#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sx4 n ALA 3 N 0.00 1.96 -2.75 0.00 0.00 -1.26 -4.96 120.51 113.50 1sx4 n ALA 3 Ca 0.00 0.30 -0.26 0.00 0.00 0.00 0.00 53.44 53.48 1sx4 n ALA 3 Cb 0.00 -2.37 -0.06 0.00 0.00 0.00 0.00 19.45 17.02 1sx4 n ALA 3 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1sx4 s LYS 4 N -2.21 2.72 -0.34 0.00 -0.14 -1.26 -2.91 119.74 115.61 1sx4 s LYS 4 Ca 0.57 -0.96 -0.09 0.00 -1.36 0.00 0.00 55.97 54.14 1sx4 s LYS 4 Cb -0.48 -2.54 0.02 0.00 -1.68 0.00 0.00 37.83 33.15 1sx4 s LYS 4 CO 0.61 0.47 0.14 0.34 -0.76 0.00 0.00 175.35 176.15 1sx4 s ASP 5 N -3.04 5.45 -0.12 2.83 -1.08 -0.44 -4.79 116.67 115.47 1sx4 s ASP 5 Ca 0.30 -0.90 -0.05 0.00 -0.52 0.00 0.00 52.55 51.38 1sx4 s ASP 5 Cb -0.10 -1.94 -0.04 0.00 -1.46 0.00 0.00 42.92 39.38 1sx4 s ASP 5 CO 0.22 -0.30 0.05 0.68 0.52 0.00 0.00 175.17 176.33 1sx4 s VAL 6 N 1.51 4.67 -0.03 1.11 -7.23 -1.26 -2.84 120.40 116.33 1sx4 s VAL 6 Ca 0.01 -0.10 0.06 0.00 -1.81 0.00 0.00 61.98 60.15 1sx4 s VAL 6 Cb -0.18 -3.03 -0.01 0.00 0.56 0.00 0.00 36.38 33.71 1sx4 s VAL 6 CO 0.05 0.56 -0.22 -0.54 -0.31 0.00 0.00 175.10 174.63 1sx4 s LYS 7 N -0.48 1.92 0.22 4.82 1.02 0.78 -4.94 119.74 123.08 1sx4 s LYS 7 Ca 0.10 -0.79 0.07 0.00 0.02 0.00 0.00 55.97 55.37 1sx4 s LYS 7 Cb -0.12 -1.79 -0.04 0.00 -0.52 0.00 0.00 37.83 35.36 1sx4 s LYS 7 CO 0.02 0.44 0.11 -0.06 -0.92 0.00 0.00 175.35 174.93 1sx4 s PHE 8 N -0.40 2.98 0.00 3.18 0.40 -1.26 -0.52 117.98 122.36 1sx4 s PHE 8 Ca 0.05 -0.12 0.00 0.00 -0.60 0.00 0.00 56.93 56.26 1sx4 s PHE 8 Cb -0.10 -1.38 0.00 0.00 0.51 0.00 0.00 43.02 42.05 1sx4 s PHE 8 CO 0.00 0.54 0.00 0.41 0.70 0.00 0.00 175.22 176.87 1sx4 n GLY 9 N -0.74 1.29 0.25 4.36 0.00 0.36 -1.94 105.19 108.78 1sx4 n GLY 9 Ca -0.08 0.03 -0.02 0.00 0.00 0.00 0.00 46.02 45.95 1sx4 n GLY 9 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1sx4 h ASN 10 N 0.00 0.57 -0.28 1.61 -1.24 -1.94 0.31 115.58 114.62 1sx4 h ASN 10 Ca 0.00 0.02 0.03 0.00 0.71 0.00 0.00 56.30 57.06 1sx4 h ASN 10 Cb 0.00 -0.09 -0.04 0.00 0.73 0.00 0.00 38.32 38.92 1sx4 h ASN 10 CO 0.00 0.38 -0.18 0.44 -1.29 0.00 0.00 177.43 176.78 1sx4 h ASP 11 N 0.71 -0.67 -0.79 1.15 5.19 -1.97 0.35 116.42 120.39 1sx4 h ASP 11 Ca 0.28 0.10 0.00 0.00 -0.62 0.00 0.00 57.03 56.80 1sx4 h ASP 11 Cb 0.13 0.29 -0.04 0.00 0.18 0.00 0.00 39.33 39.89 1sx4 h ASP 11 CO -0.16 -0.08 0.52 0.00 -3.12 0.00 0.00 179.24 176.40 1sx4 h ALA 12 N -0.59 1.41 0.00 3.45 0.00 0.20 -2.90 119.26 120.84 1sx4 h ALA 12 Ca 0.05 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1sx4 h ALA 12 Cb 0.14 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1sx4 h ALA 12 CO -0.28 0.54 -0.00 0.00 0.00 0.00 0.00 179.25 179.51 1sx4 h ARG 13 N 1.08 -0.00 -0.51 0.00 3.08 -0.36 -0.78 114.38 116.89 1sx4 h ARG 13 Ca 0.29 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.43 1sx4 h ARG 13 Cb -0.11 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 29.84 1sx4 h ARG 13 CO -0.06 0.21 -0.33 0.28 -1.07 0.00 0.00 179.97 179.00 1sx4 h VAL 14 N -0.21 0.20 0.56 2.04 2.07 -0.20 0.17 116.25 120.87 1sx4 h VAL 14 Ca -0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 1sx4 h VAL 14 Cb 0.21 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 1sx4 h VAL 14 CO 0.00 0.00 -0.50 0.11 0.02 0.00 0.00 177.57 177.20 1sx4 h LYS 15 N -0.20 -1.01 -0.81 1.57 1.79 -1.34 0.23 116.57 116.80 1sx4 h LYS 15 Ca 0.21 0.07 0.34 0.00 -2.18 0.00 0.00 60.65 59.08 1sx4 h LYS 15 Cb 0.54 0.23 -0.14 0.00 -1.58 0.00 0.00 32.23 31.28 1sx4 h LYS 15 CO -0.62 -0.67 0.44 -0.12 -1.08 0.00 0.00 179.45 177.40 1sx4 n MET 16 N -5.58 -0.05 0.13 3.15 1.56 -0.31 -0.92 117.12 115.11 1sx4 n MET 16 Ca -0.13 1.11 -0.24 0.00 -0.27 0.00 0.00 57.70 58.17 1sx4 n MET 16 Cb 0.47 -1.99 -0.15 0.00 2.15 0.00 0.00 33.22 33.70 1sx4 n MET 16 CO 0.00 0.00 0.00 1.25 -0.73 0.00 0.00 175.97 176.49 1sx4 h LEU 17 N 0.00 0.84 -1.72 -0.89 5.85 0.12 -1.82 115.31 117.70 1sx4 h LEU 17 Ca 0.68 -0.91 0.05 0.00 0.84 0.00 0.00 57.88 58.54 1sx4 h LEU 17 Cb 1.81 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 42.55 1sx4 h LEU 17 CO -0.61 1.68 0.27 0.03 -0.34 0.00 0.00 178.44 179.47 1sx4 h ARG 18 N 0.14 0.35 0.88 1.25 3.08 0.33 0.36 114.38 120.77 1sx4 h ARG 18 Ca -0.24 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 59.75 1sx4 h ARG 18 Cb 2.10 -0.08 0.01 0.00 0.08 0.00 0.00 29.97 32.08 1sx4 h ARG 18 CO 0.26 0.23 -0.43 0.78 -1.07 0.00 0.00 179.97 179.75 1sx4 h GLY 19 N 0.36 -1.24 0.01 0.04 0.00 -0.94 -1.14 103.07 100.17 1sx4 h GLY 19 Ca 0.17 0.46 0.12 0.00 0.00 0.00 0.00 47.33 48.08 1sx4 h GLY 19 CO -0.04 -0.45 -0.01 -2.08 0.00 0.00 0.00 176.54 173.96 1sx4 h VAL 20 N -1.19 0.53 -0.49 4.60 2.07 -0.41 -2.54 116.25 118.82 1sx4 h VAL 20 Ca -0.12 -0.04 0.06 0.00 0.82 0.00 0.00 66.70 67.42 1sx4 h VAL 20 Cb 0.91 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 31.05 1sx4 h VAL 20 CO 0.20 0.02 0.21 0.78 0.02 0.00 0.00 177.57 178.79 1sx4 h ASN 21 N 0.11 0.25 -0.01 0.57 -0.26 -0.08 0.89 115.58 117.04 1sx4 h ASN 21 Ca 0.29 0.05 0.02 0.00 -0.56 0.00 0.00 56.30 56.09 1sx4 h ASN 21 Cb 0.46 0.01 -0.02 0.00 -1.06 0.00 0.00 38.32 37.71 1sx4 h ASN 21 CO -0.49 0.18 -0.08 0.58 -1.06 0.00 0.00 177.43 176.55 1sx4 h VAL 22 N 0.40 0.78 0.69 2.81 2.07 -0.79 0.36 116.25 122.58 1sx4 h VAL 22 Ca 0.23 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.72 1sx4 h VAL 22 Cb 0.20 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 1sx4 h VAL 22 CO -0.20 0.00 -0.39 0.25 0.02 0.00 0.00 177.57 177.25 1sx4 h LEU 23 N -0.14 -0.97 -0.61 2.57 7.12 -1.36 -2.33 115.31 119.59 1sx4 h LEU 23 Ca 0.04 0.05 0.12 0.00 0.13 0.00 0.00 57.88 58.21 1sx4 h LEU 23 Cb 0.19 0.27 -0.12 0.00 -0.53 0.00 0.00 40.66 40.47 1sx4 h LEU 23 CO -0.09 -0.62 -0.26 0.00 -0.13 0.00 0.00 178.44 177.34 1sx4 h ALA 24 N -1.38 0.16 -0.79 1.25 0.00 0.96 -1.54 119.26 117.92 1sx4 h ALA 24 Ca -0.09 0.20 0.06 0.00 0.00 0.00 0.00 54.91 55.08 1sx4 h ALA 24 Cb 0.79 0.65 -0.06 0.00 0.00 0.00 0.00 17.79 19.17 1sx4 h ALA 24 CO 0.11 -0.57 0.48 -0.44 0.00 0.00 0.00 179.25 178.83 1sx4 h ASP 25 N -0.10 0.74 -0.55 0.00 5.19 -0.25 0.14 116.42 121.59 1sx4 h ASP 25 Ca 0.27 0.02 0.06 0.00 -0.62 0.00 0.00 57.03 56.75 1sx4 h ASP 25 Cb 0.52 -0.14 -0.03 0.00 0.18 0.00 0.00 39.33 39.87 1sx4 h ASP 25 CO -0.67 0.48 0.37 0.00 -3.12 0.00 0.00 179.24 176.30 1sx4 h ALA 26 N 1.38 1.85 0.13 3.45 0.00 -0.84 -3.12 119.26 122.11 1sx4 h ALA 26 Ca 0.34 -0.02 -0.28 0.00 0.00 0.00 0.00 54.91 54.96 1sx4 h ALA 26 Cb 0.16 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1sx4 h ALA 26 CO -0.17 0.06 -1.25 0.28 0.00 0.00 0.00 179.25 178.18 1sx4 h VAL 27 N 0.52 1.50 -0.97 0.00 2.07 0.17 -3.33 116.25 116.21 1sx4 h VAL 27 Ca 0.24 -3.06 0.05 0.00 0.82 0.00 0.00 66.70 64.74 1sx4 h VAL 27 Cb 0.27 2.95 -0.06 0.00 -1.52 0.00 0.00 31.29 32.93 1sx4 h VAL 27 CO -0.07 0.89 0.64 0.11 0.02 0.00 0.00 177.57 179.16 1sx4 h LYS 28 N 0.07 1.16 0.00 1.57 1.57 -1.02 -2.76 116.57 117.17 1sx4 h LYS 28 Ca -0.14 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 1sx4 h LYS 28 Cb 1.98 -0.26 0.00 0.00 0.08 0.00 0.00 32.23 34.02 1sx4 h LYS 28 CO 0.20 0.77 0.40 -0.39 -0.57 0.00 0.00 179.45 179.86 1sx4 h VAL 29 N 1.20 0.00 -0.60 0.50 -1.51 -1.65 0.27 116.25 114.46 1sx4 h VAL 29 Ca 0.40 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.87 1sx4 h VAL 29 Cb 0.06 0.47 0.00 0.00 -2.13 0.00 0.00 31.29 29.69 1sx4 h VAL 29 CO -0.13 0.00 0.00 0.35 -1.23 0.00 0.00 177.57 176.56 1sx4 n THR 30 N -2.57 1.60 -3.08 7.19 -2.24 -1.04 -1.26 114.28 112.89 1sx4 n THR 30 Ca -0.01 -1.05 -0.39 0.00 -2.27 0.00 0.00 64.05 60.32 1sx4 n THR 30 Cb 0.43 0.11 -0.05 0.00 -2.10 0.00 0.00 70.33 68.72 1sx4 n THR 30 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1sx4 s LEU 31 N -1.66 4.38 0.02 3.22 2.96 0.08 -4.59 118.68 123.09 1sx4 s LEU 31 Ca 0.46 1.24 0.00 0.00 -0.22 0.00 0.00 54.13 55.61 1sx4 s LEU 31 Cb 0.29 -3.07 0.00 0.00 0.50 0.00 0.00 46.19 43.92 1sx4 s LEU 31 CO 0.23 -0.02 0.00 0.61 -1.32 0.00 0.00 176.35 175.85 1sx4 n GLY 32 N 2.76 -1.46 0.29 7.98 0.00 -1.26 -3.60 105.19 109.89 1sx4 n GLY 32 Ca -0.03 -1.51 -0.08 0.00 0.00 0.00 0.00 46.02 44.40 1sx4 n GLY 32 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1sx4 h PRO 33 N -0.08 0.98 -1.11 1.61 0.13 -1.91 0.30 132.00 131.92 1sx4 h PRO 33 Ca 0.00 -0.24 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 1sx4 h PRO 33 Cb 0.08 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 31.08 1sx4 h PRO 33 CO 0.00 0.90 0.00 1.63 -0.23 0.00 0.00 178.00 180.30 1sx4 n LYS 34 N -4.34 0.86 -1.13 0.86 5.02 -1.26 -4.92 118.16 113.25 1sx4 n LYS 34 Ca 0.03 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 56.01 1sx4 n LYS 34 Cb 0.24 -1.10 0.11 0.00 -0.02 0.00 0.00 35.03 34.26 1sx4 n LYS 34 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1sx4 s GLY 35 N 0.89 1.81 0.46 0.72 0.00 0.11 -4.60 107.32 106.70 1sx4 s GLY 35 Ca 0.00 0.48 0.04 0.00 0.00 0.00 0.00 44.72 45.25 1sx4 s GLY 35 CO 0.00 0.86 0.03 0.50 0.00 0.00 0.00 173.10 174.49 1sx4 s ARG 36 N -4.61 2.09 0.25 2.90 0.52 -0.39 -4.96 118.95 114.76 1sx4 s ARG 36 Ca 0.65 -2.23 0.06 0.00 -0.52 0.00 0.00 55.73 53.69 1sx4 s ARG 36 Cb -0.21 -1.62 -0.03 0.00 0.52 0.00 0.00 34.95 33.61 1sx4 s ARG 36 CO 0.54 -0.21 0.31 -0.80 0.02 0.00 0.00 175.30 175.15 1sx4 s ASN 37 N -3.81 5.98 0.21 0.23 0.01 -1.26 -4.01 114.94 112.28 1sx4 s ASN 37 Ca 0.22 -0.08 0.10 0.00 -0.71 0.00 0.00 52.86 52.39 1sx4 s ASN 37 Cb 0.05 -1.63 -0.04 0.00 0.41 0.00 0.00 41.25 40.04 1sx4 s ASN 37 CO 0.11 -0.09 -0.12 -0.69 -1.51 0.00 0.00 177.10 174.81 1sx4 s VAL 38 N -2.06 3.00 -0.20 1.60 1.01 -0.21 -4.94 120.40 118.60 1sx4 s VAL 38 Ca 0.34 -1.87 -0.01 0.00 0.00 0.00 0.00 61.98 60.45 1sx4 s VAL 38 Cb -0.09 -2.51 0.01 0.00 0.00 0.00 0.00 36.38 33.80 1sx4 s VAL 38 CO 0.28 -0.19 -0.14 -0.69 0.00 0.00 0.00 175.10 174.35 1sx4 s VAL 39 N -1.91 2.54 -0.19 2.92 1.01 -1.26 -1.59 120.40 121.92 1sx4 s VAL 39 Ca 0.26 -0.83 -0.06 0.00 0.00 0.00 0.00 61.98 61.34 1sx4 s VAL 39 Cb -0.08 -2.14 -0.03 0.00 0.00 0.00 0.00 36.38 34.13 1sx4 s VAL 39 CO 0.15 0.46 0.04 -0.76 0.00 0.00 0.00 175.10 174.98 1sx4 s LEU 40 N 1.35 3.56 1.06 3.92 1.43 -0.57 -4.96 118.68 124.46 1sx4 s LEU 40 Ca 0.04 -0.06 -0.17 0.00 -1.03 0.00 0.00 54.13 52.92 1sx4 s LEU 40 Cb -0.14 -1.90 0.23 0.00 0.03 0.00 0.00 46.19 44.41 1sx4 s LEU 40 CO -0.09 0.11 1.23 -0.62 0.23 0.00 0.00 176.35 177.21 1sx4 s ASP 41 N 0.72 2.23 -0.30 2.29 -1.08 -1.26 -1.80 116.67 117.46 1sx4 s ASP 41 Ca 0.02 0.44 -0.06 0.00 -0.52 0.00 0.00 52.55 52.42 1sx4 s ASP 41 Cb -0.14 -0.58 0.16 0.00 -1.46 0.00 0.00 42.92 40.90 1sx4 s ASP 41 CO 0.02 -3.30 0.66 -0.54 0.52 0.00 0.00 175.17 172.53 1sx4 s LYS 42 N -5.67 0.55 0.31 4.34 1.02 -1.26 -4.79 119.74 114.23 1sx4 s LYS 42 Ca 0.72 1.19 -0.01 0.00 0.02 0.00 0.00 55.97 57.90 1sx4 s LYS 42 Cb -0.07 0.70 0.48 0.00 -0.52 0.00 0.00 37.83 38.42 1sx4 s LYS 42 CO 0.54 -0.38 1.94 0.66 -0.92 0.00 0.00 175.35 177.19 1sx4 h SER 43 N 7.98 0.84 0.00 2.83 4.64 -1.98 -3.29 113.55 124.57 1sx4 h SER 43 Ca -0.20 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1sx4 h SER 43 Cb 1.13 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1sx4 h SER 43 CO 0.16 0.67 0.00 0.49 -0.87 0.00 0.00 176.83 177.28 1sx4 n PHE 44 N -4.38 0.00 0.00 4.77 3.72 -1.26 -5.01 117.46 115.30 1sx4 n PHE 44 Ca 0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.47 1sx4 n PHE 44 Cb 0.09 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.63 1sx4 n PHE 44 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1sx4 n GLY 45 N 0.00 5.19 3.74 1.37 0.00 -1.24 -5.11 105.19 109.14 1sx4 n GLY 45 Ca 0.00 -1.04 -0.38 0.00 0.00 0.00 0.00 46.02 44.60 1sx4 n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sx4 n ALA 46 N -3.00 1.53 -0.32 4.61 0.00 -1.26 -4.55 120.51 117.52 1sx4 n ALA 46 Ca 0.00 0.11 -0.30 0.00 0.00 0.00 0.00 53.44 53.25 1sx4 n ALA 46 Cb 0.00 -2.35 0.29 0.00 0.00 0.00 0.00 19.45 17.38 1sx4 n ALA 46 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1sx4 s PRO 47 N -2.97 -2.61 -0.09 0.00 0.02 -1.26 -4.75 135.00 123.34 1sx4 s PRO 47 Ca 0.73 0.38 0.03 0.00 0.02 0.00 0.00 61.00 62.17 1sx4 s PRO 47 Cb -0.41 -1.39 0.01 0.00 0.02 0.00 0.00 34.50 32.72 1sx4 s PRO 47 CO 0.48 -4.72 -0.18 0.99 -0.33 0.00 0.00 177.00 173.23 1sx4 s THR 48 N -2.23 1.63 -0.21 0.99 2.01 -0.75 -4.93 115.64 112.16 1sx4 s THR 48 Ca 0.68 -0.76 -0.08 0.00 0.31 0.00 0.00 61.69 61.84 1sx4 s THR 48 Cb -0.18 -1.44 -0.04 0.00 0.01 0.00 0.00 72.50 70.85 1sx4 s THR 48 CO 0.61 0.47 0.08 -0.63 -0.69 0.00 0.00 174.62 174.45 1sx4 s ILE 49 N 0.56 4.77 0.06 1.82 1.01 -1.26 -1.51 121.20 126.65 1sx4 s ILE 49 Ca -0.15 -0.03 -0.06 0.00 0.00 0.00 0.00 60.65 60.41 1sx4 s ILE 49 Cb -0.17 -3.18 -0.01 0.00 0.01 0.00 0.00 42.46 39.11 1sx4 s ILE 49 CO 0.05 0.41 0.10 0.28 0.00 0.00 0.00 174.94 175.78 1sx4 s THR 50 N 0.79 0.16 -1.57 2.92 -1.32 -0.62 -4.50 115.64 111.49 1sx4 s THR 50 Ca 0.04 -1.29 0.15 0.00 -1.21 0.00 0.00 61.69 59.38 1sx4 s THR 50 Cb -0.13 -1.19 0.29 0.00 -1.51 0.00 0.00 72.50 69.96 1sx4 s THR 50 CO 0.02 -0.71 1.20 1.17 -2.21 0.00 0.00 174.62 174.09 1sx4 n LYS 51 N 0.34 2.10 -3.69 7.08 4.81 -1.26 -1.04 118.16 126.50 1sx4 n LYS 51 Ca -0.16 -1.90 -0.39 0.00 -0.87 0.00 0.00 58.31 54.99 1sx4 n LYS 51 Cb 0.60 -1.34 -0.12 0.00 0.02 0.00 0.00 35.03 34.19 1sx4 n LYS 51 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1sx4 s ASP 52 N -1.13 5.49 0.25 3.14 2.15 -1.26 -4.87 116.67 120.44 1sx4 s ASP 52 Ca 0.26 -1.08 -0.03 0.00 0.43 0.00 0.00 52.55 52.13 1sx4 s ASP 52 Cb 0.15 -1.93 0.47 0.00 -0.30 0.00 0.00 42.92 41.31 1sx4 s ASP 52 CO 0.21 -0.35 1.75 1.23 -0.17 0.00 0.00 175.17 177.83 1sx4 h GLY 53 N 8.31 1.22 2.00 2.66 0.00 -1.92 0.20 103.07 115.55 1sx4 h GLY 53 Ca -0.24 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 46.88 1sx4 h GLY 53 CO 0.63 -0.06 -0.08 -0.24 0.00 0.00 0.00 176.54 176.79 1sx4 h VAL 54 N 0.52 0.30 -0.15 4.60 3.04 -1.86 0.23 116.25 122.92 1sx4 h VAL 54 Ca 0.43 -0.55 -0.07 0.00 -1.01 0.00 0.00 66.70 65.50 1sx4 h VAL 54 Cb 0.61 1.42 -0.00 0.00 -2.01 0.00 0.00 31.29 31.31 1sx4 h VAL 54 CO -0.37 0.08 -0.18 0.28 -1.01 0.00 0.00 177.57 176.37 1sx4 h SER 55 N 0.00 0.42 -0.51 3.17 0.02 -1.01 -2.81 113.55 112.83 1sx4 h SER 55 Ca -0.00 -0.50 -0.08 0.00 -0.84 0.00 0.00 61.79 60.37 1sx4 h SER 55 Cb 0.41 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 1sx4 h SER 55 CO 0.01 0.83 -0.01 0.58 -1.14 0.00 0.00 176.83 177.10 1sx4 h VAL 56 N 0.01 1.26 0.57 2.27 2.07 -1.28 -3.31 116.25 117.85 1sx4 h VAL 56 Ca 0.02 -1.10 -0.03 0.00 0.82 0.00 0.00 66.70 66.41 1sx4 h VAL 56 Cb 0.72 0.97 0.01 0.00 -1.52 0.00 0.00 31.29 31.47 1sx4 h VAL 56 CO 0.04 0.39 -0.28 0.00 0.02 0.00 0.00 177.57 177.74 1sx4 h ALA 57 N 0.93 -0.77 -1.38 1.67 0.00 -0.43 -2.50 119.26 116.78 1sx4 h ALA 57 Ca 0.14 -0.20 0.41 0.00 0.00 0.00 0.00 54.91 55.27 1sx4 h ALA 57 Cb 0.54 0.30 -0.07 0.00 0.00 0.00 0.00 17.79 18.56 1sx4 h ALA 57 CO 0.03 -0.85 0.98 0.54 0.00 0.00 0.00 179.25 179.95 1sx4 n ARG 58 N -5.36 -0.00 0.19 0.00 5.12 -1.07 -0.72 116.66 114.81 1sx4 n ARG 58 Ca -0.12 0.82 