1.25 9.65 -0.90 -1.78 114.38 124.11 2qw4 h ARG 232 Ca 0.31 -0.18 -0.14 0.00 -1.10 0.00 0.00 59.98 58.88 2qw4 h ARG 232 Cb 0.19 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 28.60 2qw4 h ARG 232 CO -0.18 0.82 -0.45 1.79 2.80 0.00 0.00 179.97 184.75 2qw4 h THR 233 N 0.93 1.31 0.00 0.20 1.35 -0.96 -1.94 112.91 113.80 2qw4 h THR 233 Ca 0.22 -1.64 -0.00 0.00 -0.55 0.00 0.00 66.41 64.44 2qw4 h THR 233 Cb 0.20 1.64 -0.00 0.00 -1.73 0.00 0.00 68.15 68.26 2qw4 h THR 233 CO -0.02 0.51 -0.00 0.25 -0.25 0.00 0.00 175.52 176.01 2qw4 h LEU 234 N 0.42 0.00 0.00 3.87 5.85 -0.87 -0.86 115.31 123.71 2qw4 h LEU 234 Ca 0.03 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.67 2qw4 h LEU 234 Cb 0.95 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.97 2qw4 h LEU 234 CO 0.08 0.00 -0.68 0.00 -0.34 0.00 0.00 178.44 177.51 2qw4 h THR 236 N 0.00 1.21 -0.43 0.00 2.02 -0.51 -1.67 112.91 113.53 2qw4 h THR 236 Ca -0.04 -0.67 0.07 0.00 0.77 0.00 0.00 66.41 66.54 2qw4 h THR 236 Cb 1.27 0.54 -0.06 0.00 -1.74 0.00 0.00 68.15 68.17 2qw4 h THR 236 CO 0.03 0.26 0.08 1.56 0.37 0.00 0.00 175.52 177.83 2qw4 h GLN 237 N 0.82 0.21 -0.23 6.66 4.20 -1.34 -2.31 115.11 123.12 2qw4 h GLN 237 Ca 0.19 -0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.92 2qw4 h GLN 237 Cb 0.18 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.88 2qw4 h GLN 237 CO -0.02 0.14 0.03 0.78 -0.67 0.00 0.00 178.83 179.09 2qw4 h GLY 238 N 0.21 0.24 0.06 3.46 0.00 -1.25 -0.47 103.07 105.32 2qw4 h GLY 238 Ca 0.21 -0.00 0.11 0.00 0.00 0.00 0.00 47.33 47.65 2qw4 h GLY 238 CO -0.28 -0.02 -0.02 1.41 0.00 0.00 0.00 176.54 177.64 2qw4 h LEU 239 N 0.11 -0.27 -0.86 3.11 3.38 -1.22 0.19 115.31 119.75 2qw4 h LEU 239 Ca 0.11 0.14 0.17 0.00 0.09 0.00 0.00 57.88 58.39 2qw4 h LEU 239 Cb 0.11 0.25 -0.11 0.00 0.09 0.00 0.00 40.66 41.01 2qw4 h LEU 239 CO -0.15 -0.10 0.41 1.56 0.09 0.00 0.00 178.44 180.25 2qw4 h GLN 240 N 0.10 0.51 -0.11 1.13 4.20 -0.74 0.25 115.11 120.45 2qw4 h GLN 240 Ca 0.28 -0.03 -0.08 0.00 0.06 0.00 0.00 58.65 58.87 2qw4 h GLN 240 Cb 0.43 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.10 2qw4 h GLN 240 CO -0.47 0.34 -0.25 -0.09 -0.67 0.00 0.00 178.83 177.68 2qw4 h ARG 241 N 0.53 0.36 -0.29 1.46 1.12 0.68 -1.87 114.38 116.38 2qw4 h ARG 241 Ca 0.50 -0.25 0.01 0.00 -1.11 0.00 0.00 59.98 59.13 2qw4 h ARG 241 Cb 0.81 0.04 -0.02 0.00 -0.01 0.00 0.00 29.97 30.79 2qw4 h ARG 241 CO -0.43 0.85 0.17 0.82 -3.11 0.00 0.00 179.97 178.27 2qw4 h ILE 242 N -0.08 1.03 -0.25 1.20 2.04 -0.28 -1.01 117.51 120.16 2qw4 h ILE 242 Ca -0.00 -0.12 0.05 0.00 1.00 0.00 0.00 64.86 65.79 2qw4 h ILE 242 Cb 0.86 0.65 -0.08 0.00 -0.74 0.00 0.00 36.82 37.51 2qw4 h ILE 242 CO 0.06 0.06 -0.43 0.15 0.00 0.00 0.00 178.15 177.99 2qw4 h PHE 243 N 0.35 -1.26 -0.22 1.37 3.57 -0.50 -0.39 116.94 119.86 2qw4 h PHE 243 Ca 0.11 0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.72 2qw4 h PHE 243 Cb -0.00 0.59 -0.07 0.00 2.79 0.00 0.00 35.95 39.25 2qw4 h PHE 243 CO -0.08 -0.47 -0.40 -0.92 -2.23 0.00 0.00 178.31 174.22 2qw4 h TYR 244 N -0.43 -1.13 0.00 0.41 3.20 -0.88 1.00 116.97 119.14 2qw4 h TYR 244 Ca 0.10 0.05 -0.00 0.00 3.14 0.00 0.00 58.73 62.02 2qw4 h TYR 244 Cb 0.61 0.53 -0.00 0.00 1.54 0.00 0.00 36.73 39.41 2qw4 h TYR 244 CO -0.55 -0.45 -0.00 -0.07 -1.64 0.00 0.00 178.16 175.44 2qw4 h LEU 245 N -0.42 0.00 0.21 2.82 3.38 -0.90 -0.54 115.31 119.87 2qw4 h LEU 245 Ca 0.10 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.74 2qw4 h LEU 245 Cb 0.60 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.37 2qw4 h LEU 245 CO -0.44 0.00 -1.56 0.50 0.09 0.00 0.00 178.44 177.03 2qw4 h LYS 246 N 0.00 0.45 0.50 1.13 3.64 0.73 -1.63 116.57 121.38 2qw4 h LYS 246 Ca -0.00 -0.77 -0.02 0.00 -1.27 0.00 0.00 60.65 58.59 2qw4 h LYS 246 Cb 0.03 0.29 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 2qw4 h LYS 246 CO 0.00 1.36 -0.24 -0.07 -2.27 0.00 0.00 179.45 178.23 2qw4 h LEU 247 N 0.12 -0.57 -0.73 5.20 3.38 -0.37 -3.25 115.31 119.08 2qw4 h LEU 247 Ca -0.28 0.02 0.10 0.00 0.09 0.00 0.00 57.88 57.81 2qw4 h LEU 247 Cb 2.12 0.15 -0.11 0.00 0.09 0.00 0.00 40.66 42.91 2qw4 h LEU 247 CO 0.23 -0.21 -0.34 1.21 0.09 0.00 0.00 178.44 179.42 2qw4 n GLU 248 N -4.90 -0.23 -2.47 1.13 4.07 -0.26 -4.95 120.64 113.03 2qw4 n GLU 248 Ca -0.08 1.12 -0.01 0.00 -0.06 0.00 0.00 57.16 58.12 2qw4 n GLU 248 Cb 0.26 -1.66 0.00 0.00 -0.06 0.00 0.00 31.44 29.99 2qw4 n GLU 248 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 2qw4 n ASP 249 N -5.02 -6.71 0.03 4.31 -0.08 -0.61 -5.06 116.55 103.42 2qw4 n ASP 249 Ca 0.05 0.96 -0.01 0.00 -1.51 0.00 0.00 54.79 54.28 2qw4 n ASP 249 Cb 0.25 -4.41 -0.00 0.00 2.34 0.00 0.00 41.12 39.30 2qw4 n ASP 249 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2qw4 n LEU 250 N 0.34 1.18 -4.90 -2.67 4.77 -1.26 -5.02 117.00 109.43 2qw4 n LEU 250 Ca 0.02 0.16 -0.35 0.00 -0.03 0.00 0.00 56.01 55.81 2qw4 n LEU 250 Cb 0.09 -0.38 -0.05 0.00 -2.33 0.00 0.00 43.42 40.75 2qw4 n LEU 250 CO 0.36 -0.66 -0.16 0.68 -1.33 0.00 0.00 177.39 176.27 2qw4 s VAL 251 N -2.11 5.46 0.20 4.08 -7.23 -1.26 -4.99 120.40 114.55 2qw4 s VAL 251 Ca -0.04 -0.03 -0.31 0.00 -1.81 0.00 0.00 61.98 59.79 2qw4 s VAL 251 Cb 0.01 -3.50 -0.10 0.00 0.56 0.00 0.00 36.38 33.35 2qw4 s VAL 251 CO 0.05 0.42 1.55 -2.84 -0.31 0.00 0.00 175.10 173.98 2qw4 s PRO 252 N -1.64 4.21 0.40 4.82 0.02 -1.26 -4.99 135.00 136.56 2qw4 s PRO 252 Ca 0.23 2.38 -0.25 0.00 0.02 0.00 0.00 61.00 63.38 2qw4 s PRO 252 Cb -0.12 -3.13 -0.08 0.00 0.02 0.00 0.00 34.50 31.19 2qw4 s PRO 252 CO 0.14 -0.57 1.17 -1.25 -0.33 0.00 0.00 177.00 176.15 2qw4 s PRO 253 N 0.62 4.07 -0.02 5.54 0.04 -1.26 -4.95 135.00 139.03 2qw4 s PRO 253 Ca 0.67 1.84 -0.30 0.00 0.04 0.00 0.00 61.00 63.25 2qw4 s PRO 253 Cb -0.44 -2.68 -0.07 0.00 0.04 0.00 0.00 34.50 