0.08 0.00 -1.93 0.00 0.00 57.85 56.70 1sx4 n ARG 58 Cb 0.34 -1.84 0.19 0.00 -1.16 0.00 0.00 32.46 29.99 1sx4 n ARG 58 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 1sx4 h GLU 59 N 0.00 0.00 -6.12 5.56 4.39 -1.53 -3.45 114.58 113.43 1sx4 h GLU 59 Ca 0.69 0.00 -0.58 0.00 0.34 0.00 0.00 59.36 59.81 1sx4 h GLU 59 Cb 2.67 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 31.26 1sx4 h GLU 59 CO -0.07 0.25 0.82 0.42 -1.16 0.00 0.00 179.01 179.27 1sx4 s ILE 60 N -3.21 4.59 -0.01 3.13 -1.09 0.10 -4.97 121.20 119.75 1sx4 s ILE 60 Ca 0.04 1.92 0.01 0.00 -2.23 0.00 0.00 60.65 60.39 1sx4 s ILE 60 Cb 0.07 -4.27 0.00 0.00 -1.58 0.00 0.00 42.46 36.68 1sx4 s ILE 60 CO 0.69 -0.21 -0.04 -0.70 -1.23 0.00 0.00 174.94 173.45 1sx4 s GLU 61 N 3.31 0.39 0.26 2.79 2.12 -1.26 -4.84 118.70 121.46 1sx4 s GLU 61 Ca 0.46 -0.12 0.09 0.00 0.36 0.00 0.00 54.97 55.75 1sx4 s GLU 61 Cb -0.16 -0.40 -0.04 0.00 0.26 0.00 0.00 34.13 33.79 1sx4 s GLU 61 CO 0.09 0.05 0.07 -0.51 -0.54 0.00 0.00 175.26 174.42 1sx4 s LEU 62 N 0.13 3.43 0.05 2.70 1.02 -1.26 -5.04 118.68 119.71 1sx4 s LEU 62 Ca -0.01 -0.49 -0.03 0.00 0.02 0.00 0.00 54.13 53.62 1sx4 s LEU 62 Cb -0.04 -1.96 -0.28 0.00 0.02 0.00 0.00 46.19 43.93 1sx4 s LEU 62 CO -0.00 -0.01 1.03 -0.08 0.02 0.00 0.00 176.35 177.31 1sx4 h GLU 63 N 1.76 0.25 -6.27 1.70 4.81 -2.00 -3.42 114.58 111.41 1sx4 h GLU 63 Ca -0.46 -0.43 -0.55 0.00 -0.13 0.00 0.00 59.36 57.80 1sx4 h GLU 63 Cb 1.24 0.16 -0.00 0.00 0.63 0.00 0.00 28.75 30.78 1sx4 h GLU 63 CO 0.60 1.16 1.14 0.34 -0.73 0.00 0.00 179.01 181.52 1sx4 s ASP 64 N -7.05 6.55 0.57 1.04 2.15 -1.26 -4.87 116.67 113.80 1sx4 s ASP 64 Ca -0.06 2.24 0.28 0.00 0.43 0.00 0.00 52.55 55.45 1sx4 s ASP 64 Cb 0.07 -2.53 1.70 0.00 -0.30 0.00 0.00 42.92 41.86 1sx4 s ASP 64 CO 0.87 -1.02 2.21 0.11 -0.17 0.00 0.00 175.17 177.17 1sx4 h LYS 65 N 10.07 0.00 0.14 4.34 1.79 -1.92 0.47 116.57 131.47 1sx4 h LYS 65 Ca -0.41 0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 57.77 1sx4 h LYS 65 Cb 1.19 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.84 1sx4 h LYS 65 CO 0.96 0.03 -1.44 0.74 -1.08 0.00 0.00 179.45 178.66 1sx4 h PHE 66 N 0.00 0.56 -0.94 -1.35 0.04 -1.93 -2.70 116.94 110.61 1sx4 h PHE 66 Ca -0.00 -0.41 0.01 0.00 2.80 0.00 0.00 57.97 60.38 1sx4 h PHE 66 Cb 0.06 -0.02 -0.05 0.00 2.20 0.00 0.00 35.95 38.14 1sx4 h PHE 66 CO 0.00 1.56 0.62 0.93 -0.60 0.00 0.00 178.31 180.82 1sx4 h GLU 67 N -0.18 1.23 -0.47 1.51 5.08 -1.57 -1.63 114.58 118.55 1sx4 h GLU 67 Ca -0.29 -0.07 0.04 0.00 -1.00 0.00 0.00 59.36 58.03 1sx4 h GLU 67 Cb 1.86 -0.28 -0.04 0.00 0.50 0.00 0.00 28.75 30.79 1sx4 h GLU 67 CO 0.11 0.81 0.24 -0.97 -1.00 0.00 0.00 179.01 178.20 1sx4 h ASN 68 N 1.27 0.34 -0.98 1.42 -1.24 -0.11 -1.57 115.58 114.71 1sx4 h ASN 68 Ca 0.35 0.02 0.10 0.00 0.71 0.00 0.00 56.30 57.48 1sx4 h ASN 68 Cb -0.13 -0.04 -0.07 0.00 0.73 0.00 0.00 38.32 38.80 1sx4 h ASN 68 CO -0.08 0.24 0.62 0.24 -1.29 0.00 0.00 177.43 177.17 1sx4 h MET 69 N 0.47 0.99 -0.34 6.67 2.86 -1.04 0.38 114.93 124.92 1sx4 h MET 69 Ca 0.20 -0.06 0.05 0.00 -2.06 0.00 0.00 59.70 57.83 1sx4 h MET 69 Cb 0.11 -0.22 -0.08 0.00 0.06 0.00 0.00 31.60 31.46 1sx4 h MET 69 CO -0.14 0.66 -0.54 0.78 1.06 0.00 0.00 176.91 178.73 1sx4 h GLY 70 N 1.02 -0.96 1.56 8.32 0.00 -0.38 -1.86 103.07 110.76 1sx4 h GLY 70 Ca 0.46 0.69 -0.13 0.00 0.00 0.00 0.00 47.33 48.34 1sx4 h GLY 70 CO -0.21 -0.15 -0.44 0.00 0.00 0.00 0.00 176.54 175.74 1sx4 h ALA 71 N -0.04 0.87 0.00 3.60 0.00 -0.61 -2.27 119.26 120.82 1sx4 h ALA 71 Ca 0.07 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1sx4 h ALA 71 Cb 0.62 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1sx4 h ALA 71 CO -0.56 0.65 0.00 1.04 0.00 0.00 0.00 179.25 180.38 1sx4 n GLN 72 N -4.00 0.13 -0.09 0.00 1.13 0.12 -1.33 117.38 113.33 1sx4 n GLN 72 Ca -0.02 0.24 -0.13 0.00 -1.94 0.00 0.00 57.00 55.15 1sx4 n GLN 72 Cb 0.53 -1.69 -0.07 0.00 0.11 0.00 0.00 30.24 29.12 1sx4 n GLN 72 CO 0.00 0.00 0.00 0.52 -1.44 0.00 0.00 177.06 176.14 1sx4 h MET 73 N 0.00 0.00 -0.08 -1.09 2.86 -0.78 -3.36 114.93 112.48 1sx4 h MET 73 Ca 0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1sx4 h MET 73 Cb 0.46 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.11 1sx4 h MET 73 CO 0.00 0.54 -0.01 -0.39 1.06 0.00 0.00 176.91 178.11 1sx4 h VAL 74 N -1.00 1.06 -0.37 -2.22 -1.51 -1.45 -2.39 116.25 108.37 1sx4 h VAL 74 Ca -0.17 -0.23 0.11 0.00 -1.23 0.00 0.00 66.70 65.19 1sx4 h VAL 74 Cb 0.88 1.01 -0.01 0.00 -2.13 0.00 0.00 31.29 31.04 1sx4 h VAL 74 CO -0.10 0.07 0.55 0.50 -1.23 0.00 0.00 177.57 177.36 1sx4 h LYS 75 N 0.11 0.00 0.00 5.19 3.64 -1.35 0.47 116.57 124.63 1sx4 h LYS 75 Ca 0.03 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1sx4 h LYS 75 Cb 0.09 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 1sx4 h LYS 75 CO 0.00 0.00 -0.08 -1.91 -2.27 0.00 0.00 179.45 175.20 1sx4 n GLU 76 N -3.39 0.09 0.04 1.90 2.13 -0.90 -0.95 120.64 119.56 1sx4 n GLU 76 Ca 0.07 0.06 -0.09 0.00 0.66 0.00 0.00 57.16 57.86 1sx4 n GLU 76 Cb 0.70 -1.59 -0.07 0.00 0.27 0.00 0.00 31.44 30.75 1sx4 n GLU 76 CO 0.00 0.00 0.00 -0.39 -0.41 0.00 0.00 177.13 176.33 1sx4 h VAL 77 N 0.00 0.71 -0.92 6.31 -1.51 -1.08 -1.08 116.25 118.68 1sx4 h VAL 77 Ca 0.00 -1.18 0.18 0.00 -1.23 0.00 0.00 66.70 64.47 1sx4 h VAL 77 Cb 0.58 1.23 -0.08 0.00 -2.13 0.00 0.00 31.29 30.90 1sx4 h VAL 77 CO 0.00 0.20 0.59 0.00 -1.23 0.00 0.00 177.57 177.13 1sx4 h ALA 78 N -0.49 1.94 -0.09 5.19 0.00 -1.62 0.95 119.26 125.14 1sx4 h ALA 78 Ca -0.02 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 1sx4 h ALA 78 Cb 0.48 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.20 1sx4 h ALA 78 CO 0.03 -0.23 -0.43 1.03 0.00 0.00 0.00 179.25 179.66 1sx4 h SER 79 N 0.60 0.54 0.12 0.00 0.87 -0.81 -3.22 113.55 111.66 1sx4 h SER 79 Ca 0.49 -0.64 -0.01 0.00 -1.23 0.00 0.00 61.79 60.40 1sx4 h SER 79 Cb 0.93 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.73 1sx4 h SER 79 CO -0.23 1.09 -0.06 0.11 -0.53 0.00 0.00 176.83 177.21 1sx4 h LYS 80 N 0.02 -0.16 -1.24 2.24 1.79 -0.69 -2.63 116.57 115.90 1sx4 h LYS 80 Ca -0.03 0.01 0.43 0.00 -2.18 0.00 0.00 60.65 58.89 1sx4 h LYS 80 Cb 1.08 0.04 -0.13 0.00 -1.58 0.00 0.00 32.23 31.63 1sx4 h LYS 80 CO 0.09 0.13 0.79 0.00 -1.08 0.00 0.00 179.45 179.38 1sx4 n ALA 81 N -2.31 1.23 0.05 3.86 0.00 0.28 -1.48 120.51 122.15 1sx4 n ALA 81 Ca -0.09 0.79 -0.19 0.00 0.00 0.00 0.00 53.44 53.96 1sx4 n ALA 81 Cb 0.19 -0.96 -0.14 0.00 0.00 0.00 0.00 19.45 18.54 1sx4 n ALA 81 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1sx4 h ASN 82 N 0.00 0.46 0.74 0.00 -0.00 -1.48 -2.77 115.58 112.53 1sx4 h ASN 82 Ca 0.80 -0.72 0.00 0.00 -0.00 0.00 0.00 56.30 56.38 1sx4 h ASN 82 Cb 2.56 -0.15 0.00 0.00 -0.00 0.00 0.00 38.32 40.73 1sx4 h ASN 82 CO -0.43 1.61 0.00 0.44 -0.00 0.00 0.00 177.43 179.05 1sx4 h ASP 83 N 0.08 0.00 0.11 1.15 3.32 -0.95 0.33 116.42 120.47 1sx4 h ASP 83 Ca -0.31 0.00 -0.37 0.00 0.02 0.00 0.00 57.03 56.37 1sx4 h ASP 83 Cb 2.05 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 41.56 1sx4 h ASP 83 CO 0.15 0.00 -2.19 0.00 -1.72 0.00 0.00 179.24 175.49 1sx4 n ALA 84 N -1.98 1.25 -1.16 3.45 0.00 -0.69 -4.73 120.51 116.65 1sx4 n ALA 84 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 53.44 52.55 1sx4 n ALA 84 Cb 0.24 -0.43 0.00 0.00 0.00 0.00 0.00 19.45 19.26 1sx4 n ALA 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sx4 n ALA 85 N -3.00 0.61 -3.93 0.00 0.00 -1.05 -5.01 120.51 108.14 1sx4 n ALA 85 Ca -0.35 -0.26 -0.31 0.00 0.00 0.00 0.00 53.44 52.52 1sx4 n ALA 85 Cb 1.04 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.46 1sx4 n ALA 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sx4 n GLY 86 N 0.00 -0.45 3.57 0.00 0.00 0.12 -4.38 105.19 104.05 1sx4 n GLY 86 Ca 0.00 0.09 -0.06 0.00 0.00 0.00 0.00 46.02 46.04 1sx4 n GLY 86 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1sx4 s ASP 87 N -2.99 -0.27 0.00 1.61 -1.08 -1.26 -4.69 116.67 107.99 1sx4 s ASP 87 Ca 0.61 -0.08 0.00 0.00 -0.52 0.00 0.00 52.55 52.56 1sx4 s ASP 87 Cb -0.34 0.35 0.00 0.00 -1.46 0.00 0.00 42.92 41.46 1sx4 s ASP 87 CO 0.75 -0.58 0.00 0.61 0.52 0.00 0.00 175.17 176.47 1sx4 n GLY 88 N -0.27 0.83 0.37 2.66 0.00 -1.26 -4.71 105.19 102.81 1sx4 n GLY 88 Ca -0.07 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.03 1sx4 n GLY 88 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1sx4 h THR 89 N 0.00 0.95 -0.35 2.61 1.35 -1.87 0.11 112.91 115.72 1sx4 h THR 89 Ca 0.00 -0.31 -0.01 0.00 -0.55 0.00 0.00 66.41 65.53 1sx4 h THR 89 Cb 0.00 -0.03 -0.02 0.00 -1.73 0.00 0.00 68.15 66.37 1sx4 h THR 89 CO 0.00 0.17 0.16 0.74 -0.25 0.00 0.00 175.52 176.34 1sx4 h THR 90 N 0.91 1.17 0.99 6.82 2.02 -1.92 -1.58 112.91 121.32 1sx4 h THR 90 Ca 0.44 -0.48 -0.05 0.00 0.77 0.00 0.00 66.41 67.08 1sx4 h THR 90 Cb 0.44 0.85 0.01 0.00 -1.74 0.00 0.00 68.15 67.71 1sx4 h THR 90 CO -0.20 0.18 -0.48 0.74 0.37 0.00 0.00 175.52 176.13 1sx4 h THR 91 N 0.42 0.02 -0.91 3.16 2.02 -1.64 -0.24 112.91 115.74 1sx4 h THR 91 Ca 0.12 -0.01 0.09 0.00 0.77 0.00 0.00 66.41 67.38 1sx4 h THR 91 Cb 0.13 0.02 -0.12 0.00 -1.74 0.00 0.00 68.15 66.44 1sx4 h THR 91 CO -0.01 0.00 -0.51 0.00 0.37 0.00 0.00 175.52 175.37 1sx4 n ALA 92 N -2.67 -0.51 -0.24 6.16 0.00 0.26 -0.06 120.51 123.45 1sx4 n ALA 92 Ca -0.17 0.80 0.05 0.00 0.00 0.00 0.00 53.44 54.12 1sx4 n ALA 92 Cb 0.53 -0.17 0.17 0.00 0.00 0.00 0.00 19.45 19.97 1sx4 n ALA 92 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1sx4 h THR 93 N 0.00 0.62 -0.43 0.00 2.02 -0.32 0.27 112.91 115.06 1sx4 h THR 93 Ca 0.17 -0.13 0.04 0.00 0.77 0.00 0.00 66.41 67.27 1sx4 h THR 93 Cb 0.40 0.22 -0.04 0.00 -1.74 0.00 0.00 68.15 66.99 1sx4 h THR 93 CO -0.87 0.07 0.19 0.58 0.37 0.00 0.00 175.52 175.86 1sx4 h VAL 94 N 0.37 0.93 -0.29 3.16 2.07 0.99 -0.97 116.25 122.50 1sx4 h VAL 94 Ca 0.40 -0.13 -0.08 0.00 0.82 0.00 0.00 66.70 67.71 1sx4 h VAL 94 Cb 0.62 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 1sx4 h VAL 94 CO -0.43 0.07 -0.15 -0.07 0.02 0.00 0.00 177.57 177.01 1sx4 h LEU 95 N 0.38 0.50 -0.03 2.57 3.38 0.31 -2.59 115.31 119.83 1sx4 h LEU 95 Ca 0.19 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1sx4 h LEU 95 Cb 0.14 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1sx4 h LEU 95 CO -0.16 0.67 -0.05 0.00 0.09 0.00 0.00 178.44 178.99 1sx4 h ALA 96 N 1.38 0.05 -0.70 1.53 0.00 -1.00 0.30 119.26 120.81 1sx4 h ALA 96 Ca 0.08 -0.30 0.20 0.00 0.00 0.00 0.00 54.91 54.89 1sx4 h ALA 96 Cb 0.53 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1sx4 h ALA 96 CO 0.03 -0.13 0.55 -0.56 0.00 0.00 0.00 179.25 179.15 1sx4 h GLN 97 N -0.44 0.00 0.01 0.00 -0.00 -1.07 0.23 115.11 113.83 1sx4 h GLN 97 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 58.65 58.61 1sx4 h GLN 97 Cb 0.62 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.10 1sx4 h GLN 97 CO 0.01 0.00 -0.23 0.00 -0.00 0.00 0.00 178.83 178.61 1sx4 h ALA 98 N 1.56 0.04 -0.32 0.06 0.00 -0.99 -0.26 119.26 119.35 1sx4 h ALA 98 Ca 0.33 -0.62 0.03 0.00 0.00 0.00 0.00 54.91 54.66 1sx4 h ALA 98 Cb 1.43 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 19.31 1sx4 h ALA 98 CO -0.00 0.13 0.11 0.82 0.00 0.00 0.00 179.25 180.31 1sx4 h ILE 99 N -0.97 0.92 0.08 0.00 2.04 0.17 -2.33 117.51 117.41 1sx4 h ILE 99 Ca -0.06 -0.09 0.01 0.00 1.00 0.00 0.00 64.86 65.72 1sx4 h ILE 99 Cb 1.07 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 1sx4 h ILE 99 CO -0.03 0.05 -0.13 0.40 0.00 0.00 0.00 178.15 178.44 1sx4 h ILE 100 N 0.25 0.70 -0.04 -0.67 2.04 -0.71 0.24 117.51 119.31 1sx4 h ILE 100 Ca 0.14 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.03 1sx4 h ILE 100 Cb 0.11 0.70 -0.04 0.00 -0.74 0.00 0.00 36.82 36.84 1sx4 h ILE 100 CO -0.14 0.00 -0.20 0.74 0.00 0.00 0.00 178.15 178.55 1sx4 h THR 101 N -0.26 0.52 -0.22 -0.27 2.02 -0.75 0.12 112.91 114.06 1sx4 h THR 101 Ca 0.02 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.16 1sx4 h THR 101 Cb 0.28 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.19 1sx4 h THR 101 CO -0.07 0.00 -0.03 -0.33 0.37 0.00 0.00 175.52 175.46 1sx4 h GLU 102 N -0.30 0.41 0.11 6.66 4.39 -1.36 -2.59 114.58 121.89 1sx4 h GLU 102 Ca 0.07 -0.14 0.00 0.00 0.34 0.00 0.00 59.36 59.63 1sx4 h GLU 102 Cb 0.40 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.01 1sx4 h GLU 102 CO -0.21 0.62 -0.11 0.78 -1.16 0.00 0.00 179.01 178.93 1sx4 h GLY 103 N 0.15 -0.23 1.17 -3.84 0.00 -0.03 -1.81 103.07 98.48 1sx4 h GLY 103 Ca 0.06 0.13 0.08 0.00 0.00 0.00 0.00 47.33 47.59 1sx4 h GLY 103 CO 0.02 -0.12 0.38 1.41 0.00 0.00 0.00 176.54 178.23 1sx4 h LEU 104 N -0.25 0.40 -1.57 3.11 3.38 -0.92 0.97 115.31 120.43 1sx4 h LEU 104 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1sx4 h LEU 104 Cb 0.24 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1sx4 h LEU 104 CO -0.03 0.26 -0.09 0.50 0.09 0.00 0.00 178.44 179.16 1sx4 h LYS 105 N 0.46 0.16 0.00 1.13 3.64 -0.95 0.10 116.57 121.11 1sx4 h LYS 105 Ca 0.25 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 1sx4 h LYS 105 Cb 0.39 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.19 1sx4 h LYS 105 CO -0.07 0.27 -0.41 0.00 -2.27 0.00 0.00 179.45 176.97 1sx4 h ALA 106 N 1.75 0.80 -0.11 5.00 0.00 0.16 -2.58 119.26 124.29 1sx4 h ALA 106 Ca 0.03 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.72 1sx4 h ALA 106 Cb 0.27 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1sx4 h ALA 106 CO 0.01 0.05 -0.68 0.28 0.00 0.00 0.00 179.25 178.91 1sx4 h VAL 107 N 0.00 1.35 0.00 0.00 2.07 0.11 -2.33 116.25 117.45 1sx4 h VAL 107 Ca -0.00 -2.03 -0.02 0.00 0.82 0.00 0.00 66.70 65.47 1sx4 h VAL 107 Cb 1.03 2.01 -0.00 0.00 -1.52 0.00 0.00 31.29 32.81 1sx4 h VAL 107 CO 0.00 0.62 -0.08 0.00 0.02 0.00 0.00 177.57 178.13 1sx4 h ALA 108 N 0.92 1.34 0.00 1.67 0.00 -1.06 0.92 119.26 123.06 1sx4 h ALA 108 Ca -0.02 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1sx4 h ALA 108 Cb 1.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1sx4 h ALA 108 CO 0.12 0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.47 1sx4 n ALA 109 N -2.28 1.78 -0.12 0.00 0.00 -0.89 -4.88 120.51 114.12 1sx4 n ALA 109 Ca -0.02 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1sx4 n ALA 109 Cb 0.19 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.22 1sx4 n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sx4 n GLY 110 N 0.26 0.93 3.77 0.00 0.00 0.32 -5.09 105.19 105.39 1sx4 n GLY 110 Ca 0.03 -0.06 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 1sx4 n GLY 110 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1sx4 s MET 111 N -0.58 2.90 -0.44 1.61 -1.94 -1.10 -4.97 119.30 114.78 1sx4 s MET 111 Ca 0.00 1.40 -0.26 0.00 -1.71 0.00 0.00 55.69 55.13 1sx4 s MET 111 Cb 0.00 -1.96 0.02 0.00 2.01 0.00 0.00 34.83 34.90 1sx4 s MET 111 CO 0.00 -1.17 0.93 1.21 -0.01 0.00 0.00 175.02 175.98 1sx4 s ASN 112 N -2.51 6.55 0.30 3.03 2.47 -1.26 -4.67 114.94 118.86 1sx4 s ASN 112 Ca 0.67 0.25 0.00 0.00 0.42 0.00 0.00 52.86 54.20 1sx4 s ASN 112 Cb -0.21 -2.46 0.51 0.00 -1.45 0.00 0.00 41.25 37.64 1sx4 s ASN 112 CO 0.40 -1.01 1.93 -0.65 -3.72 0.00 0.00 177.10 174.04 1sx4 h PRO 113 N 8.94 1.02 -0.24 0.43 0.11 -1.93 0.15 132.00 140.47 1sx4 h PRO 113 Ca -0.24 -0.06 0.03 0.00 0.11 0.00 0.00 66.00 65.84 1sx4 h PRO 113 Cb 1.08 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.94 1sx4 h PRO 113 CO 1.02 0.68 0.17 0.52 -0.21 0.00 0.00 178.00 180.17 1sx4 h MET 114 N 1.05 0.19 0.00 1.05 2.86 -1.93 0.19 114.93 118.34 1sx4 h MET 114 Ca 0.37 -0.01 -0.19 0.00 -2.06 0.00 0.00 59.70 57.80 1sx4 h MET 114 Cb 0.11 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.70 1sx4 h MET 114 CO -0.12 0.12 -0.91 -0.44 1.06 0.00 0.00 176.91 176.62 1sx4 h ASP 115 N 0.19 0.00 -0.65 1.22 3.32 -1.12 -2.68 116.42 116.71 1sx4 h ASP 115 Ca 0.10 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 1sx4 h ASP 115 Cb 0.17 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.69 1sx4 h ASP 115 CO -0.02 0.91 0.40 -0.07 -1.72 0.00 0.00 179.24 178.74 1sx4 h LEU 116 N 0.00 0.77 0.33 1.55 3.38 -0.17 -0.85 115.31 120.33 1sx4 h LEU 116 Ca -0.01 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1sx4 h LEU 116 Cb 1.62 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 42.17 1sx4 h LEU 116 CO 0.12 0.60 -0.22 0.50 0.09 0.00 0.00 178.44 179.53 1sx4 h LYS 117 N 0.88 -0.52 -0.74 1.13 3.64 -0.74 -0.46 116.57 119.76 1sx4 h LYS 117 Ca 0.23 0.04 0.10 0.00 -1.27 0.00 0.00 60.65 59.74 1sx4 h LYS 117 Cb -0.04 0.12 -0.07 0.00 -0.41 0.00 0.00 32.23 31.83 1sx4 h LYS 117 CO -0.04 -0.34 0.38 0.00 -2.27 0.00 0.00 179.45 177.18 1sx4 h ARG 118 N -0.54 0.63 -0.09 1.90 3.08 -1.08 0.19 114.38 118.48 1sx4 h ARG 118 Ca -0.03 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 1sx4 h ARG 118 Cb 0.45 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.36 1sx4 h ARG 118 CO 0.02 0.41 0.04 0.78 -1.07 0.00 0.00 179.97 180.15 1sx4 h GLY 119 N 0.65 0.14 0.11 0.04 0.00 -1.05 0.28 103.07 103.23 1sx4 h GLY 119 Ca 0.37 -0.07 0.15 0.00 0.00 0.00 0.00 47.33 47.77 1sx4 h GLY 119 CO -0.27 0.07 0.30 -2.22 0.00 0.00 0.00 176.54 174.42 1sx4 h ILE 120 N 0.01 0.63 -0.08 2.60 2.04 -0.30 0.16 117.51 122.56 1sx4 h ILE 120 Ca 0.03 -0.15 -0.13 0.00 1.00 0.00 0.00 64.86 65.62 1sx4 h ILE 120 Cb 0.14 0.17 0.01 0.00 -0.74 0.00 0.00 36.82 36.39 1sx4 h ILE 120 CO -0.00 0.08 -0.45 0.44 0.00 0.00 0.00 178.15 178.22 1sx4 h ASP 121 N 0.43 0.53 -0.15 1.72 3.32 -0.25 -1.13 116.42 120.89 1sx4 h ASP 121 Ca 0.42 -0.66 0.05 0.00 0.02 0.00 0.00 57.03 56.87 1sx4 h ASP 121 Cb 0.66 -0.16 -0.06 0.00 0.22 0.00 0.00 39.33 40.00 1sx4 h ASP 121 CO -0.42 1.10 -0.26 0.50 -1.72 0.00 0.00 179.24 178.44 1sx4 h LYS 122 N -0.00 -0.31 -0.70 3.56 3.64 -0.18 0.13 116.57 122.71 1sx4 h LYS 122 Ca -0.03 0.02 0.13 0.00 -1.27 0.00 0.00 60.65 59.50 1sx4 h LYS 122 Cb 1.10 0.07 -0.13 0.00 -0.41 0.00 0.00 32.23 32.86 1sx4 h LYS 122 CO 0.09 -0.21 -0.25 0.00 -2.27 0.00 0.00 179.45 176.82 1sx4 h ALA 123 N 0.61 0.29 -0.24 5.00 0.00 -0.87 -1.84 119.26 122.20 1sx4 h ALA 123 Ca 0.11 0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 1sx4 h ALA 123 Cb 0.48 0.66 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1sx4 h ALA 123 CO -0.33 -0.51 0.11 0.28 0.00 0.00 0.00 179.25 178.80 1sx4 h VAL 124 N -0.06 1.15 -0.43 0.00 2.07 0.18 -1.45 116.25 117.71 1sx4 h VAL 124 Ca 0.31 -0.43 0.12 0.00 0.82 0.00 0.00 66.70 67.53 1sx4 h VAL 124 Cb 0.55 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 1sx4 h VAL 124 CO -0.74 0.15 0.31 0.74 0.02 0.00 0.00 177.57 178.04 1sx4 h THR 125 N 0.25 0.79 0.15 2.57 2.02 -0.03 0.29 112.91 118.96 1sx4 h THR 125 Ca 0.08 -0.00 -0.30 0.00 0.77 0.00 0.00 66.41 66.96 1sx4 h THR 125 Cb 0.13 0.78 0.02 0.00 -1.74 0.00 0.00 68.15 67.34 1sx4 h THR 125 CO -0.01 0.00 -1.29 0.00 0.37 0.00 0.00 175.52 174.60 1sx4 h ALA 126 N 1.79 0.01 -0.49 6.16 0.00 -1.13 -2.97 119.26 122.63 1sx4 h ALA 126 Ca 0.20 -0.82 -0.07 0.00 0.00 0.00 0.00 54.91 54.22 1sx4 h ALA 126 Cb 0.80 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 1sx4 h ALA 126 CO -0.00 0.77 0.00 0.00 0.00 0.00 0.00 179.25 180.02 1sx4 h ALA 127 N 0.36 1.09 -0.42 0.00 0.00 0.50 -2.13 119.26 118.67 1sx4 h ALA 127 Ca -0.19 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.35 1sx4 h ALA 127 Cb 1.97 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 19.55 1sx4 h ALA 127 CO 0.24 0.58 -0.18 0.28 0.00 0.00 0.00 179.25 180.16 1sx4 h VAL 128 N 0.75 1.27 -0.18 0.00 2.07 -0.58 -0.24 116.25 119.34 1sx4 h VAL 128 Ca 0.15 -1.29 0.01 0.00 0.82 0.00 0.00 66.70 66.39 1sx4 h VAL 128 Cb 0.45 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 1sx4 h VAL 128 CO 0.02 0.44 0.10 -0.33 0.02 0.00 0.00 177.57 177.81 1sx4 h GLU 129 N 0.72 0.20 -0.23 1.57 3.07 -1.34 -0.96 114.58 117.61 1sx4 h GLU 129 Ca 0.11 -0.01 0.06 0.00 -0.50 0.00 0.00 59.36 59.01 1sx4 h GLU 129 Cb 0.70 -0.05 -0.07 0.00 -0.84 0.00 0.00 28.75 28.49 1sx4 h GLU 129 CO 0.05 0.13 -0.31 0.93 -1.40 0.00 0.00 179.01 178.42 1sx4 h GLU 130 N 0.21 -0.32 -0.50 2.33 4.39 -0.74 -1.08 114.58 118.87 1sx4 h GLU 130 Ca 0.07 0.02 0.09 0.00 0.34 0.00 0.00 59.36 59.88 1sx4 h GLU 130 Cb 0.00 0.07 -0.07 0.00 -0.10 0.00 0.00 28.75 28.65 1sx4 h GLU 130 CO -0.04 -0.21 0.08 -0.07 -1.16 0.00 0.00 179.01 177.61 1sx4 h LEU 131 N -0.33 -0.04 -2.56 1.33 3.38 -0.92 0.70 115.31 116.87 1sx4 h LEU 131 Ca 0.12 0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.19 1sx4 h LEU 131 Cb 0.53 0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 1sx4 h LEU 131 CO -0.41 0.01 -0.02 0.11 0.09 0.00 0.00 178.44 178.22 1sx4 h LYS 132 N 0.21 0.00 0.20 1.13 1.57 0.01 -1.89 116.57 117.79 1sx4 h LYS 132 Ca 0.25 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.71 1sx4 h LYS 132 Cb 0.35 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.69 1sx4 h LYS 132 CO -0.34 0.02 -1.37 0.00 -0.57 0.00 0.00 179.45 177.18 1sx4 h ALA 133 N 1.98 -0.07 0.00 3.86 0.00 0.18 -3.22 119.26 121.99 1sx4 h ALA 133 Ca -0.00 -0.83 -0.06 0.00 0.00 0.00 0.00 54.91 54.02 1sx4 h ALA 133 Cb 0.09 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1sx4 h ALA 133 CO 0.00 0.73 -0.28 -0.07 0.00 0.00 0.00 179.25 179.63 1sx4 h LEU 134 N 0.18 0.00 -9.63 0.00 4.07 -0.49 -3.45 115.31 106.00 1sx4 h LEU 134 Ca -0.22 0.00 -0.53 0.00 0.08 0.00 0.00 57.88 57.21 1sx4 h LEU 134 Cb 2.06 0.00 0.06 0.00 1.08 0.00 0.00 40.66 43.86 1sx4 h LEU 134 CO 0.26 0.28 1.02 -0.24 -1.08 0.00 0.00 178.44 178.67 1sx4 n SER 135 N -3.32 3.96 -4.49 -0.43 2.88 -0.78 -4.85 113.62 106.60 1sx4 n SER 135 Ca 0.01 1.05 -0.31 0.00 -1.33 0.00 0.00 58.87 58.30 1sx4 n SER 135 Cb 0.52 -1.56 -0.12 0.00 -0.75 0.00 0.00 64.21 62.30 1sx4 n SER 135 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1sx4 s VAL 136 N 1.38 2.94 0.51 2.46 -7.23 -1.07 -4.90 120.40 114.49 1sx4 s VAL 136 Ca 0.76 -1.21 -0.23 0.00 -1.81 0.00 0.00 61.98 59.50 1sx4 s VAL 136 Cb -0.51 -2.28 -0.06 0.00 0.56 0.00 0.00 36.38 34.09 1sx4 s VAL 136 CO 0.33 0.28 1.35 -2.84 -0.31 0.00 0.00 175.10 173.91 1sx4 s PRO 137 N -1.64 3.39 -0.36 4.82 0.02 -1.26 -2.32 135.00 137.65 1sx4 s PRO 137 Ca 0.16 2.22 -0.05 0.00 0.02 0.00 0.00 61.00 63.34 1sx4 s PRO 137 Cb -0.11 -2.40 0.06 0.00 0.02 0.00 0.00 34.50 32.08 1sx4 s PRO 137 CO 0.07 -0.99 0.13 0.00 -0.33 0.00 0.00 177.00 175.89 1sx4 n SER 139 N 4.75 0.03 -4.91 0.00 3.41 -1.26 -4.44 113.62 111.20 1sx4 n SER 139 Ca -0.10 -0.24 -0.27 0.00 -0.26 0.00 0.00 58.87 57.99 1sx4 n SER 139 Cb 0.43 0.11 0.01 0.00 -0.26 0.00 0.00 64.21 64.50 1sx4 n SER 139 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 1sx4 s ASP 140 N -0.11 6.13 0.33 4.04 1.47 -1.26 -4.99 116.67 122.27 1sx4 s ASP 140 Ca 0.00 0.86 0.01 0.00 1.18 0.00 0.00 52.55 54.60 1sx4 s ASP 140 Cb 0.00 -2.12 0.56 0.00 -0.34 0.00 0.00 42.92 41.01 1sx4 s ASP 140 CO 0.00 -0.67 1.97 0.28 0.68 0.00 0.00 175.17 177.43 1sx4 h SER 141 N 0.16 0.78 -0.64 2.11 0.02 -1.98 -2.88 113.55 111.12 1sx4 h SER 141 Ca -0.47 -0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 60.41 1sx4 h SER 141 Cb 1.22 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 63.53 1sx4 h SER 141 CO 0.61 0.60 0.28 0.50 -1.14 0.00 0.00 176.83 177.68 1sx4 h LYS 142 N 0.89 0.93 -0.04 3.45 3.64 -1.98 -1.69 116.57 121.78 1sx4 h LYS 142 Ca 0.23 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 1sx4 h LYS 142 Cb -0.03 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.63 1sx4 h LYS 142 CO -0.04 0.77 -0.03 0.00 -2.27 0.00 0.00 179.45 177.87 1sx4 h ALA 143 N 1.12 0.05 -0.86 5.00 0.00 -1.94 -2.16 119.26 120.48 1sx4 h ALA 143 Ca 0.22 -0.26 0.20 0.00 0.00 0.00 0.00 54.91 55.07 1sx4 h ALA 143 Cb 0.16 -0.01 -0.16 0.00 0.00 0.00 0.00 17.79 17.78 1sx4 h ALA 143 CO -0.02 -0.18 -0.07 0.82 0.00 0.00 0.00 179.25 179.79 1sx4 h ILE 144 N -0.36 0.18 -0.57 0.00 2.04 -1.50 0.16 117.51 117.47 1sx4 h ILE 144 Ca 0.01 -0.01 -0.04 0.00 1.00 0.00 0.00 64.86 65.81 1sx4 h ILE 144 Cb 0.52 0.14 -0.03 0.00 -0.74 0.00 0.00 36.82 36.71 1sx4 h ILE 144 CO 0.01 0.01 0.20 0.00 0.00 0.00 0.00 178.15 178.37 1sx4 h ALA 145 N 1.84 1.28 -0.72 1.87 0.00 -1.13 -0.52 119.26 121.88 1sx4 h ALA 145 Ca 0.46 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 1sx4 h ALA 145 Cb 0.82 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 1sx4 h ALA 145 CO -0.82 0.52 0.27 1.96 0.00 0.00 0.00 179.25 181.19 1sx4 h GLN 146 N 0.82 1.07 -0.01 0.00 4.20 -0.37 0.24 115.11 121.06 1sx4 h GLN 146 Ca 0.19 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1sx4 h GLN 146 Cb 0.20 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.81 1sx4 h GLN 146 CO -0.01 0.88 -0.03 -0.39 -0.67 0.00 0.00 178.83 178.61 1sx4 h VAL 147 N 1.04 1.45 -0.42 -0.54 -1.51 -0.17 -1.52 116.25 114.59 1sx4 h VAL 147 Ca 0.24 -1.37 0.04 0.00 -1.23 0.00 0.00 66.70 64.38 1sx4 h VAL 147 Cb 0.22 2.34 -0.05 0.00 -2.13 0.00 0.00 31.29 31.67 1sx4 h VAL 147 CO -0.02 0.36 -0.26 1.23 -1.23 0.00 0.00 177.57 177.65 1sx4 h GLY 148 N -0.51 -1.85 -0.11 5.19 0.00 -1.06 -0.52 103.07 104.21 1sx4 h GLY 148 Ca 0.00 0.99 0.19 0.00 0.00 0.00 0.00 47.33 48.51 1sx4 h GLY 148 CO 0.01 -0.55 0.33 -0.84 0.00 0.00 0.00 176.54 175.49 1sx4 h THR 149 N -0.02 0.52 -0.09 4.70 2.02 -0.48 -1.10 112.91 118.46 1sx4 h THR 149 Ca 0.07 -0.13 -0.22 0.00 0.77 0.00 0.00 66.41 66.89 1sx4 h THR 149 Cb 0.19 0.09 0.01 0.00 -1.74 0.00 0.00 68.15 66.70 1sx4 h THR 149 CO -0.41 0.07 -0.83 -0.29 0.37 0.00 0.00 175.52 174.43 1sx4 h ILE 150 N 0.39 1.32 -0.85 3.11 6.09 -0.16 -1.20 117.51 126.20 1sx4 h ILE 150 Ca 0.51 -2.13 0.12 0.00 -1.37 0.00 0.00 64.86 61.98 1sx4 h ILE 150 Cb 0.91 2.14 -0.08 0.00 0.47 0.00 0.00 36.82 40.26 1sx4 h ILE 150 CO -0.50 0.66 0.48 -1.28 -3.07 0.00 0.00 178.15 174.43 1sx4 h SER 151 N 0.40 0.65 -0.36 2.19 0.87 -0.53 -3.12 113.55 113.66 1sx4 h SER 151 Ca -0.06 0.06 -0.23 0.00 -1.23 0.00 0.00 61.79 60.33 1sx4 h SER 151 Cb 1.45 -0.06 -0.09 0.00 -0.44 0.00 0.00 62.40 63.26 1sx4 h SER 151 CO 0.16 0.34 0.18 0.00 -0.53 0.00 0.00 176.83 176.97 1sx4 n ALA 152 N -2.39 5.16 -2.90 6.23 0.00 -0.47 -4.72 120.51 121.41 1sx4 n ALA 152 Ca 0.15 -1.39 -0.11 0.00 0.00 0.00 0.00 53.44 52.09 1sx4 n ALA 152 Cb 0.34 -1.51 -0.01 0.00 0.00 0.00 0.00 19.45 18.27 1sx4 n ALA 152 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1sx4 n ASN 153 N 1.07 -1.88 -0.13 0.00 4.05 -1.18 -2.15 115.26 115.04 1sx4 n ASN 153 Ca 0.26 0.09 0.00 0.00 0.45 0.00 0.00 54.58 55.37 1sx4 n ASN 153 Cb 0.60 -1.68 0.00 0.00 1.23 0.00 0.00 39.78 39.93 1sx4 n ASN 153 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 177.26 173.01 1sx4 n SER 154 N -1.78 -0.82 -4.32 1.20 7.64 -0.48 -4.91 113.62 110.15 1sx4 n SER 154 Ca -0.01 0.00 -0.47 0.00 1.01 0.00 0.00 58.87 59.41 1sx4 n SER 154 Cb 0.51 -0.28 -0.03 0.00 -1.01 0.00 0.00 64.21 63.41 1sx4 n SER 154 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1sx4 s ASP 155 N -2.55 6.61 0.57 6.43 -1.08 -0.91 -4.91 116.67 120.82 1sx4 s ASP 155 Ca 0.00 -2.46 0.30 0.00 -0.52 0.00 0.00 52.55 49.87 1sx4 s ASP 155 Cb 0.00 -2.21 1.46 0.00 -1.46 0.00 0.00 42.92 40.71 1sx4 s ASP 155 CO 0.00 -0.64 1.87 -0.33 0.52 0.00 0.00 175.17 176.59 1sx4 h GLU 156 N 8.06 0.00 0.13 4.34 5.08 -1.91 -1.45 114.58 128.83 1sx4 h GLU 156 Ca 0.00 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.08 1sx4 h GLU 156 Cb 1.06 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.32 1sx4 h GLU 156 CO 0.83 0.00 -1.24 1.15 -1.00 0.00 0.00 179.01 178.74 1sx4 h THR 157 N 0.00 1.45 0.11 1.13 2.02 -1.97 -1.74 112.91 113.91 1sx4 h THR 157 Ca 0.31 -2.91 -0.01 0.00 0.77 0.00 0.00 66.41 64.58 1sx4 h THR 157 Cb 1.47 2.89 0.00 0.00 -1.74 0.00 0.00 68.15 70.76 1sx4 h THR 157 CO -0.00 0.86 -0.05 0.58 0.37 0.00 0.00 175.52 177.27 1sx4 h VAL 158 N 0.11 1.05 -0.54 3.16 2.07 -1.67 -1.09 116.25 119.33 1sx4 h VAL 158 Ca -0.15 -0.61 0.11 0.00 0.82 0.00 0.00 66.70 66.87 1sx4 h VAL 158 Cb 1.95 1.43 -0.11 0.00 -1.52 0.00 0.00 31.29 33.04 1sx4 h VAL 158 CO 0.21 0.15 -0.24 1.23 0.02 0.00 0.00 177.57 178.94 1sx4 h GLY 159 N -0.43 0.12 1.00 2.17 0.00 -1.39 0.74 103.07 105.29 1sx4 h GLY 159 Ca -0.01 0.31 0.01 0.00 0.00 0.00 0.00 47.33 47.63 1sx4 h GLY 159 CO 0.02 -0.22 0.39 1.70 0.00 0.00 0.00 176.54 178.43 1sx4 h LYS 160 N -0.11 0.77 -0.35 4.80 3.64 -1.25 -0.13 116.57 123.94 1sx4 h LYS 160 Ca 0.24 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.47 1sx4 h LYS 160 Cb 0.50 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 1sx4 h LYS 160 CO -0.61 0.51 -0.21 1.25 -2.27 0.00 0.00 179.45 178.11 1sx4 h LEU 161 N 0.79 0.79 0.47 5.20 5.85 0.16 0.35 115.31 128.93 1sx4 h LEU 161 Ca 0.22 -0.42 -0.02 0.00 0.84 0.00 0.00 57.88 58.49 1sx4 h LEU 161 Cb -0.08 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.73 1sx4 h LEU 161 CO -0.05 1.05 -0.23 0.40 -0.34 0.00 0.00 178.44 179.27 1sx4 h ILE 162 N 0.55 0.54 -0.55 4.05 2.04 -0.74 0.40 117.51 123.79 1sx4 h ILE 162 Ca 0.07 -0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.04 1sx4 h ILE 162 Cb 0.77 0.54 -0.09 0.00 -0.74 0.00 0.00 36.82 37.29 1sx4 h ILE 162 CO 0.06 0.00 -0.02 0.00 0.00 0.00 0.00 178.15 178.19 1sx4 h ALA 163 N -0.10 0.51 -0.54 1.87 0.00 -0.72 0.87 119.26 121.15 1sx4 h ALA 163 Ca -0.07 0.17 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1sx4 h ALA 163 Cb 0.49 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1sx4 h ALA 163 CO 0.11 -0.40 0.34 0.93 0.00 0.00 0.00 179.25 180.23 1sx4 h GLU 164 N 0.10 0.67 0.21 0.00 5.08 0.12 -2.64 114.58 118.12 1sx4 h GLU 164 Ca 0.28 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.59 1sx4 h GLU 164 Cb 0.44 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1sx4 h GLU 164 CO -0.48 0.44 -0.10 0.00 -1.00 0.00 0.00 179.01 177.87 1sx4 h ALA 165 N 1.21 -0.29 -1.46 3.43 0.00 0.50 -2.52 119.26 120.14 1sx4 h ALA 165 Ca 0.20 -0.18 0.46 0.00 0.00 0.00 0.00 54.91 55.40 1sx4 h ALA 165 Cb -0.04 0.11 -0.11 0.00 0.00 0.00 0.00 17.79 17.75 1sx4 h ALA 165 CO -0.06 -0.49 0.98 0.52 0.00 0.00 0.00 179.25 180.19 1sx4 h MET 166 N -0.62 0.06 -0.01 0.00 2.86 -0.84 0.49 114.93 116.87 1sx4 h MET 166 Ca -0.03 -0.00 -0.26 0.00 -2.06 0.00 0.00 59.70 57.34 1sx4 h MET 166 Cb 0.45 -0.01 0.02 0.00 0.06 0.00 0.00 31.60 32.12 1sx4 h MET 166 CO 0.05 0.04 -1.02 0.22 1.06 0.00 0.00 176.91 177.26 