31.35 2qw4 s PRO 253 CO 0.36 -0.31 1.74 -1.25 0.04 0.00 0.00 177.00 177.58 2qw4 s PRO 254 N -2.29 4.17 0.24 0.56 0.04 -1.26 -4.78 135.00 131.68 2qw4 s PRO 254 Ca 0.57 2.32 0.14 0.00 0.04 0.00 0.00 61.00 64.07 2qw4 s PRO 254 Cb -0.31 -4.01 0.87 0.00 0.04 0.00 0.00 34.50 31.09 2qw4 s PRO 254 CO 0.38 -0.87 1.00 -2.30 0.04 0.00 0.00 177.00 175.26 2qw4 n PRO 255 N 7.14 -0.04 0.25 0.56 -0.02 -1.26 -0.58 135.00 141.05 2qw4 n PRO 255 Ca 0.18 0.87 -0.11 0.00 -2.02 0.00 0.00 63.50 62.42 2qw4 n PRO 255 Cb 0.42 -1.58 -0.06 0.00 -0.02 0.00 0.00 33.50 32.27 2qw4 n PRO 255 CO 0.00 0.00 0.00 -0.84 1.98 0.00 0.00 175.50 176.64 2qw4 h ILE 256 N 0.00 0.00 -0.86 4.25 -0.00 -2.00 0.13 117.51 119.03 2qw4 h ILE 256 Ca 0.54 0.00 0.12 0.00 -0.00 0.00 0.00 64.86 65.53 2qw4 h ILE 256 Cb 1.46 0.00 -0.06 0.00 -0.00 0.00 0.00 36.82 38.22 2qw4 h ILE 256 CO -0.47 0.00 0.56 0.40 -0.00 0.00 0.00 178.15 178.63 2qw4 h ILE 257 N -0.68 0.88 -0.57 0.16 1.08 -1.21 -1.04 117.51 116.12 2qw4 h ILE 257 Ca -0.06 -0.25 -0.10 0.00 -0.39 0.00 0.00 64.86 64.06 2qw4 h ILE 257 Cb 0.55 0.10 -0.02 0.00 -3.07 0.00 0.00 36.82 34.38 2qw4 h ILE 257 CO 0.06 0.13 -0.05 -0.78 -0.69 0.00 0.00 178.15 176.82 2qw4 h ASP 258 N 0.72 1.02 0.45 1.72 1.82 -1.22 -2.77 116.42 118.15 2qw4 h ASP 258 Ca 0.42 -0.31 -0.01 0.00 -0.39 0.00 0.00 57.03 56.74 2qw4 h ASP 258 Cb 0.61 -0.28 -0.02 0.00 0.68 0.00 0.00 39.33 40.32 2qw4 h ASP 258 CO -0.18 1.10 -0.40 0.50 -1.61 0.00 0.00 179.24 178.65 2qw4 h LYS 259 N 0.93 -0.82 -0.73 0.28 3.64 0.61 -3.11 116.57 117.37 2qw4 h LYS 259 Ca 0.16 0.06 0.07 0.00 -1.27 0.00 0.00 60.65 59.66 2qw4 h LYS 259 Cb 0.61 0.19 -0.09 0.00 -0.41 0.00 0.00 32.23 32.52 2qw4 h LYS 259 CO 0.04 -0.55 -0.50 0.82 -2.27 0.00 0.00 179.45 177.00 2qw4 h ILE 260 N -0.85 0.00 -0.58 2.00 2.04 -1.41 0.06 117.51 118.77 2qw4 h ILE 260 Ca -0.04 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.92 2qw4 h ILE 260 Cb 0.74 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.72 2qw4 h ILE 260 CO -0.04 0.00 -0.18 0.33 0.00 0.00 0.00 178.15 178.26 2qw4 n PHE 261 N -4.93 0.13 -1.71 1.37 7.35 -1.05 -3.09 117.46 115.53 2qw4 n PHE 261 Ca 0.01 0.71 -0.17 0.00 -0.76 0.00 0.00 57.45 57.24 2qw4 n PHE 261 Cb 0.24 -0.79 -0.08 0.00 0.35 0.00 0.00 39.48 39.20 2qw4 n PHE 261 CO 0.00 0.00 0.00 -1.64 -0.76 0.00 0.00 176.76 174.36 2qw4 s MET 262 N -5.66 1.73 -0.33 -4.13 -1.94 0.01 -4.54 119.30 104.43 2qw4 s MET 262 Ca -0.08 -0.04 -0.03 0.00 -1.71 0.00 0.00 55.69 53.83 2qw4 s MET 262 Cb 0.14 -4.93 0.27 0.00 2.01 0.00 0.00 34.83 32.33 2qw4 s MET 262 CO 0.44 -4.51 1.22 -0.25 -0.01 0.00 0.00 175.02 171.91 2qw4 n ASP 263 N 17.78 -1.33 0.00 3.03 10.43 -1.18 -5.01 116.55 140.27 2qw4 n ASP 263 Ca 0.44 -1.74 0.00 0.00 2.57 0.00 0.00 54.79 56.06 2qw4 n ASP 263 Cb 0.45 0.72 0.00 0.00 1.84 0.00 0.00 41.12 44.13 2qw4 n ASP 263 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 177.20 176.54