1sx4 h ASP 167 N 0.06 0.91 0.04 1.22 3.58 -1.08 -3.18 116.42 117.97 1sx4 h ASP 167 Ca 0.83 -0.73 -0.14 0.00 0.42 0.00 0.00 57.03 57.40 1sx4 h ASP 167 Cb 2.82 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 43.58 1sx4 h ASP 167 CO -0.29 1.52 -0.72 0.11 -2.88 0.00 0.00 179.24 176.98 1sx4 h LYS 168 N 0.39 0.08 0.00 0.28 1.57 0.30 -3.32 116.57 115.87 1sx4 h LYS 168 Ca -0.13 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.52 1sx4 h LYS 168 Cb 1.67 0.05 0.00 0.00 0.08 0.00 0.00 32.23 34.03 1sx4 h LYS 168 CO 0.20 1.07 0.00 1.33 -0.57 0.00 0.00 179.45 181.48 1sx4 n VAL 169 N -4.37 1.07 -3.54 0.50 0.24 -0.82 -4.65 118.33 106.76 1sx4 n VAL 169 Ca -0.20 0.29 0.00 0.00 -2.04 0.00 0.00 64.34 62.39 1sx4 n VAL 169 Cb 0.66 -1.11 0.00 0.00 -1.47 0.00 0.00 33.84 31.92 1sx4 n VAL 169 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1sx4 n GLY 170 N -0.20 -0.69 0.09 7.63 0.00 -1.20 -2.86 105.19 107.97 1sx4 n GLY 170 Ca 0.03 -1.25 0.11 0.00 0.00 0.00 0.00 46.02 44.90 1sx4 n GLY 170 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1sx4 n LYS 171 N 0.00 0.62 -0.39 1.61 5.02 -1.26 -4.28 118.16 119.47 1sx4 n LYS 171 Ca 0.00 0.06 0.07 0.00 -2.02 0.00 0.00 58.31 56.43 1sx4 n LYS 171 Cb 0.00 -1.77 0.21 0.00 -0.02 0.00 0.00 35.03 33.46 1sx4 n LYS 171 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1sx4 n GLU 172 N -2.61 2.24 -4.01 1.97 1.02 -1.26 -4.99 120.64 112.99 1sx4 n GLU 172 Ca -0.01 -2.84 -0.31 0.00 -0.02 0.00 0.00 57.16 53.98 1sx4 n GLU 172 Cb 0.57 -1.73 -0.06 0.00 -0.02 0.00 0.00 31.44 30.20 1sx4 n GLU 172 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1sx4 s GLY 173 N -2.35 2.08 0.24 0.62 0.00 -1.21 -3.75 107.32 102.94 1sx4 s GLY 173 Ca 0.39 -0.91 -0.15 0.00 0.00 0.00 0.00 44.72 44.05 1sx4 s GLY 173 CO 0.05 -0.86 0.65 0.14 0.00 0.00 0.00 173.10 173.08 1sx4 s VAL 174 N -1.37 4.75 -0.10 1.40 1.01 -1.23 -4.93 120.40 119.93 1sx4 s VAL 174 Ca 0.29 0.90 0.01 0.00 0.00 0.00 0.00 61.98 63.18 1sx4 s VAL 174 Cb -0.12 -3.70 0.02 0.00 0.00 0.00 0.00 36.38 32.57 1sx4 s VAL 174 CO 0.21 0.03 -0.13 -0.63 0.00 0.00 0.00 175.10 174.59 1sx4 s ILE 175 N -1.72 1.30 0.12 2.22 1.01 -1.26 -1.20 121.20 121.67 1sx4 s ILE 175 Ca 0.46 -0.52 0.10 0.00 0.00 0.00 0.00 60.65 60.69 1sx4 s ILE 175 Cb -0.13 -1.21 -0.04 0.00 0.01 0.00 0.00 42.46 41.09 1sx4 s ILE 175 CO 0.19 0.40 -0.24 0.42 0.00 0.00 0.00 174.94 175.72 1sx4 s THR 176 N 1.06 2.02 -0.09 2.92 -4.23 -0.77 -5.01 115.64 111.53 1sx4 s THR 176 Ca -0.06 -1.69 0.01 0.00 -1.18 0.00 0.00 61.69 58.76 1sx4 s THR 176 Cb -0.15 -1.82 -0.02 0.00 1.34 0.00 0.00 72.50 71.85 1sx4 s THR 176 CO -0.02 -0.00 -0.10 0.68 -0.54 0.00 0.00 174.62 174.64 1sx4 s VAL 177 N -1.18 3.39 0.14 2.29 -7.23 -1.26 0.12 120.40 116.67 1sx4 s VAL 177 Ca 0.11 -0.57 -0.08 0.00 -1.81 0.00 0.00 61.98 59.63 1sx4 s VAL 177 Cb -0.10 -2.40 -0.01 0.00 0.56 0.00 0.00 36.38 34.44 1sx4 s VAL 177 CO 0.06 0.56 0.23 -1.83 -0.31 0.00 0.00 175.10 173.81 1sx4 s GLU 178 N -0.32 1.05 0.39 4.82 -1.05 -0.50 -4.96 118.70 118.13 1sx4 s GLU 178 Ca 0.04 -1.16 -0.27 0.00 -0.15 0.00 0.00 54.97 53.42 1sx4 s GLU 178 Cb -0.13 0.35 -0.11 0.00 -0.44 0.00 0.00 34.13 33.81 1sx4 s GLU 178 CO 0.02 -0.36 1.42 -0.25 0.95 0.00 0.00 175.26 177.04 1sx4 n ASP 179 N -0.16 3.38 -4.91 0.83 8.00 -1.26 -2.83 116.55 119.61 1sx4 n ASP 179 Ca -0.09 1.19 -0.21 0.00 0.71 0.00 0.00 54.79 56.40 1sx4 n ASP 179 Cb 0.63 -1.58 0.06 0.00 -0.02 0.00 0.00 41.12 40.21 1sx4 n ASP 179 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1sx4 s GLY 180 N -0.26 1.81 -0.19 0.44 0.00 -0.71 -4.77 107.32 103.63 1sx4 s GLY 180 Ca 0.56 -1.64 -0.22 0.00 0.00 0.00 0.00 44.72 43.41 1sx4 s GLY 180 CO 0.62 -1.27 0.31 -0.91 0.00 0.00 0.00 173.10 171.85 1sx4 h THR 181 N 0.02 1.04 -1.01 0.90 1.35 -1.91 -3.48 112.91 109.83 1sx4 h THR 181 Ca -0.38 -2.15 0.00 0.00 -0.55 0.00 0.00 66.41 63.33 1sx4 h THR 181 Cb 1.28 2.34 0.00 0.00 -1.73 0.00 0.00 68.15 70.05 1sx4 h THR 181 CO 0.46 0.35 0.00 0.61 -0.25 0.00 0.00 175.52 176.69 1sx4 n GLY 182 N 1.48 1.56 0.07 5.82 0.00 -1.26 -4.99 105.19 107.87 1sx4 n GLY 182 Ca -0.26 -1.81 0.01 0.00 0.00 0.00 0.00 46.02 43.96 1sx4 n GLY 182 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1sx4 n LEU 183 N 0.00 0.27 -4.88 0.99 4.77 -1.26 -3.32 117.00 113.57 1sx4 n LEU 183 Ca 0.00 0.12 -0.34 0.00 -0.03 0.00 0.00 56.01 55.76 1sx4 n LEU 183 Cb 0.00 0.19 -0.05 0.00 -2.33 0.00 0.00 43.42 41.22 1sx4 n LEU 183 CO 0.00 0.20 0.01 -1.10 -1.33 0.00 0.00 177.39 175.16 1sx4 s GLN 184 N -3.00 3.65 0.52 3.23 1.11 -1.26 -3.45 119.66 120.45 1sx4 s GLN 184 Ca -0.07 0.00 -0.21 0.00 0.01 0.00 0.00 55.36 55.09 1sx4 s GLN 184 Cb 0.10 -3.00 -0.06 0.00 -1.01 0.00 0.00 33.01 29.04 1sx4 s GLN 184 CO 0.85 0.58 1.17 -0.51 0.01 0.00 0.00 175.29 177.39 1sx4 s ASP 185 N -1.91 5.77 -0.08 5.90 1.01 -1.26 -4.02 116.67 122.09 1sx4 s ASP 185 Ca 0.33 2.30 -0.07 0.00 0.71 0.00 0.00 52.55 55.82 1sx4 s ASP 185 Cb -0.13 -2.60 0.02 0.00 1.01 0.00 0.00 42.92 41.22 1sx4 s ASP 185 CO 0.19 -1.19 0.20 -0.70 0.21 0.00 0.00 175.17 173.88 1sx4 s GLU 186 N -3.05 0.23 -0.25 8.23 2.12 -0.31 -4.96 118.70 120.72 1sx4 s GLU 186 Ca 0.70 0.29 -0.03 0.00 0.36 0.00 0.00 54.97 56.30 1sx4 s GLU 186 Cb -0.28 0.10 0.02 0.00 0.26 0.00 0.00 34.13 34.22 1sx4 s GLU 186 CO 0.32 -0.04 -0.04 -1.17 -0.54 0.00 0.00 175.26 173.79 1sx4 s LEU 187 N 0.19 3.19 -0.08 2.70 2.96 -1.26 -0.33 118.68 126.05 1sx4 s LEU 187 Ca -0.01 -0.75 -0.10 0.00 -0.22 0.00 0.00 54.13 53.05 1sx4 s LEU 187 Cb -0.02 -1.70 -0.05 0.00 0.50 0.00 0.00 46.19 44.92 1sx4 s LEU 187 CO -0.00 -0.11 0.24 -1.81 -1.32 0.00 0.00 176.35 173.34 1sx4 s ASP 188 N 1.38 6.54 -0.15 3.68 1.01 -0.34 -4.99 116.67 123.80 1sx4 s ASP 188 Ca 0.02 0.64 -0.02 0.00 0.71 0.00 0.00 52.55 53.89 1sx4 s ASP 188 Cb -0.16 -2.14 0.05 0.00 1.01 0.00 0.00 42.92 41.68 1sx4 s ASP 188 CO -0.04 0.37 0.02 -0.69 0.21 0.00 0.00 175.17 175.05 1sx4 s VAL 189 N -0.99 0.45 0.02 -1.27 1.01 -1.26 -0.79 120.40 117.57 1sx4 s VAL 189 Ca 0.18 -0.28 -0.23 0.00 0.00 0.00 0.00 61.98 61.65 1sx4 s VAL 189 Cb -0.14 -0.82 -0.05 0.00 0.00 0.00 0.00 36.38 35.36 1sx4 s VAL 189 CO 0.07 -0.02 0.69 -0.69 0.00 0.00 0.00 175.10 175.15 1sx4 s VAL 190 N 1.91 4.81 -0.25 2.92 1.01 -0.23 -5.01 120.40 125.57 1sx4 s VAL 190 Ca 0.02 1.46 -0.20 0.00 0.00 0.00 0.00 61.98 63.26 1sx4 s VAL 190 Cb -0.15 -4.04 -0.02 0.00 0.00 0.00 0.00 36.38 32.17 1sx4 s VAL 190 CO -0.07 0.38 0.59 -1.61 0.00 0.00 0.00 175.10 174.40 1sx4 s GLU 191 N -0.09 4.10 5.48 2.72 0.41 -1.26 -3.44 118.70 126.63 1sx4 s GLU 191 Ca 0.35 0.48 0.00 0.00 -0.41 0.00 0.00 54.97 55.39 1sx4 s GLU 191 Cb -0.19 -3.65 0.00 0.00 -1.78 0.00 0.00 34.13 28.51 1sx4 s GLU 191 CO 0.20 -0.38 0.00 0.41 -0.49 0.00 0.00 175.26 175.00 1sx4 n GLY 192 N 4.21 1.72 3.70 -1.39 0.00 -1.26 -4.83 105.19 107.35 1sx4 n GLY 192 Ca -0.02 -0.59 -0.36 0.00 0.00 0.00 0.00 46.02 45.05 1sx4 n GLY 192 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1sx4 s MET 193 N 0.00 4.16 -0.26 1.61 -2.45 -1.24 -4.69 119.30 116.43 1sx4 s MET 193 Ca 0.00 -0.17 -0.25 0.00 -1.25 0.00 0.00 55.69 54.02 1sx4 s MET 193 Cb 0.00 -3.47 0.08 0.00 1.25 0.00 0.00 34.83 32.69 1sx4 s MET 193 CO 0.00 0.19 0.77 -1.14 1.05 0.00 0.00 175.02 175.89 1sx4 s GLN 194 N 0.66 0.80 0.34 4.11 0.74 -1.26 -2.13 119.66 122.93 1sx4 s GLN 194 Ca 0.10 0.89 0.05 0.00 0.05 0.00 0.00 55.36 56.45 1sx4 s GLN 194 Cb -0.12 0.39 -0.02 0.00 1.10 0.00 0.00 33.01 34.36 1sx4 s GLN 194 CO 0.01 -0.11 0.18 1.97 -0.55 0.00 0.00 175.29 176.80 1sx4 n PHE 195 N 2.50 -0.22 -0.97 1.67 -1.74 -0.40 -5.00 117.46 113.30 1sx4 n PHE 195 Ca -0.14 -2.46 -0.18 0.00 -0.56 0.00 0.00 57.45 54.11 1sx4 n PHE 195 Cb 0.55 0.11 0.03 0.00 1.52 0.00 0.00 39.48 41.69 1sx4 n PHE 195 CO 0.00 0.00 0.00 -0.25 -0.56 0.00 0.00 176.76 175.95 1sx4 n ASP 196 N -1.67 6.50 -4.07 5.98 8.00 -1.26 -2.48 116.55 127.56 1sx4 n ASP 196 Ca -0.00 -3.10 -0.27 0.00 0.71 0.00 0.00 54.79 52.13 1sx4 n ASP 196 Cb 0.56 -1.08 -0.17 0.00 -0.02 0.00 0.00 41.12 40.41 1sx4 n ASP 196 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1sx4 s ARG 197 N -1.85 2.08 0.45 -1.24 1.81 -1.13 -4.64 118.95 114.43 1sx4 s ARG 197 Ca 0.35 -0.53 0.03 0.00 -1.72 0.00 0.00 55.73 53.85 1sx4 s ARG 197 Cb 0.27 -1.70 0.01 0.00 -0.45 0.00 0.00 34.95 33.07 1sx4 s ARG 197 CO -0.03 0.03 0.64 0.20 -0.68 0.00 0.00 175.30 175.46 1sx4 s GLY 198 N 0.71 1.68 0.59 -3.53 0.00 -1.24 0.01 107.32 105.53 1sx4 s GLY 198 Ca -0.13 -1.28 -0.18 0.00 0.00 0.00 0.00 44.72 43.13 1sx4 s GLY 198 CO 0.03 -1.10 0.60 1.58 0.00 0.00 0.00 173.10 174.21 1sx4 n TYR 199 N -2.03 -0.45 0.49 1.90 0.18 -1.10 -4.24 117.16 111.92 1sx4 n TYR 199 Ca 0.03 0.43 0.12 0.00 1.88 0.00 0.00 57.90 60.37 1sx4 n TYR 199 Cb 0.58 -1.98 0.15 0.00 -0.38 0.00 0.00 39.34 37.71 1sx4 n TYR 199 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 1sx4 h LEU 200 N 0.23 0.00 -7.47 -3.48 3.38 -1.47 -3.44 115.31 103.06 1sx4 h LEU 200 Ca -0.46 -0.18 -0.24 0.00 0.09 0.00 0.00 57.88 57.09 1sx4 h LEU 200 Cb 1.39 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 41.83 1sx4 h LEU 200 CO 0.47 0.09 -0.61 -0.94 0.09 0.00 0.00 178.44 177.54 1sx4 s SER 201 N -4.45 -0.09 0.00 -0.43 1.04 -1.26 -5.02 113.70 103.49 1sx4 s SER 201 Ca 0.05 0.26 0.01 0.00 0.48 0.00 0.00 55.95 56.75 1sx4 s SER 201 Cb 0.13 0.16 0.07 0.00 0.10 0.00 0.00 66.02 66.48 1sx4 s SER 201 CO 0.73 -0.13 0.50 -2.65 0.98 0.00 0.00 173.24 172.67 1sx4 n PRO 202 N 4.01 0.05 0.09 4.02 -0.02 -1.26 -2.27 135.00 139.61 1sx4 n PRO 202 Ca -0.24 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.23 1sx4 n PRO 202 Cb 0.53 -1.42 -0.04 0.00 -0.02 0.00 0.00 33.50 32.54 1sx4 n PRO 202 CO 0.00 0.00 0.00 1.88 1.98 0.00 0.00 175.50 179.36 1sx4 h TYR 203 N 0.00 0.00 -0.07 6.00 0.05 -1.99 -3.26 116.97 117.70 1sx4 h TYR 203 Ca 0.00 0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.80 1sx4 h TYR 203 Cb 0.00 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.74 1sx4 h TYR 203 CO 0.00 0.64 0.07 0.74 -1.05 0.00 0.00 178.16 178.56 1sx4 h PHE 204 N 0.00 0.00 -1.41 4.88 0.04 -1.79 -3.43 116.94 115.23 1sx4 h PHE 204 Ca -0.06 0.00 -0.60 0.00 2.80 0.00 0.00 57.97 60.11 1sx4 h PHE 204 Cb 1.54 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.68 1sx4 h PHE 204 CO 0.00 0.00 1.50 -0.89 -0.60 0.00 0.00 178.31 178.32 1sx4 n ILE 205 N -4.09 0.18 1.27 -0.55 5.41 -1.23 -4.84 119.36 115.50 1sx4 n ILE 205 Ca -0.01 -0.40 0.13 0.00 1.00 0.00 0.00 62.75 63.46 1sx4 n ILE 205 Cb 0.17 -2.08 0.33 0.00 -0.71 0.00 0.00 39.64 37.35 1sx4 n ILE 205 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1sx4 n ASN 206 N 11.53 1.72 -3.56 4.38 0.23 -1.26 -4.62 115.26 123.68 1sx4 n ASN 206 Ca 0.38 -1.43 -0.29 0.00 -0.53 0.00 0.00 54.58 52.72 1sx4 n ASN 206 Cb 0.34 0.10 -0.12 0.00 -2.08 0.00 0.00 39.78 38.02 1sx4 n ASN 206 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 1sx4 s LYS 207 N -2.20 0.97 0.52 -3.83 1.02 -1.19 -4.99 119.74 110.02 1sx4 s LYS 207 Ca 0.30 -1.81 0.26 0.00 0.02 0.00 0.00 55.97 54.74 1sx4 s LYS 207 Cb 0.20 -1.80 1.41 0.00 -0.52 0.00 0.00 37.83 37.12 1sx4 s LYS 207 CO 0.41 -1.23 2.07 -1.00 -0.92 0.00 0.00 175.35 174.68 1sx4 h PRO 208 N 6.60 0.00 -0.85 -1.68 0.13 -1.82 -2.68 132.00 131.70 1sx4 h PRO 208 Ca 0.07 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 65.23 1sx4 h PRO 208 Cb 0.93 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.02 1sx4 h PRO 208 CO 0.38 0.12 0.56 0.93 -0.23 0.00 0.00 178.00 179.76 1sx4 h GLU 209 N 0.00 1.06 0.00 0.86 3.07 -1.95 -0.60 114.58 117.01 1sx4 h GLU 209 Ca -0.00 -0.06 -0.15 0.00 -0.50 0.00 0.00 59.36 58.65 1sx4 h GLU 209 Cb 0.32 -0.24 -0.02 0.00 -0.84 0.00 0.00 28.75 27.97 1sx4 h GLU 209 CO 0.02 0.70 -0.86 1.15 -1.40 0.00 0.00 179.01 178.62 1sx4 h THR 210 N 1.09 0.93 -0.50 1.13 2.02 -2.00 -3.47 112.91 112.11 1sx4 h THR 210 Ca 0.33 -2.41 -0.08 0.00 0.77 0.00 0.00 66.41 65.02 1sx4 h THR 210 Cb -0.03 2.41 -0.01 0.00 -1.74 0.00 0.00 68.15 68.78 1sx4 h THR 210 CO -0.09 0.53 -0.10 0.61 0.37 0.00 0.00 175.52 176.85 1sx4 n GLY 211 N 1.30 0.30 3.11 2.16 0.00 -0.24 -5.04 105.19 106.78 1sx4 n GLY 211 Ca -0.02 -0.75 -0.08 0.00 0.00 0.00 0.00 46.02 45.17 1sx4 n GLY 211 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sx4 s ALA 212 N -2.19 0.26 -0.05 4.61 0.00 -1.04 -4.47 121.76 118.89 1sx4 s ALA 212 Ca 0.00 -0.96 -0.08 0.00 0.00 0.00 0.00 51.96 50.92 1sx4 s ALA 212 Cb 0.00 0.30 -0.05 0.00 0.00 0.00 0.00 23.12 23.37 1sx4 s ALA 212 CO 0.00 -0.37 0.23 0.08 0.00 0.00 0.00 175.76 175.70 1sx4 s VAL 213 N -3.55 5.36 -0.10 0.00 1.01 0.90 -3.20 120.40 120.81 1sx4 s VAL 213 Ca 0.03 0.25 -0.04 0.00 0.00 0.00 0.00 61.98 62.23 1sx4 s VAL 213 Cb 0.05 -3.52 0.05 0.00 0.00 0.00 0.00 36.38 32.96 1sx4 s VAL 213 CO -0.09 0.49 0.20 -0.70 0.00 0.00 0.00 175.10 175.00 1sx4 s GLU 214 N -1.39 0.08 0.04 2.72 2.12 -1.26 -0.63 118.70 120.39 1sx4 s GLU 214 Ca 0.22 0.60 0.05 0.00 0.36 0.00 0.00 54.97 56.20 1sx4 s GLU 214 Cb -0.13 -0.18 -0.02 0.00 0.26 0.00 0.00 34.13 34.05 1sx4 s GLU 214 CO 0.11 -0.28 -0.14 -0.51 -0.54 0.00 0.00 175.26 173.91 1sx4 s LEU 215 N 2.15 2.19 -0.05 2.70 1.43 -0.82 -4.92 118.68 121.36 1sx4 s LEU 215 Ca 0.00 -0.48 0.07 0.00 -1.03 0.00 0.00 54.13 52.69 1sx4 s LEU 215 Cb -0.12 -0.58 -0.01 0.00 0.03 0.00 0.00 46.19 45.51 1sx4 s LEU 215 CO -0.07 0.01 -0.25 -1.61 0.23 0.00 0.00 176.35 174.66 1sx4 s GLU 216 N -1.24 2.40 -1.57 1.70 2.02 -1.26 -0.67 118.70 120.08 1sx4 s GLU 216 Ca 0.01 -0.90 -0.14 0.00 0.02 0.00 0.00 54.97 53.95 1sx4 s GLU 216 Cb -0.08 -2.11 0.10 0.00 0.10 0.00 0.00 34.13 32.14 1sx4 s GLU 216 CO 0.01 0.43 0.89 0.43 0.02 0.00 0.00 175.26 177.04 1sx4 n SER 217 N 2.81 -4.01 -4.81 -0.19 7.64 -0.13 -4.63 113.62 110.31 1sx4 n SER 217 Ca -0.17 -0.86 -0.36 0.00 1.01 0.00 0.00 58.87 58.49 1sx4 n SER 217 Cb 0.52 -3.53 -0.06 0.00 -1.01 0.00 0.00 64.21 60.12 1sx4 n SER 217 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1sx4 s PRO 218 N -6.68 4.34 0.59 1.43 0.04 -1.19 -4.61 135.00 128.92 1sx4 s PRO 218 Ca 0.63 1.01 -0.15 0.00 0.04 0.00 0.00 61.00 62.52 1sx4 s PRO 218 Cb -0.32 -2.81 -0.04 0.00 0.04 0.00 0.00 34.50 31.36 1sx4 s PRO 218 CO 0.86 0.33 1.04 -0.06 0.04 0.00 0.00 177.00 179.21 1sx4 s PHE 219 N -1.59 3.13 -0.13 0.56 0.08 -0.41 -2.79 117.98 116.83 1sx4 s PHE 219 Ca 0.46 1.48 0.01 0.00 0.12 0.00 0.00 56.93 59.00 1sx4 s PHE 219 Cb -0.17 -2.93 0.02 0.00 -0.57 0.00 0.00 43.02 39.37 1sx4 s PHE 219 CO 0.21 -0.94 -0.13 0.42 -0.10 0.00 0.00 175.22 174.69 1sx4 s ILE 220 N -2.58 1.42 -0.35 0.64 1.01 0.13 -0.32 121.20 121.15 1sx4 s ILE 220 Ca 0.62 -0.55 -0.14 0.00 0.00 0.00 0.00 60.65 60.57 1sx4 s ILE 220 Cb -0.14 -1.34 -0.01 0.00 0.01 0.00 0.00 42.46 40.98 1sx4 s ILE 220 CO 0.38 0.43 0.29 -0.22 0.00 0.00 0.00 174.94 175.82 1sx4 s LEU 221 N 1.39 4.57 -0.41 2.97 2.96 0.19 -0.53 118.68 129.82 1sx4 s LEU 221 Ca 0.02 -0.42 -0.11 0.00 -0.22 0.00 0.00 54.13 53.39 1sx4 s LEU 221 Cb -0.13 -2.21 0.05 0.00 0.50 0.00 0.00 46.19 44.40 1sx4 s LEU 221 CO -0.07 -0.30 0.26 -0.76 -1.32 0.00 0.00 176.35 174.15 1sx4 s LEU 222 N 1.82 5.03 -0.24 -0.68 1.43 -1.26 -0.42 118.68 124.36 1sx4 s LEU 222 Ca 0.08 -1.23 0.00 0.00 -1.03 0.00 0.00 54.13 51.95 1sx4 s LEU 222 Cb -0.17 -2.04 0.04 0.00 0.03 0.00 0.00 46.19 44.05 1sx4 s LEU 222 CO 0.11 -0.48 -0.10 0.00 0.23 0.00 0.00 176.35 176.11 1sx4 s ALA 223 N 1.52 2.60 -1.36 4.21 0.00 -0.63 -1.66 121.76 126.45 1sx4 s ALA 223 Ca 0.03 -1.55 -0.11 0.00 0.00 0.00 0.00 51.96 50.33 1sx4 s ALA 223 Cb -0.21 -1.59 0.11 0.00 0.00 0.00 0.00 23.12 21.43 1sx4 s ALA 223 CO 0.05 -0.91 2.07 -3.47 0.00 0.00 0.00 175.76 173.50 1sx4 n ASP 224 N 4.57 4.91 0.00 0.00 2.03 -0.98 -2.16 116.55 124.92 1sx4 n ASP 224 Ca -0.16 -3.00 0.00 0.00 0.52 0.00 0.00 54.79 52.15 1sx4 n ASP 224 Cb 0.45 -1.54 0.00 0.00 -0.72 0.00 0.00 41.12 39.31 1sx4 n ASP 224 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1sx4 n LYS 225 N 4.56 0.00 -1.78 -0.67 2.85 -1.26 -4.33 118.16 117.52 1sx4 n LYS 225 Ca 0.47 0.00 -0.38 0.00 -1.05 0.00 0.00 58.31 57.35 1sx4 n LYS 225 Cb 0.36 0.00 0.05 0.00 -0.65 0.00 0.00 35.03 34.79 1sx4 n LYS 225 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1sx4 s LYS 226 N -2.00 3.03 -0.28 -1.58 1.02 -1.26 -2.85 119.74 115.82 1sx4 s LYS 226 Ca 0.00 2.19 0.03 0.00 0.02 0.00 0.00 55.97 58.21 1sx4 s LYS 226 Cb 0.00 -2.18 0.07 0.00 -0.52 0.00 0.00 37.83 35.21 1sx4 s LYS 226 CO 0.00 -1.26 -0.04 0.42 -0.92 0.00 0.00 175.35 173.55 1sx4 s ILE 227 N -1.33 2.05 -0.16 2.17 1.01 -0.33 -4.93 121.20 119.68 1sx4 s ILE 227 Ca 0.74 -1.80 -0.05 0.00 0.00 0.00 0.00 60.65 59.55 1sx4 s ILE 227 Cb -0.40 -2.31 -0.08 0.00 0.01 0.00 0.00 42.46 39.68 1sx4 s ILE 227 CO 0.46 -0.26 -0.18 -1.20 0.00 0.00 0.00 174.94 173.76 1sx4 n SER 228 N 4.43 1.81 -4.69 3.58 7.64 -1.26 -2.93 113.62 122.20 1sx4 n SER 228 Ca -0.07 0.09 -0.39 0.00 1.01 0.00 0.00 58.87 59.50 1sx4 n SER 228 Cb 0.42 -0.39 -0.06 0.00 -1.01 0.00 0.00 64.21 63.17 1sx4 n SER 228 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1sx4 s ASN 229 N -6.11 6.75 0.46 6.43 0.01 -1.26 -0.22 114.94 121.00 1sx4 s ASN 229 Ca -0.22 0.90 0.25 0.00 -0.71 0.00 0.00 52.86 53.08 1sx4 s ASN 229 Cb 0.08 -2.35 1.02 0.00 0.41 0.00 0.00 41.25 40.41 1sx4 s ASN 229 CO 0.32 -0.17 1.87 -0.29 -1.51 0.00 0.00 177.10 177.32 1sx4 h ILE 230 N 4.97 0.50 -0.87 0.60 2.10 -1.89 -3.06 117.51 119.86 1sx4 h ILE 230 Ca -0.36 -1.00 0.22 0.00 1.08 0.00 0.00 64.86 64.80 1sx4 h ILE 230 Cb 1.16 1.70 -0.13 0.00 -1.09 0.00 0.00 36.82 38.46 1sx4 h ILE 230 CO 0.76 0.19 0.27 0.03 -1.08 0.00 0.00 178.15 178.32 1sx4 h ARG 231 N 0.00 0.25 0.00 2.19 3.08 -2.00 0.15 114.38 118.05 1sx4 h ARG 231 Ca -0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1sx4 h ARG 231 Cb 0.68 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.68 1sx4 h ARG 231 CO 0.03 0.16 0.00 0.93 -1.07 0.00 0.00 179.97 180.02 1sx4 h GLU 232 N 0.26 0.00 0.07 0.04 5.08 -1.96 -3.00 114.58 115.05 1sx4 h GLU 232 Ca 0.54 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 58.53 1sx4 h GLU 232 Cb 1.06 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.27 1sx4 h GLU 232 CO -0.61 0.00 -2.13 -1.33 -1.00 0.00 0.00 179.01 173.94 1sx4 n MET 233 N -2.86 0.70 -0.36 2.33 2.81 0.52 -2.82 117.12 117.44 1sx4 n MET 233 Ca -0.03 0.25 -0.00 0.00 -1.81 0.00 0.00 57.70 56.11 1sx4 n MET 233 Cb 0.06 -1.64 0.05 0.00 -0.71 0.00 0.00 33.22 30.99 1sx4 n MET 233 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1sx4 h LEU 234 N -0.11 -1.32 -1.86 4.03 3.38 -1.37 0.43 115.31 118.49 1sx4 h LEU 234 Ca -0.49 0.30 0.22 0.00 0.09 0.00 0.00 57.88 58.00 1sx4 h LEU 234 Cb 1.90 0.71 -0.04 0.00 0.09 0.00 0.00 40.66 43.32 1sx4 h LEU 234 CO -0.03 -0.30 0.58 1.55 0.09 0.00 0.00 178.44 180.34 1sx4 h PRO 235 N -0.02 0.11 0.00 1.13 0.13 -1.85 -2.59 132.00 128.92 1sx4 h PRO 235 Ca 0.35 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 65.46 1sx4 h PRO 235 Cb 0.61 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 31.71 1sx4 h PRO 235 CO -0.96 0.08 -0.36 0.28 -0.23 0.00 0.00 178.00 176.81 1sx4 h VAL 236 N 0.12 0.17 -1.10 1.56 2.07 -0.42 -3.19 116.25 115.46 1sx4 h VAL 236 Ca 0.41 -1.17 0.32 0.00 0.82 0.00 0.00 66.70 67.08 1sx4 h VAL 236 Cb 1.43 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.51 1sx4 h VAL 236 CO -0.05 0.06 0.93 -0.07 0.02 0.00 0.00 177.57 178.46 1sx4 h LEU 237 N -1.00 0.00 0.02 2.57 3.38 -1.17 0.15 115.31 119.25 1sx4 h LEU 237 Ca -0.03 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.63 1sx4 h LEU 237 Cb 0.42 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.12 1sx4 h LEU 237 CO -0.02 0.00 -1.82 -0.62 0.09 0.00 0.00 178.44 176.07 1sx4 n GLU 238 N -3.82 0.65 0.15 1.13 1.02 -0.99 -2.06 120.64 116.73 1sx4 n GLU 238 Ca 0.24 0.26 0.04 0.00 -0.02 0.00 0.00 57.16 57.68 1sx4 n GLU 238 Cb 1.29 -1.75 0.45 0.00 -0.02 0.00 0.00 31.44 31.40 1sx4 n GLU 238 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1sx4 h ALA 239 N 0.86 1.63 0.10 0.62 0.00 -0.73 -2.68 119.26 119.06 1sx4 h ALA 239 Ca -0.33 -0.16 -0.27 0.00 0.00 0.00 0.00 54.91 54.15 1sx4 h ALA 239 Cb 2.04 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 19.77 1sx4 h ALA 239 CO 0.07 0.28 -1.17 0.28 0.00 0.00 0.00 179.25 178.71 1sx4 h VAL 240 N 0.17 1.45 0.00 0.00 2.07 -1.36 -3.10 116.25 115.48 1sx4 h VAL 240 Ca 0.04 -2.83 -0.02 0.00 0.82 0.00 0.00 66.70 64.71 1sx4 h VAL 240 Cb 0.29 2.79 -0.00 0.00 -1.52 0.00 0.00 31.29 32.84 1sx4 h VAL 240 CO 0.02 0.83 -0.11 0.00 0.02 0.00 0.00 177.57 178.33 1sx4 h ALA 241 N 0.59 1.46 0.07 1.67 0.00 -1.24 -1.73 119.26 120.07 1sx4 h ALA 241 Ca -0.13 -0.10 -0.25 0.00 0.00 0.00 0.00 54.91 54.43 1sx4 h ALA 241 Cb 1.86 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.63 1sx4 h ALA 241 CO 0.20 0.14 -1.14 0.87 0.00 0.00 0.00 179.25 179.32 1sx4 h LYS 242 N 0.00 0.15 0.00 0.00 1.57 -1.49 -3.22 116.57 113.58 1sx4 h LYS 242 Ca -0.00 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.53 1sx4 h LYS 242 Cb 0.26 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.66 1sx4 h LYS 242 CO 0.01 1.11 -0.13 0.00 -0.57 0.00 0.00 179.45 179.88 1sx4 n ALA 243 N -2.45 2.55 -1.44 3.86 0.00 -1.00 -4.95 120.51 117.08 1sx4 n ALA 243 Ca -0.05 -0.13 -0.11 0.00 0.00 0.00 0.00 53.44 53.15 1sx4 n ALA 243 Cb 0.99 -1.39 -0.04 0.00 0.00 0.00 0.00 19.45 19.00 1sx4 n ALA 243 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sx4 n GLY 244 N 1.44 1.05 3.68 0.00 0.00 -0.69 -5.02 105.19 105.65 1sx4 n GLY 244 Ca 0.06 -0.51 -0.28 0.00 0.00 0.00 0.00 46.02 45.29 1sx4 n GLY 244 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sx4 s LYS 245 N -3.15 2.47 1.02 1.61 1.02 -1.23 -5.07 119.74 116.42 1sx4 s LYS 245 Ca 0.00 -0.97 -0.13 0.00 0.02 0.00 0.00 55.97 54.89 1sx4 s LYS 245 Cb 0.00 -2.45 0.20 0.00 -0.52 0.00 0.00 37.83 35.06 1sx4 s LYS 245 CO 0.00 0.50 1.11 -1.25 -0.92 0.00 0.00 175.35 174.78 1sx4 s PRO 246 N -2.62 0.23 -0.04 -1.68 0.04 -1.26 -4.74 135.00 124.94 1sx4 s PRO 246 Ca 0.26 0.36 -0.01 0.00 0.04 0.00 0.00 61.00 61.65 1sx4 s PRO 246 Cb -0.11 -1.73 0.03 0.00 0.04 0.00 0.00 34.50 32.74 1sx4 s PRO 246 CO 0.18 -2.83 0.08 -1.17 0.04 0.00 0.00 177.00 173.30 1sx4 s LEU 247 N -6.47 1.02 -0.09 -3.56 2.96 0.37 -1.29 118.68 111.62 1sx4 s LEU 247 Ca 0.66 0.15 -0.10 0.00 -0.22 0.00 0.00 54.13 54.62 1sx4 s LEU 247 Cb -0.17 0.13 -0.05 0.00 0.50 0.00 0.00 46.19 46.60 1sx4 s LEU 247 CO 0.57 -0.12 0.24 -0.22 -1.32 0.00 0.00 176.35 175.49 1sx4 s LEU 248 N 0.99 4.40 -0.29 -0.68 2.96 0.57 -1.46 118.68 125.17 1sx4 s LEU 248 Ca -0.08 0.63 0.00 0.00 -0.22 0.00 0.00 54.13 54.46 1sx4 s LEU 248 Cb -0.11 -2.26 0.06 0.00 0.50 0.00 0.00 46.19 44.38 1sx4 s LEU 248 CO -0.04 0.36 -0.02 -0.63 -1.32 0.00 0.00 176.35 174.70 1sx4 s ILE 249 N -0.92 2.69 -0.43 6.68 -1.09 -0.08 0.55 121.20 128.61 1sx4 s ILE 249 Ca 0.18 -1.55 -0.06 0.00 -2.23 0.00 0.00 60.65 56.99 1sx4 s ILE 249 Cb -0.14 -2.60 0.11 0.00 -1.58 0.00 0.00 42.46 38.26 1sx4 s ILE 249 CO 0.07 -0.13 0.25 -0.63 -1.23 0.00 0.00 174.94 173.26 1sx4 s ILE 250 N 1.18 3.67 0.44 2.92 1.01 0.44 -2.13 121.20 128.73 1sx4 s ILE 250 Ca -0.05 -1.88 0.05 0.00 0.00 0.00 0.00 60.65 58.77 1sx4 s ILE 250 Cb -0.20 -3.44 -0.06 0.00 0.01 0.00 0.00 42.46 38.77 1sx4 s ILE 250 CO -0.03 -0.68 0.01 0.00 0.00 0.00 0.00 174.94 174.24 1sx4 s ALA 251 N 1.24 3.48 0.47 9.38 0.00 -1.24 -1.60 121.76 133.49 1sx4 s ALA 251 Ca 0.06 -1.65 0.20 0.00 0.00 0.00 0.00 51.96 50.57 1sx4 s ALA 251 Cb -0.24 0.13 1.20 0.00 0.00 0.00 0.00 23.12 24.21 1sx4 s ALA 251 CO -0.02 -0.09 1.93 1.49 0.00 0.00 0.00 175.76 179.07 1sx4 h GLU 252 N 1.63 0.25 0.00 0.00 4.81 -1.28 -0.09 114.58 119.89 1sx4 h GLU 252 Ca -0.44 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 1sx4 h GLU 252 Cb 1.27 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.59 1sx4 h GLU 252 CO 0.79 0.16 0.00 -3.47 -0.73 0.00 0.00 179.01 175.76 1sx4 n ASP 253 N -4.43 0.00 -3.91 1.04 2.03 -1.26 -4.23 116.55 105.79 1sx4 n ASP 253 Ca 0.14 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 55.15 1sx4 n ASP 253 Cb 0.62 0.00 -0.15 0.00 -0.72 0.00 0.00 41.12 40.86 1sx4 n ASP 253 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1sx4 s VAL 254 N -2.00 1.48 0.10 5.18 1.01 -1.26 -1.19 120.40 123.72 1sx4 s VAL 254 Ca 0.00 -1.38 -0.00 0.00 0.00 0.00 0.00 61.98 60.60 1sx4 s VAL 254 Cb 0.00 -1.86 0.02 0.00 0.00 0.00 0.00 36.38 34.54 1sx4 s VAL 254 CO 0.00 -0.27 0.14 -0.62 0.00 0.00 0.00 175.10 174.35 1sx4 n GLU 255 N 4.66 0.40 0.00 2.72 1.02 -1.15 -4.73 120.64 123.56 1sx4 n GLU 255 Ca -0.08 -0.34 0.00 0.00 -0.02 0.00 0.00 57.16 56.72 1sx4 n GLU 255 Cb 0.44 -0.10 0.00 0.00 -0.02 0.00 0.00 31.44 31.75 1sx4 n GLU 255 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1sx4 n GLY 256 N 3.96 -2.70 0.43 0.62 0.00 -1.26 -1.37 105.19 104.87 1sx4 n GLY 256 Ca 0.02 0.58 -0.12 0.00 0.00 0.00 0.00 46.02 46.50 1sx4 n GLY 256 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1sx4 h GLU 257 N 0.00 -0.39 0.71 1.61 4.22 -1.92 0.23 114.58 119.04 1sx4 h GLU 257 Ca 0.00 0.03 -0.03 0.00 0.08 0.00 0.00 59.36 59.43 1sx4 h GLU 257 Cb 0.00 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 1sx4 h GLU 257 CO 0.00 -0.26 -0.42 0.00 -2.18 0.00 0.00 179.01 176.15 1sx4 h ALA 258 N 0.12 -1.24 -0.15 2.92 0.00 -0.70 -3.00 119.26 117.22 1sx4 h ALA 258 Ca 0.09 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 54.81 1sx4 h ALA 258 Cb 0.61 0.51 -0.06 0.00 0.00 0.00 0.00 17.79 18.85 1sx4 h ALA 258 CO -0.55 -1.19 -0.51 1.25 0.00 0.00 0.00 179.25 178.25 1sx4 h LEU 259 N -1.05 -1.62 -0.91 0.00 5.85 -0.92 -0.43 115.31 116.23 1sx4 h LEU 259 Ca -0.10 0.19 0.11 0.00 0.84 0.00 0.00 57.88 58.93 1sx4 h LEU 259 Cb 0.83 0.64 -0.13 0.00 0.37 0.00 0.00 40.66 42.37 1sx4 h LEU 259 CO 0.11 -0.44 -0.44 0.00 -0.34 0.00 0.00 178.44 177.33 1sx4 n ALA 260 N -2.98 -0.32 -0.21 1.25 0.00 0.78 0.08 120.51 119.11 1sx4 n ALA 260 Ca -0.05 0.85 -0.07 0.00 0.00 0.00 0.00 53.44 54.17 1sx4 n ALA 260 Cb 0.35 -0.28 0.03 0.00 0.00 0.00 0.00 19.45 19.55 1sx4 n ALA 260 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1sx4 h THR 261 N 0.00 1.18 -0.68 0.00 2.02 -1.14 0.65 112.91 114.93 1sx4 h THR 261 Ca 0.24 -0.42 0.07 0.00 0.77 0.00 0.00 66.41 67.06 1sx4 h THR 261 Cb 0.47 0.39 -0.06 0.00 -1.74 0.00 0.00 68.15 67.21 1sx4 h THR 261 CO -0.88 0.19 0.37 -0.07 0.37 0.00 0.00 175.52 175.50 1sx4 h LEU 262 N 0.80 0.54 -0.42 2.58 3.38 0.97 0.90 115.31 124.07 1sx4 h LEU 262 Ca 0.21 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.22 1sx4 h LEU 262 Cb 0.00 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1sx4 h LEU 262 CO -0.04 0.34 0.25 0.58 0.09 0.00 0.00 178.44 179.67 1sx4 h VAL 263 N 0.68 1.13 -0.56 1.22 2.07 0.50 -0.01 116.25 121.28 1sx4 h VAL 263 Ca 0.31 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.52 1sx4 h VAL 263 Cb 0.23 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 1sx4 h VAL 263 CO -0.20 0.13 0.23 0.58 0.02 0.00 0.00 177.57 178.33 1sx4 h VAL 264 N 0.55 1.20 -0.03 2.57 2.07 -0.08 -2.13 116.25 120.39 1sx4 h VAL 264 Ca 0.15 -0.60 -0.25 0.00 0.82 0.00 0.00 66.70 66.81 1sx4 h VAL 264 Cb -0.01 0.52 0.02 0.00 -1.52 0.00 0.00 31.29 30.30 1sx4 h VAL 264 CO -0.03 0.24 -0.97 0.78 0.02 0.00 0.00 177.57 177.61 1sx4 h ASN 265 N 0.79 0.91 -0.25 0.57 -0.26 -0.31 -3.03 115.58 114.00 1sx4 h ASN 265 Ca 0.19 -0.72 -0.18 0.00 -0.56 0.00 0.00 56.30 55.04 1sx4 h ASN 265 Cb 0.14 -0.28 -0.00 0.00 -1.06 0.00 0.00 38.32 37.12 1sx4 h ASN 265 CO -0.02 1.50 -0.51 0.71 -1.06 0.00 0.00 177.43 178.05 1sx4 h THR 266 N 0.41 1.28 0.13 2.81 1.35 -1.02 -2.79 112.91 115.07 1sx4 h THR 266 Ca -0.11 -1.70 0.02 0.00 -0.55 0.00 0.00 66.41 64.06 1sx4 h THR 266 Cb 1.62 1.60 -0.04 0.00 -1.73 0.00 0.00 68.15 69.59 1sx4 h THR 266 CO 0.19 0.55 -0.40 -0.03 -0.25 0.00 0.00 175.52 175.58 1sx4 h MET 267 N 0.65 -0.62 0.00 4.72 -1.53 -1.42 -2.86 114.93 113.87 1sx4 h MET 267 Ca 0.02 0.04 0.00 0.00 -3.44 0.00 0.00 59.70 56.33 1sx4 h MET 267 Cb 1.11 0.14 0.00 0.00 -0.55 0.00 0.00 31.60 32.30 1sx4 h MET 267 CO 0.11 -0.41 0.00 0.54 0.14 0.00 0.00 176.91 177.29 1sx4 n ARG 268 N -5.46 0.45 -2.15 0.39 1.74 -1.15 -4.79 116.66 105.71 1sx4 n ARG 268 Ca -0.07 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.92 1sx4 n ARG 268 Cb 0.37 -1.13 -0.01 0.00 -1.02 0.00 0.00 32.46 30.68 1sx4 n ARG 268 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1sx4 n GLY 269 N -0.06 0.03 0.03 -0.13 0.00 -1.08 -4.98 105.19 99.01 1sx4 n GLY 269 Ca 0.03 -0.51 -0.01 0.00 0.00 0.00 0.00 46.02 45.53 1sx4 n GLY 269 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1sx4 h ILE 270 N 0.00 0.00 -3.54 -0.61 2.04 -1.68 -3.47 117.51 110.25 1sx4 h ILE 270 Ca -0.21 -0.20 -0.31 0.00 1.00 0.00 0.00 64.86 65.14 1sx4 h ILE 270 Cb 1.14 0.00 -0.33 0.00 -0.74 0.00 0.00 36.82 36.89 1sx4 h ILE 270 CO 0.25 0.00 -0.73 -0.69 0.00 0.00 0.00 178.15 176.98 1sx4 s VAL 271 N -1.57 0.03 -0.33 1.67 1.01 -1.24 -5.01 120.40 114.96 1sx4 s VAL 271 Ca -0.01 0.15 -0.29 0.00 0.00 0.00 0.00 61.98 61.84 1sx4 s VAL 271 Cb 0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 36.38 36.23 1sx4 s VAL 271 CO 0.02 0.10 1.56 -0.54 0.00 0.00 0.00 175.10 176.25 1sx4 s LYS 272 N 0.94 3.60 0.05 2.72 3.01 -1.26 -4.03 119.74 124.77 1sx4 s LYS 272 Ca -0.08 1.30 -0.01 0.00 -1.01 0.00 0.00 55.97 56.16 1sx4 s LYS 272 Cb -0.12 -4.06 -0.03 0.00 -1.01 0.00 0.00 37.83 32.61 1sx4 s LYS 272 CO -0.02 -1.53 -0.01 0.08 0.51 0.00 0.00 175.35 174.37 1sx4 s VAL 273 N 5.67 0.20 0.05 3.17 1.01 -1.26 -0.48 120.40 128.77 1sx4 s VAL 273 Ca 0.69 -1.64 -0.12 0.00 0.00 0.00 0.00 61.98 60.90 1sx4 s VAL 273 Cb -0.19 -1.34 0.02 0.00 0.00 0.00 0.00 36.38 34.86 1sx4 s VAL 273 CO 0.31 -0.91 0.28 0.00 0.00 0.00 0.00 175.10 174.78 1sx4 s ALA 274 N -3.58 -0.58 -0.03 5.51 0.00 -0.53 -4.88 121.76 117.67 1sx4 s ALA 274 Ca 0.04 -0.13 -0.07 0.00 0.00 0.00 0.00 51.96 51.80 1sx4 s ALA 274 Cb 0.05 0.36 0.01 0.00 0.00 0.00 0.00 23.12 23.54 1sx4 s ALA 274 CO -0.09 -0.43 0.16 0.00 0.00 0.00 0.00 175.76 175.40 1sx4 s ALA 275 N -2.81 -0.40 -0.23 0.00 0.00 -1.26 -0.90 121.76 116.17 1sx4 s ALA 275 Ca -0.03 0.20 -0.20 0.00 0.00 0.00 0.00 51.96 51.93 1sx4 s ALA 275 Cb 0.00 -0.09 0.06 0.00 0.00 0.00 0.00 23.12 23.09 1sx4 s ALA 275 CO -0.05 -0.15 0.60 0.14 0.00 0.00 0.00 175.76 176.30 1sx4 s VAL 276 N -0.64 -0.00 0.97 0.00 -7.23 -0.90 -1.02 120.40 111.57 1sx4 s VAL 276 Ca -0.07 0.00 -0.11 0.00 -1.81 0.00 0.00 61.98 59.99 1sx4 s VAL 276 Cb -0.04 -0.84 0.14 0.00 0.56 0.00 0.00 36.38 36.19 1sx4 s VAL 276 CO 0.01 0.00 0.89 0.29 -0.31 0.00 0.00 175.10 175.98 1sx4 n LYS 277 N 2.95 -0.72 -2.08 4.82 5.02 -1.26 -3.66 118.16 123.24 1sx4 n LYS 277 Ca -0.15 -0.15 -0.32 0.00 -2.02 0.00 0.00 58.31 55.67 1sx4 n LYS 277 Cb 0.56 -2.19 0.00 0.00 -0.02 0.00 0.00 35.03 33.39 1sx4 n LYS 277 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1sx4 s ALA 278 N -2.53 2.83 0.21 7.82 0.00 -0.05 -4.75 121.76 125.29 1sx4 s ALA 278 Ca 0.64 0.29 -0.30 0.00 0.00 0.00 0.00 51.96 52.59 1sx4 s ALA 278 Cb -0.22 -3.19 -0.08 0.00 0.00 0.00 0.00 23.12 19.62 1sx4 s ALA 278 CO 0.62 -0.71 1.12 -1.25 0.00 0.00 0.00 175.76 175.54 1sx4 s PRO 279 N -4.21 4.59 2.21 0.00 0.04 -1.26 -4.86 135.00 131.50 1sx4 s PRO 279 Ca 0.62 1.78 0.00 0.00 0.04 0.00 0.00 61.00 63.44 1sx4 s PRO 279 Cb -0.14 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.16 1sx4 s PRO 279 CO 0.38 0.09 0.00 0.41 0.04 0.00 0.00 177.00 177.92 1sx4 n GLY 280 N 1.79 -0.51 0.00 0.56 0.00 -1.26 -4.28 105.19 101.49 1sx4 n GLY 280 Ca 0.02 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.07 1sx4 n GLY 280 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1sx4 n PHE 281 N -1.46 0.00 0.00 1.61 -1.74 -1.26 -4.81 117.46 109.80 1sx4 n PHE 281 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.89 1sx4 n PHE 281 Cb 0.00 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.00 1sx4 n PHE 281 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1sx4 n GLY 282 N 1.03 3.39 0.13 4.97 0.00 -1.26 -3.20 105.19 110.25 1sx4 n GLY 282 Ca 0.00 -0.07 -0.19 0.00 0.00 0.00 0.00 46.02 45.76 1sx4 n GLY 282 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1sx4 h ASP 283 N 0.00 0.47 0.13 1.61 3.32 -2.00 -3.34 116.42 116.61 1sx4 h ASP 283 Ca 0.00 -0.70 -0.04 0.00 0.02 0.00 0.00 57.03 56.31 1sx4 h ASP 283 Cb 0.00 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 1sx4 h ASP 283 CO 0.00 1.59 -0.15 0.08 -1.72 0.00 0.00 179.24 179.04 1sx4 h ARG 284 N 0.08 0.04 -0.40 3.56 0.11 -1.96 -3.16 114.38 112.66 1sx4 h ARG 284 Ca -0.30 -0.01 0.05 0.00 0.10 0.00 0.00 59.98 59.82 1sx4 h ARG 284 Cb 2.05 -0.01 -0.08 0.00 1.11 0.00 0.00 29.97 33.05 1sx4 h ARG 284 CO 0.16 0.20 -0.51 -0.09 0.10 0.00 0.00 179.97 179.83 1sx4 h ARG 285 N 0.04 -0.33 -0.52 0.08 2.43 -1.67 1.27 114.38 115.70 1sx4 h ARG 285 Ca 0.01 0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.24 1sx4 h ARG 285 Cb 0.29 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.88 1sx4 h ARG 285 CO 0.02 -0.22 0.27 0.87 -1.51 0.00 0.00 179.97 179.40 1sx4 h LYS 286 N -0.34 0.51 -0.59 0.20 1.57 -1.77 1.05 116.57 117.20 1sx4 h LYS 286 Ca 0.07 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.77 1sx4 h LYS 286 Cb 0.53 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.70 1sx4 h LYS 286 CO -0.56 0.34 0.16 0.00 -0.57 0.00 0.00 179.45 178.82 1sx4 h ALA 287 N 1.27 0.77 -0.04 3.86 0.00 -1.39 -1.56 119.26 122.17 1sx4 h ALA 287 Ca 0.23 -0.22 -0.19 0.00 0.00 0.00 0.00 54.91 54.73 1sx4 h ALA 287 Cb 0.12 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1sx4 h ALA 287 CO -0.15 0.46 -0.78 1.98 0.00 0.00 0.00 179.25 180.76 1sx4 h MET 288 N 0.84 0.32 -0.40 0.00 4.05 0.24 -2.42 114.93 117.56 1sx4 h MET 288 Ca 0.19 -0.29 -0.05 0.00 -0.28 0.00 0.00 59.70 59.27 1sx4 h MET 288 Cb 0.32 0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 31.17 1sx4 h MET 288 CO -0.00 0.96 0.05 1.25 0.23 0.00 0.00 176.91 179.40 1sx4 h LEU 289 N 0.21 0.56 -0.98 3.39 6.46 0.11 -1.84 115.31 123.23 1sx4 h LEU 289 Ca -0.04 -0.10 0.03 0.00 -0.12 0.00 0.00 57.88 57.65 1sx4 h LEU 289 Cb 1.37 -0.15 -0.06 0.00 -0.73 0.00 0.00 40.66 41.10 1sx4 h LEU 289 CO 0.13 0.60 0.64 -0.61 -0.62 0.00 0.00 178.44 178.58 1sx4 h GLN 290 N 0.59 1.22 -0.26 1.25 5.75 -0.97 -1.32 115.11 121.37 1sx4 h GLN 290 Ca 0.13 -0.07 0.06 0.00 -0.15 0.00 0.00 58.65 58.62 1sx4 h GLN 290 Cb 0.29 -0.27 -0.07 0.00 1.07 0.00 0.00 27.48 28.50 1sx4 h GLN 290 CO 0.00 0.81 -0.21 -0.44 -2.65 0.00 0.00 178.83 176.34 1sx4 h ASP 291 N 1.26 -0.70 -1.00 -0.69 3.32 -0.86 -0.98 116.42 116.76 1sx4 h ASP 291 Ca 0.38 0.13 0.05 0.00 0.02 0.00 0.00 57.03 57.62 1sx4 h ASP 291 Cb -0.03 0.34 -0.06 0.00 0.22 0.00 0.00 39.33 39.79 1sx4 h ASP 291 CO -0.11 -0.25 0.65 0.40 -1.72 0.00 0.00 179.24 178.21 1sx4 h ILE 292 N -0.21 1.12 0.39 0.35 2.04 -1.12 -1.17 117.51 118.92 1sx4 h ILE 292 Ca 0.14 -0.42 -0.00 0.00 1.00 0.00 0.00 64.86 65.58 1sx4 h ILE 292 Cb 0.43 -0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 36.28 1sx4 h ILE 292 CO -0.38 0.22 -0.45 0.00 0.00 0.00 0.00 178.15 177.54 1sx4 h ALA 293 N 1.44 -0.96 -0.34 1.87 0.00 -0.25 -2.77 119.26 118.24 1sx4 h ALA 293 Ca 0.42 -0.15 0.07 0.00 0.00 0.00 0.00 54.91 55.26 1sx4 h ALA 293 Cb 0.10 0.67 -0.08 0.00 0.00 0.00 0.00 17.79 18.48 1sx4 h ALA 293 CO -0.15 -1.09 -0.17 1.15 0.00 0.00 0.00 179.25 179.00 1sx4 h THR 294 N -0.87 0.50 -0.35 0.00 2.02 -0.56 0.45 112.91 114.10 1sx4 h THR 294 Ca -0.04 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.17 1sx4 h THR 294 Cb 0.78 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 1sx4 h THR 294 CO -0.10 0.00 0.23 0.25 0.37 0.00 0.00 175.52 176.27 1sx4 h LEU 295 N -0.11 0.30 -2.30 2.58 7.12 -1.17 -2.44 115.31 119.29 1sx4 h LEU 295 Ca 0.17 -0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.18 1sx4 h LEU 295 Cb 0.38 -0.07 0.00 0.00 -0.53 0.00 0.00 40.66 40.43 1sx4 h LEU 295 CO -0.41 0.21 0.00 0.35 -0.13 0.00 0.00 178.44 178.46 1sx4 n THR 296 N -4.49 0.60 -3.48 1.05 -2.24 -0.97 -2.41 114.28 102.34 1sx4 n THR 296 Ca 0.03 -0.80 -0.18 0.00 -2.27 0.00 0.00 64.05 60.83 1sx4 n THR 296 Cb 0.16 0.78 0.08 0.00 -2.10 0.00 0.00 70.33 69.25 1sx4 n THR 296 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1sx4 n GLY 297 N 0.46 -0.37 3.79 3.38 0.00 0.13 -0.83 105.19 111.75 1sx4 n GLY 297 Ca 0.08 0.12 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 1sx4 n GLY 297 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1sx4 s GLY 298 N -4.27 2.78 -0.16 -0.02 0.00 0.12 -4.47 107.32 101.31 1sx4 s GLY 298 Ca 0.05 -0.84 0.01 0.00 0.00 0.00 0.00 44.72 43.94 1sx4 s GLY 298 CO 0.74 -2.11 -0.19 -1.59 0.00 0.00 0.00 173.10 169.95 1sx4 s THR 299 N -2.82 1.95 0.25 0.90 2.01 0.35 -4.48 115.64 113.80 1sx4 s THR 299 Ca 0.17 -0.88 -0.31 0.00 0.31 0.00 0.00 61.69 60.98 1sx4 s THR 299 Cb 0.01 -1.77 -0.12 0.00 0.01 0.00 0.00 72.50 70.64 1sx4 s THR 299 CO 0.10 0.52 1.64 0.52 -0.69 0.00 0.00 174.62 176.71 1sx4 n VAL 300 N 4.54 0.52 -3.73 3.82 0.31 -1.26 -4.72 118.33 117.81 1sx4 n VAL 300 Ca -0.20 -0.13 -0.36 0.00 -0.01 0.00 0.00 64.34 63.64 1sx4 n VAL 300 Cb 0.50 -1.92 -0.10 0.00 -0.91 0.00 0.00 33.84 31.42 1sx4 n VAL 300 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1sx4 s ILE 301 N 0.54 3.67 0.06 2.52 1.01 -0.66 -4.99 121.20 123.35 1sx4 s ILE 301 Ca 0.70 -3.02 0.06 0.00 0.00 0.00 0.00 60.65 58.39 1sx4 s ILE 301 Cb -0.52 -3.40 -0.04 0.00 0.01 0.00 0.00 42.46 38.52 1sx4 s ILE 301 CO 0.41 -0.88 -0.13 -0.94 0.00 0.00 0.00 174.94 173.40 1sx4 s SER 302 N 0.59 4.18 0.00 3.58 1.04 -1.26 -2.32 113.70 119.51 1sx4 s SER 302 Ca 0.17 -0.36 0.19 0.00 0.48 0.00 0.00 55.95 56.44 1sx4 s SER 302 Cb -0.20 -0.79 1.15 0.00 0.10 0.00 0.00 66.02 66.28 1sx4 s SER 302 CO -0.03 0.23 1.56 -0.62 0.98 0.00 0.00 173.24 175.36 1sx4 n GLU 303 N 1.25 0.67 0.11 4.02 1.02 -1.26 -3.05 120.64 123.40 1sx4 n GLU 303 Ca -0.15 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.76 1sx4 n GLU 303 Cb 0.52 -1.45 -0.14 0.00 -0.02 0.00 0.00 31.44 30.36 1sx4 n GLU 303 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1sx4 h GLU 304 N 0.00 0.59 -0.43 3.49 5.08 -1.90 -2.99 114.58 118.42 1sx4 h GLU 304 Ca 0.00 -0.85 0.00 0.00 -1.00 0.00 0.00 59.36 57.51 1sx4 h GLU 304 Cb 0.00 0.29 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1sx4 h GLU 304 CO 0.00 1.39 0.00 -0.89 -1.00 0.00 0.00 179.01 178.51 1sx4 n ILE 305 N -3.80 0.27 -2.97 3.13 5.41 -1.18 -4.90 119.36 115.32 1sx4 n ILE 305 Ca -0.15 -0.19 -0.01 0.00 1.00 0.00 0.00 62.75 63.41 1sx4 n ILE 305 Cb 1.01 -0.13 0.00 0.00 -0.71 0.00 0.00 39.64 39.82 1sx4 n ILE 305 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1sx4 n GLY 306 N 0.47 -1.17 3.27 7.39 0.00 -1.13 -5.05 105.19 108.97 1sx4 n GLY 306 Ca 0.04 0.44 -0.19 0.00 0.00 0.00 0.00 46.02 46.31 1sx4 n GLY 306 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1sx4 s MET 307 N -3.09 1.11 0.01 1.61 -1.94 -1.17 -5.01 119.30 110.81 1sx4 s MET 307 Ca 0.03 -1.31 0.06 0.00 -1.71 0.00 0.00 55.69 52.76 1sx4 s MET 307 Cb -0.00 -1.05 -0.02 0.00 2.01 0.00 0.00 34.83 35.77 1sx4 s MET 307 CO 0.70 0.20 -0.18 -1.21 -0.01 0.00 0.00 175.02 174.52 1sx4 s GLU 308 N -2.76 1.39 0.18 2.03 2.02 -1.26 -4.27 118.70 116.04 1sx4 s GLU 308 Ca 0.12 -0.73 -0.13 0.00 0.02 0.00 0.00 54.97 54.25 1sx4 s GLU 308 Cb -0.05 -1.39 0.17 0.00 0.10 0.00 0.00 34.13 32.96 1sx4 s GLU 308 CO 0.04 0.37 1.73 -0.07 0.02 0.00 0.00 175.26 177.35 1sx4 h LEU 309 N 5.42 0.07 -0.83 1.80 3.38 -1.92 -2.63 115.31 120.60 1sx4 h LEU 309 Ca -0.39 0.07 0.19 0.00 0.09 0.00 0.00 57.88 57.85 1sx4 h LEU 309 Cb 1.15 0.09 -0.12 0.00 0.09 0.00 0.00 40.66 41.87 1sx4 h LEU 309 CO 0.47 0.07 0.29 -0.33 0.09 0.00 0.00 178.44 179.03 1sx4 h GLU 310 N 0.27 0.34 -3.51 1.13 3.07 -1.86 -2.37 114.58 111.64 1sx4 h GLU 310 Ca 0.24 -0.02 -0.75 0.00 -0.50 0.00 0.00 59.36 58.32 1sx4 h GLU 310 Cb 0.29 -0.08 -0.14 0.00 -0.84 0.00 0.00 28.75 27.98 1sx4 h GLU 310 CO -0.28 0.22 2.19 1.63 -1.40 0.00 0.00 179.01 181.37 1sx4 n LYS 311 N -5.09 3.57 -3.54 2.33 5.02 -0.99 -4.74 118.16 114.72 1sx4 n LYS 311 Ca 0.18 -3.40 -0.18 0.00 -2.02 0.00 0.00 58.31 52.89 1sx4 n LYS 311 Cb 0.56 -2.95 -0.13 0.00 -0.02 0.00 0.00 35.03 32.48 1sx4 n LYS 311 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1sx4 s ALA 312 N 0.65 -0.27 0.82 7.82 0.00 -0.89 -4.70 121.76 125.19 1sx4 s ALA 312 Ca 0.41 0.36 -0.12 0.00 0.00 0.00 0.00 51.96 52.61 1sx4 s ALA 312 Cb 0.11 -1.21 0.08 0.00 0.00 0.00 0.00 23.12 22.10 1sx4 s ALA 312 CO -0.01 -1.06 1.17 0.95 0.00 0.00 0.00 175.76 176.81 1sx4 s THR 313 N 2.33 2.10 0.40 0.00 -4.23 -1.26 -4.54 115.64 110.43 1sx4 s THR 313 Ca 0.06 0.03 0.21 0.00 -1.18 0.00 0.00 61.69 60.81 1sx4 s THR 313 Cb -0.15 -2.99 0.41 0.00 1.34 0.00 0.00 72.50 71.11 1sx4 s THR 313 CO -0.11 -0.04 1.71 -0.07 -0.54 0.00 0.00 174.62 175.57 1sx4 h LEU 314 N -1.10 0.40 -1.25 4.79 3.38 -1.94 -2.27 115.31 117.33 1sx4 h LEU 314 Ca -0.47 0.12 0.11 0.00 0.09 0.00 0.00 57.88 57.73 1sx4 h LEU 314 Cb 1.33 0.07 -0.06 0.00 0.09 0.00 0.00 40.66 42.08 1sx4 h LEU 314 CO 0.65 -0.03 0.57 -0.08 0.09 0.00 0.00 178.44 179.64 1sx4 h GLU 315 N 0.30 0.78 0.00 1.13 4.81 -2.00 -1.18 114.58 118.41 1sx4 h GLU 315 Ca 0.69 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.83 1sx4 h GLU 315 Cb 1.84 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 31.04 1sx4 h GLU 315 CO -0.39 0.52 -0.19 -0.44 -0.73 0.00 0.00 179.01 177.79 1sx4 h ASP 316 N 0.81 0.00 -3.66 1.04 3.32 -1.77 -3.44 116.42 112.71 1sx4 h ASP 316 Ca 0.42 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.94 1sx4 h ASP 316 Cb 0.50 0.00 0.06 0.00 0.22 0.00 0.00 39.33 40.11 1sx4 h ASP 316 CO -0.18 0.19 0.68 -0.76 -1.72 0.00 0.00 179.24 177.45 1sx4 s LEU 317 N -8.49 4.41 1.11 1.55 1.02 -0.45 0.13 118.68 117.96 1sx4 s LEU 317 Ca -0.04 2.65 -0.16 0.00 0.02 0.00 0.00 54.13 56.61 1sx4 s LEU 317 Cb 0.15 -3.64 0.24 0.00 0.02 0.00 0.00 46.19 42.97 1sx4 s LEU 317 CO 0.69 -0.60 1.11 -0.83 0.02 0.00 0.00 176.35 176.74 1sx4 s GLY 318 N -0.10 1.58 -0.04 -3.19 0.00 0.31 -4.42 107.32 101.47 1sx4 s GLY 318 Ca 0.53 -0.71 -0.20 0.00 0.00 0.00 0.00 44.72 44.34 1sx4 s GLY 318 CO 0.48 0.05 0.44 1.62 0.00 0.00 0.00 173.10 175.69 1sx4 s GLN 319 N -5.24 0.78 0.33 2.90 0.74 -0.01 0.21 119.66 119.37 1sx4 s GLN 319 Ca 0.69 0.02 0.01 0.00 0.05 0.00 0.00 55.36 56.12 1sx4 s GLN 319 Cb -0.13 0.36 -0.01 0.00 1.10 0.00 0.00 33.01 34.32 1sx4 s GLN 319 CO 0.56 -0.22 0.39 0.00 -0.55 0.00 0.00 175.29 175.48 1sx4 s ALA 320 N -1.15 1.13 -0.19 1.58 0.00 -1.12 -1.66 121.76 120.35 1sx4 s ALA 320 Ca -0.12 -1.70 0.19 0.00 0.00 0.00 0.00 51.96 50.34 1sx4 s ALA 320 Cb -0.03 1.27 -0.03 0.00 0.00 0.00 0.00 23.12 24.33 1sx4 s ALA 320 CO 0.06 -0.74 1.04 0.87 0.00 0.00 0.00 175.76 176.99 1sx4 h LYS 321 N 2.15 0.00 -1.56 0.00 1.57 -1.31 -3.15 116.57 114.26 1sx4 h LYS 321 Ca -0.28 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.58 1sx4 h LYS 321 Cb 1.24 0.00 -0.25 0.00 0.08 0.00 0.00 32.23 33.30 1sx4 h LYS 321 CO 0.39 0.18 0.51 1.03 -0.57 0.00 0.00 179.45 180.99 1sx4 s ARG 322 N -3.11 0.53 0.05 3.15 0.52 -1.21 -0.95 118.95 117.92 1sx4 s ARG 322 Ca -0.00 0.37 0.03 0.00 -0.52 0.00 0.00 55.73 55.61 1sx4 s ARG 322 Cb 0.09 0.25 -0.02 0.00 0.52 0.00 0.00 34.95 35.79 1sx4 s ARG 322 CO 0.78 -0.12 -0.10 0.14 0.02 0.00 0.00 175.30 176.03 1sx4 s VAL 323 N -0.40 0.78 -0.12 3.52 -7.23 0.16 -1.02 120.40 116.09 1sx4 s VAL 323 Ca 0.01 -1.07 -0.02 0.00 -1.81 0.00 0.00 61.98 59.09 1sx4 s VAL 323 Cb -0.03 -0.78 0.04 0.00 0.56 0.00 0.00 36.38 36.17 1sx4 s VAL 323 CO -0.03 -0.24 -0.00 -0.69 -0.31 0.00 0.00 175.10 173.82 1sx4 s VAL 324 N -1.18 0.58 -0.07 1.32 1.01 -0.18 -1.95 120.40 119.94 1sx4 s VAL 324 Ca -0.05 -0.22 0.02 0.00 0.00 0.00 0.00 61.98 61.73 1sx4 s VAL 324 Cb -0.09 -0.83 0.01 0.00 0.00 0.00 0.00 36.38 35.47 1sx4 s VAL 324 CO 0.01 0.12 -0.12 0.27 0.00 0.00 0.00 175.10 175.38 1sx4 s ILE 325 N 1.87 1.11 0.00 2.22 -4.36 0.20 -0.97 121.20 121.26 1sx4 s ILE 325 Ca 0.03 -0.46 0.00 0.00 -0.26 0.00 0.00 60.65 59.96 1sx4 s ILE 325 Cb -0.14 -1.02 0.00 0.00 1.25 0.00 0.00 42.46 42.55 1sx4 s ILE 325 CO -0.07 0.35 0.00 0.59 0.24 0.00 0.00 174.94 176.05 1sx4 n ASN 326 N 3.87 0.15 -0.12 4.36 3.02 0.40 -0.07 115.26 126.86 1sx4 n ASN 326 Ca -0.23 -0.52 0.07 0.00 -0.03 0.00 0.00 54.58 53.88 1sx4 n ASN 326 Cb 0.52 0.00 0.40 0.00 -0.61 0.00 0.00 39.78 40.09 1sx4 n ASN 326 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1sx4 h LYS 327 N 0.00 0.61 -0.05 3.52 3.64 -1.92 -2.92 116.57 119.45 1sx4 h LYS 327 Ca 0.00 -0.04 -0.17 0.00 -1.27 0.00 0.00 60.65 59.17 1sx4 h LYS 327 Cb 0.00 -0.14 -0.32 0.00 -0.41 0.00 0.00 32.23 31.36 1sx4 h LYS 327 CO 0.00 0.41 -0.84 -0.40 -2.27 0.00 0.00 179.45 176.35 1sx4 n ASP 328 N -4.48 0.48 -3.31 4.20 5.68 -1.26 -3.71 116.55 114.16 1sx4 n ASP 328 Ca 0.09 -2.01 -0.07 0.00 -0.50 0.00 0.00 54.79 52.30 1sx4 n ASP 328 Cb 0.23 -0.14 -0.06 0.00 -1.14 0.00 0.00 41.12 40.02 1sx4 n ASP 328 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1sx4 s THR 329 N -0.41 -0.67 0.17 2.12 2.01 -1.03 -2.83 115.64 115.00 1sx4 s THR 329 Ca 0.24 -0.15 -0.16 0.00 0.31 0.00 0.00 61.69 61.93 1sx4 s THR 329 Cb 0.29 -0.91 -0.07 0.00 0.01 0.00 0.00 72.50 71.82 1sx4 s THR 329 CO -0.11 -0.17 0.60 -0.89 -0.69 0.00 0.00 174.62 173.35 1sx4 s THR 330 N 2.58 4.78 -0.16 -0.82 2.01 0.10 -0.46 115.64 123.68 1sx4 s THR 330 Ca 0.12 0.95 -0.07 0.00 0.31 0.00 0.00 61.69 63.00 1sx4 s THR 330 Cb -0.14 -3.76 0.07 0.00 0.01 0.00 0.00 72.50 68.67 1sx4 s THR 330 CO -0.23 0.22 0.35 0.28 -0.69 0.00 0.00 174.62 174.56 1sx4 s THR 331 N -1.49 -0.26 -0.23 -0.82 -1.32 -0.14 -1.27 115.64 110.10 1sx4 s THR 331 Ca 0.39 0.16 -0.12 0.00 -1.21 0.00 0.00 61.69 60.92 1sx4 s THR 331 Cb -0.15 -0.55 -0.05 0.00 -1.51 0.00 0.00 72.50 70.24 1sx4 s THR 331 CO 0.20 0.07 0.21 -0.63 -2.21 0.00 0.00 174.62 172.25 1sx4 s ILE 332 N 1.88 5.33 -0.30 5.08 1.01 -0.91 -1.01 121.20 132.29 1sx4 s ILE 332 Ca -0.05 0.29 -0.11 0.00 0.00 0.00 0.00 60.65 60.77 1sx4 s ILE 332 Cb -0.10 -3.55 -0.03 0.00 0.01 0.00 0.00 42.46 38.79 1sx4 s ILE 332 CO -0.11 0.32 0.19 -0.63 0.00 0.00 0.00 174.94 174.71 1sx4 s ILE 333 N 1.12 5.07 -0.32 2.92 1.01 -0.18 -4.09 121.20 126.73 1sx4 s ILE 333 Ca 0.10 -0.09 -0.03 0.00 0.00 0.00 0.00 60.65 60.63 1sx4 s ILE 333 Cb -0.14 -3.50 0.00 0.00 0.01 0.00 0.00 42.46 38.84 1sx4 s ILE 333 CO 0.05 0.15 0.10 -0.67 0.00 0.00 0.00 174.94 174.57 1sx4 n ASP 334 N 5.05 -8.01 -4.87 3.58 2.03 -1.26 -2.96 116.55 110.11 1sx4 n ASP 334 Ca -0.14 1.27 -0.31 0.00 0.52 0.00 0.00 54.79 56.14 1sx4 n ASP 334 Cb 0.51 -5.28 -0.03 0.00 -0.72 0.00 0.00 41.12 35.59 1sx4 n ASP 334 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1sx4 s GLY 335 N -1.79 1.95 0.49 0.27 0.00 -1.26 -2.12 107.32 104.87 1sx4 s GLY 335 Ca 0.04 -0.12 0.28 0.00 0.00 0.00 0.00 44.72 44.92 1sx4 s GLY 335 CO 0.77 0.09 1.89 -2.08 0.00 0.00 0.00 173.10 173.77 1sx4 h VAL 336 N 1.00 0.30 -1.52 1.40 2.07 -1.33 -3.46 116.25 114.72 1sx4 h VAL 336 Ca -0.47 -0.84 -0.74 0.00 0.82 0.00 0.00 66.70 65.47 1sx4 h VAL 336 Cb 1.19 1.65 0.03 0.00 -1.52 0.00 0.00 31.29 32.63 1sx4 h VAL 336 CO 0.63 0.12 0.74 0.61 0.02 0.00 0.00 177.57 179.69 1sx4 n GLY 337 N 0.11 0.66 3.77 2.17 0.00 -1.01 -4.84 105.19 106.05 1sx4 n GLY 337 Ca 0.00 0.87 -0.40 0.00 0.00 0.00 0.00 46.02 46.50 1sx4 n GLY 337 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1sx4 s GLU 338 N 2.58 3.93 0.05 1.61 2.02 -1.26 -4.81 118.70 122.81 1sx4 s GLU 338 Ca 0.95 2.26 0.11 0.00 0.02 0.00 0.00 54.97 58.31 1sx4 s GLU 338 Cb -1.08 -2.76 0.49 0.00 0.10 0.00 0.00 34.13 30.88 1sx4 s GLU 338 CO 0.62 -0.56 1.35 0.39 0.02 0.00 0.00 175.26 177.07 1sx4 n GLU 339 N 0.11 0.03 0.16 1.61 1.02 -1.26 -1.49 120.64 120.82 1sx4 n GLU 339 Ca 0.04 0.38 -0.14 0.00 -0.02 0.00 0.00 57.16 57.42 1sx4 n GLU 339 Cb 0.43 -1.58 -0.08 0.00 -0.02 0.00 0.00 31.44 30.19 1sx4 n GLU 339 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1sx4 h ALA 340 N 2.27 -0.33 -0.09 0.62 0.00 -1.99 -0.58 119.26 119.16 1sx4 h ALA 340 Ca 0.00 -0.08 -0.21 0.00 0.00 0.00 0.00 54.91 54.62 1sx4 h ALA 340 Cb 0.16 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1sx4 h ALA 340 CO 0.00 -0.68 -0.81 0.00 0.00 0.00 0.00 179.25 177.76 1sx4 h ALA 341 N 0.42 0.40 0.76 0.00 0.00 -1.63 -2.80 119.26 116.41 1sx4 h ALA 341 Ca -0.03 -0.63 -0.03 0.00 0.00 0.00 0.00 54.91 54.22 1sx4 h ALA 341 Cb 0.26 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1sx4 h ALA 341 CO 0.05 0.73 -0.44 0.82 0.00 0.00 0.00 179.25 180.42 1sx4 h ILE 342 N 0.39 0.12 -0.89 0.00 2.04 -1.40 -1.35 117.51 116.42 1sx4 h ILE 342 Ca -0.06 0.00 0.14 0.00 1.00 0.00 0.00 64.86 65.94 1sx4 h ILE 342 Cb 1.42 0.12 -0.07 0.00 -0.74 0.00 0.00 36.82 37.55 1sx4 h ILE 342 CO 0.15 0.00 0.57 -0.61 0.00 0.00 0.00 178.15 178.27 1sx4 h GLN 343 N -1.11 0.69 0.50 2.37 5.75 -1.21 -1.60 115.11 120.50 1sx4 h GLN 343 Ca -0.10 -0.04 -0.02 0.00 -0.15 0.00 0.00 58.65 58.33 1sx4 h GLN 343 Cb 0.88 -0.16 0.00 0.00 1.07 0.00 0.00 27.48 29.28 1sx4 h GLN 343 CO 0.12 0.46 -0.24 0.78 -2.65 0.00 0.00 178.83 177.30 1sx4 h GLY 344 N 0.71 -0.70 1.41 2.39 0.00 -1.32 -0.64 103.07 104.92 1sx4 h GLY 344 Ca 0.44 0.26 0.08 0.00 0.00 0.00 0.00 47.33 48.11 1sx4 h GLY 344 CO -0.20 -0.26 0.22 -0.09 0.00 0.00 0.00 176.54 176.21 1sx4 h ARG 345 N -0.95 0.00 -0.13 4.80 9.65 -1.00 0.45 114.38 127.20 1sx4 h ARG 345 Ca -0.07 0.00 -0.20 0.00 -1.10 0.00 0.00 59.98 58.62 1sx4 h ARG 345 Cb 0.60 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.19 1sx4 h ARG 345 CO 0.11 0.00 -0.72 0.28 2.80 0.00 0.00 179.97 182.45 1sx4 h VAL 346 N 0.00 1.33 0.00 0.20 2.07 -1.21 -2.74 116.25 115.90 1sx4 h VAL 346 Ca 0.13 -2.02 0.00 0.00 0.82 0.00 0.00 66.70 65.64 1sx4 h VAL 346 Cb 0.56 2.00 0.00 0.00 -1.52 0.00 0.00 31.29 32.33 1sx4 h VAL 346 CO -0.00 0.62 0.00 0.00 0.02 0.00 0.00 177.57 178.21 1sx4 n ALA 347 N -2.55 1.68 -0.09 1.67 0.00 0.09 -1.45 120.51 119.86 1sx4 n ALA 347 Ca -0.05 0.04 -0.16 0.00 0.00 0.00 0.00 53.44 53.26 1sx4 n ALA 347 Cb 0.71 -1.34 -0.10 0.00 0.00 0.00 0.00 19.45 18.71 1sx4 n ALA 347 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1sx4 h GLN 348 N 0.00 0.00 0.00 0.00 4.20 -1.27 -3.35 115.11 114.69 1sx4 h GLN 348 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1sx4 h GLN 348 Cb 0.34 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.12 1sx4 h GLN 348 CO 0.00 0.84 0.00 -0.89 -0.67 0.00 0.00 178.83 178.11 1sx4 n ILE 349 N -4.53 0.69 -0.09 2.54 5.41 -1.04 -1.74 119.36 120.60 1sx4 n ILE 349 Ca -0.21 0.17 -0.10 0.00 1.00 0.00 0.00 62.75 63.62 1sx4 n ILE 349 Cb 0.53 -0.91 -0.02 0.00 -0.71 0.00 0.00 39.64 38.53 1sx4 n ILE 349 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.55 176.46 1sx4 h ARG 350 N 0.00 0.43 -0.01 0.38 9.65 -1.38 -3.20 114.38 120.26 1sx4 h ARG 350 Ca 0.00 -0.07 0.00 0.00 -1.10 0.00 0.00 59.98 58.81 1sx4 h ARG 350 Cb 0.19 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 28.69 1sx4 h ARG 350 CO 0.00 0.42 -0.33 1.04 2.80 0.00 0.00 179.97 183.90 1sx4 n GLN 351 N -4.77 0.71 -0.27 0.20 6.02 -0.71 -3.81 117.38 114.75 1sx4 n GLN 351 Ca -0.02 -0.44 -0.05 0.00 -0.01 0.00 0.00 57.00 56.48 1sx4 n GLN 351 Cb 0.11 -1.49 0.09 0.00 1.02 0.00 0.00 30.24 29.97 1sx4 n GLN 351 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 1sx4 h GLN 352 N 1.07 1.15 -0.10 -1.09 1.08 -1.49 -2.71 115.11 113.00 1sx4 h GLN 352 Ca 0.00 -0.21 -0.19 0.00 -1.45 0.00 0.00 58.65 56.80 1sx4 h GLN 352 Cb 0.52 -0.19 -0.00 0.00 -0.05 0.00 0.00 27.48 27.77 1sx4 h GLN 352 CO 0.00 0.93 -0.72 0.82 -0.95 0.00 0.00 178.83 178.92 1sx4 h ILE 353 N 1.12 1.35 -0.91 2.54 2.04 -1.66 -1.00 117.51 120.99 1sx4 h ILE 353 Ca 0.25 -2.07 0.01 0.00 1.00 0.00 0.00 64.86 64.06 1sx4 h ILE 353 Cb 0.22 2.04 -0.05 0.00 -0.74 0.00 0.00 36.82 38.30 1sx4 h ILE 353 CO -0.02 0.63 0.60 -0.33 0.00 0.00 0.00 178.15 179.03 1sx4 h GLU 354 N 0.34 1.18 -0.51 2.37 4.39 -1.63 -2.86 114.58 117.87 1sx4 h GLU 354 Ca -0.03 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.60 1sx4 h GLU 354 Cb 1.30 -0.27 0.00 0.00 -0.10 0.00 0.00 28.75 29.68 1sx4 h GLU 354 CO 0.13 0.78 0.00 0.39 -1.16 0.00 0.00 179.01 179.15 1sx4 n GLU 355 N -4.46 3.06 -2.23 2.33 1.02 -1.04 -4.86 120.64 114.45 1sx4 n GLU 355 Ca 0.10 -2.50 -0.36 0.00 -0.02 0.00 0.00 57.16 54.38 1sx4 n GLU 355 Cb 0.03 -1.56 -0.04 0.00 -0.02 0.00 0.00 31.44 29.85 1sx4 n GLU 355 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1sx4 s ALA 356 N -1.41 2.25 -2.00 0.62 0.00 -0.38 -4.83 121.76 116.01 1sx4 s ALA 356 Ca 0.39 -1.26 0.15 0.00 0.00 0.00 0.00 51.96 51.25 1sx4 s ALA 356 Cb 0.23 -4.39 0.92 0.00 0.00 0.00 0.00 23.12 19.88 1sx4 s ALA 356 CO 0.22 -3.96 1.41 0.25 0.00 0.00 0.00 175.76 173.68 1sx4 n THR 357 N 7.15 0.00 -4.72 0.00 -2.24 -1.26 -4.80 114.28 108.41 1sx4 n THR 357 Ca 0.23 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.70 1sx4 n THR 357 Cb 0.50 -0.47 -0.08 0.00 -2.10 0.00 0.00 70.33 68.18 1sx4 n THR 357 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1sx4 s SER 358 N -1.76 4.02 -0.20 3.42 0.15 -1.26 -5.08 113.70 112.98 1sx4 s SER 358 Ca 0.23 -1.59 0.04 0.00 0.70 0.00 0.00 55.95 55.33 1sx4 s SER 358 Cb 0.11 0.31 -0.21 0.00 -1.71 0.00 0.00 66.02 64.52 1sx4 s SER 358 CO 0.18 -0.76 0.01 0.47 1.20 0.00 0.00 173.24 174.34 1sx4 n ASP 359 N -1.19 1.59 0.08 5.45 8.00 -1.26 -4.30 116.55 124.91 1sx4 n ASP 359 Ca -0.16 -0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.23 1sx4 n ASP 359 Cb 0.67 -0.23 -0.03 0.00 -0.02 0.00 0.00 41.12 41.50 1sx4 n ASP 359 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1sx4 h TYR 360 N 0.02 0.43 0.00 1.24 3.20 -1.98 -3.21 116.97 116.67 1sx4 h TYR 360 Ca -0.52 -0.24 0.00 0.00 3.14 0.00 0.00 58.73 61.11 1sx4 h TYR 360 Cb 2.00 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 40.22 1sx4 h TYR 360 CO 0.03 1.07 0.00 -0.25 -1.64 0.00 0.00 178.16 177.37 1sx4 n ASP 361 N -3.68 0.00 -0.09 -2.11 9.92 -1.26 -3.25 116.55 116.08 1sx4 n ASP 361 Ca -0.05 -0.52 -0.13 0.00 -0.53 0.00 0.00 54.79 53.55 1sx4 n ASP 361 Cb 0.84 0.00 -0.08 0.00 -0.64 0.00 0.00 41.12 41.24 1sx4 n ASP 361 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 1sx4 n ARG 362 N -0.95 0.44 0.18 -1.24 0.63 -1.21 -4.39 116.66 110.11 1sx4 n ARG 362 Ca 0.10 0.11 -0.14 0.00 -0.92 0.00 0.00 57.85 57.00 1sx4 n ARG 362 Cb 0.05 -1.33 -0.07 0.00 0.45 0.00 0.00 32.46 31.56 1sx4 n ARG 362 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1sx4 h GLU 363 N -0.09 -0.61 -0.77 -0.14 4.39 -1.55 -2.54 114.58 113.26 1sx4 h GLU 363 Ca -0.41 0.04 0.03 0.00 0.34 0.00 0.00 59.36 59.36 1sx4 h GLU 363 Cb 1.59 0.14 -0.05 0.00 -0.10 0.00 0.00 28.75 30.33 1sx4 h GLU 363 CO -0.09 -0.41 0.49 0.87 -1.16 0.00 0.00 179.01 178.71 1sx4 h LYS 364 N -0.64 0.94 -0.31 2.33 1.79 -1.83 -1.62 116.57 117.23 1sx4 h LYS 364 Ca -0.00 -0.06 -0.02 0.00 -2.18 0.00 0.00 60.65 58.39 1sx4 h LYS 364 Cb 0.60 -0.21 -0.01 0.00 -1.58 0.00 0.00 32.23 31.03 1sx4 h LYS 364 CO -0.10 0.62 0.11 -0.07 -1.08 0.00 0.00 179.45 178.93 1sx4 h LEU 365 N 0.97 0.44 -1.36 2.94 3.38 -1.75 -1.34 115.31 118.59 1sx4 h LEU 365 Ca 0.31 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 1sx4 h LEU 365 Cb 0.00 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1sx4 h LEU 365 CO -0.11 0.51 0.17 1.56 0.09 0.00 0.00 178.44 180.67 1sx4 h GLN 366 N 0.35 0.60 0.80 1.13 4.20 -1.20 -0.39 115.11 120.61 1sx4 h GLN 366 Ca 0.10 -0.08 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 1sx4 h GLN 366 Cb 0.22 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 27.88 1sx4 h GLN 366 CO -0.01 0.50 -0.49 0.93 -0.67 0.00 0.00 178.83 179.09 1sx4 h GLU 367 N 0.60 -1.16 -0.84 1.46 5.08 -0.91 -2.72 114.58 116.09 1sx4 h GLU 367 Ca 0.15 0.08 0.12 0.00 -1.00 0.00 0.00 59.36 58.71 1sx4 h GLU 367 Cb 0.12 0.26 -0.08 0.00 0.50 0.00 0.00 28.75 29.55 1sx4 h GLU 367 CO -0.02 -0.78 0.45 0.00 -1.00 0.00 0.00 179.01 177.67 1sx4 h ARG 368 N -1.21 0.68 -0.99 2.33 3.08 -0.89 0.52 114.38 117.91 1sx4 h ARG 368 Ca -0.11 -0.04 0.12 0.00 0.07 0.00 0.00 59.98 60.02 1sx4 h ARG 368 Cb 0.97 -0.15 -0.08 0.00 0.08 0.00 0.00 29.97 30.78 1sx4 h ARG 368 CO 0.11 0.45 0.61 -0.39 -1.07 0.00 0.00 179.97 179.68 1sx4 h VAL 369 N 0.70 0.92 -0.20 2.04 -1.51 -1.01 -1.42 116.25 115.77 1sx4 h VAL 369 Ca 0.43 -0.33 -0.21 0.00 -1.23 0.00 0.00 66.70 65.36 1sx4 h VAL 369 Cb 0.52 -0.14 0.01 0.00 -2.13 0.00 0.00 31.29 29.55 1sx4 h VAL 369 CO -0.31 0.18 -0.69 0.00 -1.23 0.00 0.00 177.57 175.51 1sx4 h ALA 370 N 1.53 0.38 0.00 5.19 0.00 -0.61 0.44 119.26 126.19 1sx4 h ALA 370 Ca 0.49 -0.57 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1sx4 h ALA 370 Cb 0.48 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1sx4 h ALA 370 CO -0.26 0.69 -0.03 0.87 0.00 0.00 0.00 179.25 180.51 1sx4 h LYS 371 N 0.58 0.00 0.00 0.00 1.57 -0.66 -2.87 116.57 115.19 1sx4 h LYS 371 Ca -0.03 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.42 1sx4 h LYS 371 Cb 1.31 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.56 1sx4 h LYS 371 CO 0.15 0.03 -2.25 1.28 -0.57 0.00 0.00 179.45 178.09 1sx4 n LEU 372 N -3.18 0.16 0.00 2.94 4.77 -0.59 -3.59 117.00 117.51 1sx4 n LEU 372 Ca -0.01 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1sx4 n LEU 372 Cb 0.25 0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.72 1sx4 n LEU 372 CO 0.26 0.47 0.00 0.00 -1.33 0.00 0.00 177.39 176.79 1sx4 n ALA 373 N -2.70 0.12 -1.39 -1.18 0.00 0.15 -5.02 120.51 110.50 1sx4 n ALA 373 Ca -0.30 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.14 1sx4 n ALA 373 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.53 1sx4 n ALA 373 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sx4 n GLY 374 N 2.91 0.73 3.27 0.00 0.00 -1.09 -4.96 105.19 106.05 1sx4 n GLY 374 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1sx4 n GLY 374 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1sx4 s GLY 375 N 0.00 1.51 -0.12 -0.02 0.00 -1.14 -4.13 107.32 103.43 1sx4 s GLY 375 Ca 0.00 -1.75 -0.00 0.00 0.00 0.00 0.00 44.72 42.97 1sx4 s GLY 375 CO 0.00 -1.53 -0.10 0.14 0.00 0.00 0.00 173.10 171.61 1sx4 s VAL 376 N -3.80 3.35 0.00 1.40 1.01 -1.22 -3.57 120.40 117.57 1sx4 s VAL 376 Ca 0.33 -0.57 0.08 0.00 0.00 0.00 0.00 61.98 61.83 1sx4 s VAL 376 Cb 0.07 -2.41 -0.02 0.00 0.00 0.00 0.00 36.38 34.02 1sx4 s VAL 376 CO 0.10 0.53 -0.25 0.00 0.00 0.00 0.00 175.10 175.49 1sx4 s ALA 377 N 0.06 2.08 -0.09 5.51 0.00 -0.34 -1.06 121.76 127.91 1sx4 s ALA 377 Ca -0.03 -1.12 0.04 0.00 0.00 0.00 0.00 51.96 50.85 1sx4 s ALA 377 Cb -0.14 -0.49 -0.00 0.00 0.00 0.00 0.00 23.12 22.48 1sx4 s ALA 377 CO 0.04 0.50 -0.23 0.08 0.00 0.00 0.00 175.76 176.15 1sx4 s VAL 378 N -0.66 2.16 -0.14 0.00 1.01 0.03 -1.85 120.40 120.94 1sx4 s VAL 378 Ca 0.10 -0.99 -0.06 0.00 0.00 0.00 0.00 61.98 61.02 1sx4 s VAL 378 Cb -0.10 -1.82 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 1sx4 s VAL 378 CO 0.00 0.56 0.09 -0.63 0.00 0.00 0.00 175.10 175.12 1sx4 s ILE 379 N 0.24 5.02 -0.26 2.22 1.01 0.12 -1.19 121.20 128.36 1sx4 s ILE 379 Ca -0.15 0.04 -0.06 0.00 0.00 0.00 0.00 60.65 60.48 1sx4 s ILE 379 Cb -0.17 -3.21 -0.00 0.00 0.01 0.00 0.00 42.46 39.09 1sx4 s ILE 379 CO 0.08 0.54 0.03 -0.54 0.00 0.00 0.00 174.94 175.05 1sx4 s LYS 380 N -0.38 3.28 -0.01 2.79 1.02 0.56 -1.41 119.74 125.60 1sx4 s LYS 380 Ca 0.10 -0.71 -0.30 0.00 0.02 0.00 0.00 55.97 55.08 1sx4 s LYS 380 Cb -0.12 -3.21 -0.03 0.00 -0.52 0.00 0.00 37.83 33.95 1sx4 s LYS 380 CO 0.02 -0.31 1.06 0.08 -0.92 0.00 0.00 175.35 175.28 1sx4 s VAL 381 N 1.50 4.60 0.01 3.17 1.01 -1.13 -1.16 120.40 128.41 1sx4 s VAL 381 Ca 0.04 1.87 -0.08 0.00 0.00 0.00 0.00 61.98 63.81 1sx4 s VAL 381 Cb -0.16 -4.20 -0.05 0.00 0.00 0.00 0.00 36.38 31.98 1sx4 s VAL 381 CO 0.00 0.11 0.30 -0.83 0.00 0.00 0.00 175.10 174.68 1sx4 s GLY 382 N 1.08 2.29 -0.11 4.51 0.00 -1.26 -1.75 107.32 112.08 1sx4 s GLY 382 Ca 0.53 -0.50 -0.28 0.00 0.00 0.00 0.00 44.72 44.47 1sx4 s GLY 382 CO 0.26 -0.29 0.66 0.00 0.00 0.00 0.00 173.10 173.73 1sx4 s ALA 383 N -1.28 -1.69 0.11 3.20 0.00 -1.21 -4.77 121.76 116.12 1sx4 s ALA 383 Ca 0.28 1.46 -0.14 0.00 0.00 0.00 0.00 51.96 53.55 1sx4 s ALA 383 Cb -0.14 -0.36 -0.07 0.00 0.00 0.00 0.00 23.12 22.55 1sx4 s ALA 383 CO 0.15 -0.35 1.44 0.00 0.00 0.00 0.00 175.76 177.01 1sx4 h ALA 384 N 3.71 0.46 -5.51 0.00 0.00 -1.87 -3.42 119.26 112.64 1sx4 h ALA 384 Ca -0.28 -0.40 -0.63 0.00 0.00 0.00 0.00 54.91 53.60 1sx4 h ALA 384 Cb 1.15 -0.10 -0.09 0.00 0.00 0.00 0.00 17.79 18.75 1sx4 h ALA 384 CO 0.29 0.48 -0.38 0.25 0.00 0.00 0.00 179.25 179.89 1sx4 n THR 385 N -4.23 0.00 0.02 0.00 -2.24 -1.26 -5.06 114.28 101.51 1sx4 n THR 385 Ca -0.03 -2.33 -0.18 0.00 -2.27 0.00 0.00 64.05 59.24 1sx4 n THR 385 Cb 0.47 0.22 -0.14 0.00 -2.10 0.00 0.00 70.33 68.79 1sx4 n THR 385 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1sx4 h GLU 386 N 0.00 0.23 -0.26 -0.78 4.81 -1.99 -2.79 114.58 113.80 1sx4 h GLU 386 Ca -0.39 -0.40 0.08 0.00 -0.13 0.00 0.00 59.36 58.52 1sx4 h GLU 386 Cb 1.30 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.82 1sx4 h GLU 386 CO 0.63 1.08 0.20 -0.39 -0.73 0.00 0.00 179.01 179.80 1sx4 h VAL 387 N 0.06 0.76 0.09 0.32 -1.51 -1.98 -2.62 116.25 111.38 1sx4 h VAL 387 Ca -0.36 0.00 -0.24 0.00 -1.23 0.00 0.00 66.70 64.87 1sx4 h VAL 387 Cb 2.04 0.85 -0.01 0.00 -2.13 0.00 0.00 31.29 32.05 1sx4 h VAL 387 CO 0.11 0.00 -1.23 -0.08 -1.23 0.00 0.00 177.57 175.14 1sx4 h GLU 388 N 0.00 0.18 0.04 5.19 4.81 -1.97 -3.31 114.58 119.53 1sx4 h GLU 388 Ca 0.12 -0.31 0.03 0.00 -0.13 0.00 0.00 59.36 59.07 1sx4 h GLU 388 Cb 0.53 0.12 -0.05 0.00 0.63 0.00 0.00 28.75 29.98 1sx4 h GLU 388 CO -0.00 1.15 -0.32 1.98 -0.73 0.00 0.00 179.01 181.09 1sx4 h MET 389 N -0.49 -0.47 -0.28 1.92 4.05 -1.34 -0.43 114.93 117.89 1sx4 h MET 389 Ca -0.28 0.03 0.04 0.00 -0.28 0.00 0.00 59.70 59.22 1sx4 h MET 389 Cb 1.61 0.11 -0.07 0.00 -0.80 0.00 0.00 31.60 32.44 1sx4 h MET 389 CO 0.01 -0.32 -0.54 0.87 0.23 0.00 0.00 176.91 177.17 1sx4 h LYS 390 N -0.49 -0.45 -0.23 0.39 1.57 -1.66 0.37 116.57 116.07 1sx4 h LYS 390 Ca 0.05 0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1sx4 h LYS 390 Cb 0.56 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.96 1sx4 h LYS 390 CO -0.24 -0.30 0.14 1.49 -0.57 0.00 0.00 179.45 179.97 1sx4 h GLU 391 N -0.47 0.31 -0.47 3.15 4.57 -1.62 -2.49 114.58 117.56 1sx4 h GLU 391 Ca 0.05 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.18 1sx4 h GLU 391 Cb 0.62 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.12 1sx4 h GLU 391 CO -0.51 0.24 0.20 -0.22 -1.18 0.00 0.00 179.01 177.53 1sx4 h LYS 392 N 0.28 0.69 0.18 1.92 1.63 -0.84 -2.14 116.57 118.29 1sx4 h LYS 392 Ca 0.08 -0.12 0.01 0.00 -0.85 0.00 0.00 60.65 59.77 1sx4 h LYS 392 Cb 0.01 -0.11 -0.03 0.00 -0.60 0.00 0.00 32.23 31.50 1sx4 h LYS 392 CO -0.02 0.61 -0.26 -0.22 -3.45 0.00 0.00 179.45 176.12 1sx4 h LYS 393 N 0.61 -0.48 -0.70 1.90 3.64 -0.24 -2.23 116.57 119.07 1sx4 h LYS 393 Ca 0.16 0.03 0.15 0.00 -1.27 0.00 0.00 60.65 59.72 1sx4 h LYS 393 Cb 0.17 0.11 -0.12 0.00 -0.41 0.00 0.00 32.23 31.99 1sx4 h LYS 393 CO -0.01 -0.32 0.03 0.00 -2.27 0.00 0.00 179.45 176.87 1sx4 h ALA 394 N 0.19 0.73 0.20 5.00 0.00 -1.35 0.15 119.26 124.18 1sx4 h ALA 394 Ca 0.01 0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1sx4 h ALA 394 Cb 0.50 0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1sx4 h ALA 394 CO -0.11 -0.40 -0.10 0.00 0.00 0.00 0.00 179.25 178.65 1sx4 h ARG 395 N 0.13 -0.26 -0.42 0.00 3.08 -1.00 0.24 114.38 116.14 1sx4 h ARG 395 Ca 0.38 0.02 0.09 0.00 0.07 0.00 0.00 59.98 60.53 1sx4 h ARG 395 Cb 0.64 0.06 -0.09 0.00 0.08 0.00 0.00 29.97 30.66 1sx4 h ARG 395 CO -0.59 -0.10 -0.18 0.28 -1.07 0.00 0.00 179.97 178.31 1sx4 h VAL 396 N -0.38 0.43 -0.47 2.04 2.07 -0.76 0.36 116.25 119.54 1sx4 h VAL 396 Ca -0.03 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.56 1sx4 h VAL 396 Cb 0.29 0.43 -0.09 0.00 -1.52 0.00 0.00 31.29 30.40 1sx4 h VAL 396 CO 0.05 0.00 -0.50 -0.33 0.02 0.00 0.00 177.57 176.80 1sx4 h GLU 397 N -0.10 -0.32 -0.95 1.57 4.39 -0.64 0.25 114.58 118.78 1sx4 h GLU 397 Ca 0.21 0.02 0.17 0.00 0.34 0.00 0.00 59.36 60.09 1sx4 h GLU 397 Cb 0.42 0.07 -0.17 0.00 -0.10 0.00 0.00 28.75 28.97 1sx4 h GLU 397 CO -0.49 -0.21 -0.33 0.22 -1.16 0.00 0.00 179.01 177.04 1sx4 h ASP 398 N -0.33 -1.20 0.38 1.42 3.58 0.62 -2.12 116.42 118.77 1sx4 h ASP 398 Ca 0.12 0.30 -0.27 0.00 0.42 0.00 0.00 57.03 57.59 1sx4 h ASP 398 Cb 0.58 0.68 0.01 0.00 1.72 0.00 0.00 39.33 42.32 1sx4 h ASP 398 CO -0.63 -0.30 -1.17 0.00 -2.88 0.00 0.00 179.24 174.26 1sx4 h ALA 399 N 1.58 0.14 -0.86 -0.78 0.00 0.09 -2.71 119.26 116.73 1sx4 h ALA 399 Ca 0.38 -0.80 0.22 0.00 0.00 0.00 0.00 54.91 54.72 1sx4 h ALA 399 Cb 0.64 0.04 -0.14 0.00 0.00 0.00 0.00 17.79 18.32 1sx4 h ALA 399 CO -0.97 0.83 0.14 1.25 0.00 0.00 0.00 179.25 180.50 1sx4 h LEU 400 N 0.18 -0.17 0.08 0.00 7.12 -0.13 -0.50 115.31 121.88 1sx4 h LEU 400 Ca -0.14 0.21 -0.00 0.00 0.13 0.00 0.00 57.88 58.08 1sx4 h LEU 400 Cb 1.85 0.32 0.00 0.00 -0.53 0.00 0.00 40.66 42.30 1sx4 h LEU 400 CO 0.21 -0.19 -0.04 0.45 -0.13 0.00 0.00 178.44 178.73 1sx4 h HIS 401 N 0.15 -0.10 -0.58 1.25 3.86 -1.20 -2.76 115.15 115.78 1sx4 h HIS 401 Ca 0.52 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.72 1sx4 h HIS 401 Cb 1.02 0.03 -0.03 0.00 1.06 0.00 0.00 27.41 29.50 1sx4 h HIS 401 CO -0.34 0.07 0.32 0.00 0.86 0.00 0.00 177.93 178.84 1sx4 h ALA 402 N 0.67 0.74 -0.03 2.45 0.00 -0.86 -1.93 119.26 120.30 1sx4 h ALA 402 Ca -0.01 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.83 1sx4 h ALA 402 Cb 0.21 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1sx4 h ALA 402 CO 0.02 0.25 -0.15 1.79 0.00 0.00 0.00 179.25 181.16 1sx4 h THR 403 N 0.78 0.63 -0.12 0.00 1.35 -1.14 0.32 112.91 114.73 1sx4 h THR 403 Ca 0.20 0.00 0.03 0.00 -0.55 0.00 0.00 66.41 66.10 1sx4 h THR 403 Cb 0.03 0.63 -0.00 0.00 -1.73 0.00 0.00 68.15 67.08 1sx4 h THR 403 CO -0.03 0.00 0.49 0.03 -0.25 0.00 0.00 175.52 175.75 1sx4 h ARG 404 N -0.23 0.00 0.09 4.72 2.47 -1.06 0.42 114.38 120.78 1sx4 h ARG 404 Ca 0.06 0.00 -0.33 0.00 -1.26 0.00 0.00 59.98 58.45 1sx4 h ARG 404 Cb 0.31 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.61 1sx4 h ARG 404 CO -0.17 0.00 -1.80 0.00 0.56 0.00 0.00 179.97 178.56 1sx4 n ALA 405 N -1.93 0.86 -0.36 0.04 0.00 0.85 -3.34 120.51 116.63 1sx4 n ALA 405 Ca 0.01 -0.57 0.05 0.00 0.00 0.00 0.00 53.44 52.94 1sx4 n ALA 405 Cb 0.56 -0.64 0.22 0.00 0.00 0.00 0.00 19.45 19.59 1sx4 n ALA 405 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sx4 h ALA 406 N -0.10 1.49 -0.24 0.00 0.00 0.14 -0.16 119.26 120.39 1sx4 h ALA 406 Ca -0.41 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.33 1sx4 h ALA 406 Cb 1.83 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.37 1sx4 h ALA 406 CO -0.00 0.31 -0.55 0.28 0.00 0.00 0.00 179.25 179.28 1sx4 h VAL 407 N 1.06 1.30 0.00 0.00 2.07 -1.43 0.31 116.25 119.55 1sx4 h VAL 407 Ca 0.47 -1.77 0.00 0.00 0.82 0.00 0.00 66.70 66.22 1sx4 h VAL 407 Cb 0.36 1.70 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 1sx4 h VAL 407 CO -0.22 0.56 -0.77 1.05 0.02 0.00 0.00 177.57 178.21 1sx4 h GLU 408 N 0.55 0.00 0.00 1.57 4.11 -1.48 -3.43 114.58 115.90 1sx4 h GLU 408 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.44 1sx4 h GLU 408 Cb 1.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.38 1sx4 h GLU 408 CO 0.11 0.00 0.00 -1.91 0.07 0.00 0.00 179.01 177.28 1sx4 n GLU 409 N -2.63 0.63 0.00 1.06 2.13 -0.10 -5.09 120.64 116.65 1sx4 n GLU 409 Ca 0.01 -0.03 0.00 0.00 0.66 0.00 0.00 57.16 57.80 1sx4 n GLU 409 Cb 0.52 -0.27 0.00 0.00 0.27 0.00 0.00 31.44 31.96 1sx4 n GLU 409 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1sx4 n GLY 410 N 0.10 -2.51 3.20 8.31 0.00 0.11 -4.51 105.19 109.89 1sx4 n GLY 410 Ca 0.00 -1.96 -0.14 0.00 0.00 0.00 0.00 46.02 43.93 1sx4 n GLY 410 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1sx4 s VAL 411 N -0.33 0.97 0.25 1.61 -7.23 -0.98 0.21 120.40 114.89 1sx4 s VAL 411 Ca 0.00 -1.84 -0.00 0.00 -1.81 0.00 0.00 61.98 58.33 1sx4 s VAL 411 Cb 0.00 -1.58 -0.03 0.00 0.56 0.00 0.00 36.38 35.33 1sx4 s VAL 411 CO 0.00 -0.68 0.24 0.68 -0.31 0.00 0.00 175.10 175.02 1sx4 s VAL 412 N -2.97 0.00 -0.12 1.32 -7.23 -0.79 -2.59 120.40 108.02 1sx4 s VAL 412 Ca 0.10 -1.90 -0.29 0.00 -1.81 0.00 0.00 61.98 58.08 1sx4 s VAL 412 Cb 0.01 -2.48 -0.04 0.00 0.56 0.00 0.00 36.38 34.43 1sx4 s VAL 412 CO -0.01 0.00 1.51 0.00 -0.31 0.00 0.00 175.10 176.29 1sx4 s ALA 413 N -3.84 3.57 1.00 1.32 0.00 -1.26 -2.23 121.76 120.31 1sx4 s ALA 413 Ca 0.37 0.68 0.00 0.00 0.00 0.00 0.00 51.96 53.01 1sx4 s ALA 413 Cb 0.04 -3.72 0.00 0.00 0.00 0.00 0.00 23.12 19.44 1sx4 s ALA 413 CO 0.17 -1.42 0.00 0.41 0.00 0.00 0.00 175.76 174.92 1sx4 n GLY 414 N 4.04 -1.71 2.32 0.00 0.00 -0.50 -1.92 105.19 107.43 1sx4 n GLY 414 Ca 0.16 -1.55 -0.07 0.00 0.00 0.00 0.00 46.02 44.56 1sx4 n GLY 414 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sx4 n GLY 415 N 3.74 0.93 2.22 -0.02 0.00 -1.26 -1.94 105.19 108.85 1sx4 n GLY 415 Ca 0.00 -0.46 -0.07 0.00 0.00 0.00 0.00 46.02 45.49 1sx4 n GLY 415 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sx4 n GLY 416 N -1.66 0.94 0.08 -0.02 0.00 -1.26 -4.08 105.19 99.20 1sx4 n GLY 416 Ca -0.07 -0.71 -0.12 0.00 0.00 0.00 0.00 46.02 45.11 1sx4 n GLY 416 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1sx4 h VAL 417 N 0.00 1.35 -0.92 1.61 3.04 -1.36 -2.67 116.25 117.30 1sx4 h VAL 417 Ca -0.15 -1.54 0.12 0.00 -1.01 0.00 0.00 66.70 64.11 1sx4 h VAL 417 Cb 0.49 2.34 -0.14 0.00 -2.01 0.00 0.00 31.29 31.97 1sx4 h VAL 417 CO 0.22 0.37 -0.47 0.00 -1.01 0.00 0.00 177.57 176.69 1sx4 h ALA 418 N 0.09 -0.17 -0.37 3.17 0.00 -1.64 0.16 119.26 120.51 1sx4 h ALA 418 Ca -0.01 0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.15 1sx4 h ALA 418 Cb 0.66 1.13 -0.04 0.00 0.00 0.00 0.00 17.79 19.53 1sx4 h ALA 418 CO 0.01 -0.78 0.12 -0.07 0.00 0.00 0.00 179.25 178.53 1sx4 h LEU 419 N -0.04 0.11 -1.83 0.00 4.07 -1.86 0.13 115.31 115.89 1sx4 h LEU 419 Ca 0.25 0.05 -0.00 0.00 0.08 0.00 0.00 57.88 58.26 1sx4 h LEU 419 Cb 0.53 0.04 -0.01 0.00 1.08 0.00 0.00 40.66 42.30 1sx4 h LEU 419 CO -0.92 0.10 0.07 -0.29 -1.08 0.00 0.00 178.44 176.32 1sx4 h ILE 420 N 0.26 1.05 0.05 1.22 2.10 -0.54 -0.73 117.51 120.92 1sx4 h ILE 420 Ca 0.17 -0.12 -0.00 0.00 1.08 0.00 0.00 64.86 65.99 1sx4 h ILE 420 Cb 0.16 0.86 0.00 0.00 -1.09 0.00 0.00 36.82 36.76 1sx4 h ILE 420 CO -0.19 0.05 -0.02 0.03 -1.08 0.00 0.00 178.15 176.94 1sx4 h ARG 421 N 0.19 -0.06 0.00 2.19 2.47 0.20 -3.13 114.38 116.24 1sx4 h ARG 421 Ca 0.05 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.75 1sx4 h ARG 421 Cb 0.01 0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 28.34 1sx4 h ARG 421 CO -0.01 0.49 -0.10 -0.39 0.56 0.00 0.00 179.97 180.53 1sx4 h VAL 422 N -0.66 0.86 -0.27 2.04 -1.51 -0.38 -1.12 116.25 115.21 1sx4 h VAL 422 Ca -0.01 -0.35 0.01 0.00 -1.23 0.00 0.00 66.70 65.12 1sx4 h VAL 422 Cb 0.58 1.20 -0.01 0.00 -2.13 0.00 0.00 31.29 30.93 1sx4 h VAL 422 CO 0.01 0.09 0.18 0.00 -1.23 0.00 0.00 177.57 176.63 1sx4 h ALA 423 N 1.90 1.84 0.00 5.19 0.00 -1.11 -2.50 119.26 124.58 1sx4 h ALA 423 Ca -0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1sx4 h ALA 423 Cb 0.19 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1sx4 h ALA 423 CO 0.01 0.14 -0.54 0.66 0.00 0.00 0.00 179.25 179.53 1sx4 h SER 424 N 0.34 0.00 0.57 0.00 4.64 -1.16 -3.15 113.55 114.79 1sx4 h SER 424 Ca 0.10 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.38 1sx4 h SER 424 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.09 1sx4 h SER 424 CO -0.02 0.13 -0.22 0.11 -0.87 0.00 0.00 176.83 175.96 1sx4 h LYS 425 N 0.00 0.00 -0.65 4.77 1.57 -1.07 -3.15 116.57 118.04 1sx4 h LYS 425 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1sx4 h LYS 425 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.42 1sx4 h LYS 425 CO 0.01 0.22 0.00 1.28 -0.57 0.00 0.00 179.45 180.39 1sx4 n LEU 426 N -3.62 4.17 0.24 2.94 4.77 -1.02 -4.44 117.00 120.04 1sx4 n LEU 426 Ca -0.01 -2.20 0.16 0.00 -0.03 0.00 0.00 56.01 53.92 1sx4 n LEU 426 Cb 0.35 -0.50 0.69 0.00 -2.33 0.00 0.00 43.42 41.62 1sx4 n LEU 426 CO 0.33 0.89 1.13 0.00 -1.33 0.00 0.00 177.39 178.41 1sx4 h ALA 427 N 3.92 1.71 -0.05 -1.18 0.00 -1.51 0.11 119.26 122.26 1sx4 h ALA 427 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1sx4 h ALA 427 Cb 1.16 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1sx4 h ALA 427 CO 0.10 -0.57 0.00 -0.25 0.00 0.00 0.00 179.25 178.52 1sx4 n ASP 428 N -3.09 2.81 -4.77 0.00 8.00 -1.26 -5.00 116.55 113.23 1sx4 n ASP 428 Ca 0.02 -1.89 -0.41 0.00 0.71 0.00 0.00 54.79 53.23 1sx4 n ASP 428 Cb 0.58 -0.02 -0.02 0.00 -0.02 0.00 0.00 41.12 41.64 1sx4 n ASP 428 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1sx4 s LEU 429 N -1.73 4.40 0.04 0.64 2.96 0.39 -5.02 118.68 120.36 1sx4 s LEU 429 Ca 0.25 2.73 -0.01 0.00 -0.22 0.00 0.00 54.13 56.89 1sx4 s LEU 429 Cb 0.18 -3.66 -0.03 0.00 0.50 0.00 0.00 46.19 43.17 1sx4 s LEU 429 CO 0.27 -0.59 -0.02 -0.13 -1.32 0.00 0.00 176.35 174.55 1sx4 s ARG 430 N -1.86 0.56 0.00 1.98 1.81 -1.26 -5.00 118.95 115.18 1sx4 s ARG 430 Ca 0.50 -1.09 0.00 0.00 -1.72 0.00 0.00 55.73 53.42 1sx4 s ARG 430 Cb -0.41 0.19 0.00 0.00 -0.45 0.00 0.00 34.95 34.29 1sx4 s ARG 430 CO 0.54 -0.10 0.00 0.41 -0.68 0.00 0.00 175.30 175.47 1sx4 n GLY 431 N 0.41 4.35 0.03 -3.53 0.00 -1.26 -5.02 105.19 100.16 1sx4 n GLY 431 Ca -0.16 -2.12 0.06 0.00 0.00 0.00 0.00 46.02 43.80 1sx4 n GLY 431 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1sx4 n GLN 432 N -0.21 0.04 -3.57 1.61 6.02 -1.26 -4.84 117.38 115.16 1sx4 n GLN 432 Ca 0.00 0.35 -0.06 0.00 -0.01 0.00 0.00 57.00 57.28 1sx4 n GLN 432 Cb 0.00 -1.58 -0.02 0.00 1.02 0.00 0.00 30.24 29.66 1sx4 n GLN 432 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1sx4 s ASN 433 N -3.23 -0.22 0.20 1.08 4.22 -1.26 -5.06 114.94 110.67 1sx4 s ASN 433 Ca 0.04 0.03 -0.11 0.00 -2.14 0.00 0.00 52.86 50.69 1sx4 s ASN 433 Cb 0.07 0.22 0.24 0.00 1.28 0.00 0.00 41.25 43.07 1sx4 s ASN 433 CO 0.22 -0.35 1.74 -0.08 -2.04 0.00 0.00 177.10 176.59 1sx4 h GLU 434 N 2.05 0.36 -0.54 3.55 4.57 -1.99 -0.19 114.58 122.38 1sx4 h GLU 434 Ca -0.14 -0.02 0.11 0.00 -1.18 0.00 0.00 59.36 58.13 1sx4 h GLU 434 Cb 1.19 -0.08 -0.10 0.00 -0.16 0.00 0.00 28.75 29.60 1sx4 h GLU 434 CO 0.26 0.24 -0.09 -0.44 -1.18 0.00 0.00 179.01 177.80 1sx4 h ASP 435 N 0.37 -0.42 -0.04 1.04 3.32 -1.96 0.14 116.42 118.87 1sx4 h ASP 435 Ca 0.28 0.15 -0.01 0.00 0.02 0.00 0.00 57.03 57.48 1sx4 h ASP 435 Cb 0.35 0.30 -0.00 0.00 0.22 0.00 0.00 39.33 40.20 1sx4 h ASP 435 CO -0.30 -0.15 0.01 1.56 -1.72 0.00 0.00 179.24 178.64 1sx4 h GLN 436 N 0.03 0.10 -0.32 3.56 4.20 -1.20 0.42 115.11 121.89 1sx4 h GLN 436 Ca 0.27 -0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.91 1sx4 h GLN 436 Cb 0.42 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 1sx4 h GLN 436 CO -0.53 0.10 -0.03 -0.91 -0.67 0.00 0.00 178.83 176.79 1sx4 h ASN 437 N 0.10 0.59 -0.83 1.46 2.35 -0.34 0.50 115.58 119.41 1sx4 h ASN 437 Ca 0.03 -0.33 0.00 0.00 -0.55 0.00 0.00 56.30 55.45 1sx4 h ASN 437 Cb 0.05 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.22 1sx4 h ASN 437 CO -0.00 0.78 0.52 0.58 -1.65 0.00 0.00 177.43 177.66 1sx4 h VAL 438 N 0.38 1.22 0.13 2.81 2.07 0.29 -2.02 116.25 121.13 1sx4 h VAL 438 Ca 0.09 -0.46 0.01 0.00 0.82 0.00 0.00 66.70 67.16 1sx4 h VAL 438 Cb 0.50 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 1sx4 h VAL 438 CO 0.02 0.23 -0.21 1.23 0.02 0.00 0.00 177.57 178.86 1sx4 h GLY 439 N 1.14 -0.40 -0.10 2.17 0.00 -0.24 1.02 103.07 106.65 1sx4 h GLY 439 Ca 0.30 0.24 0.07 0.00 0.00 0.00 0.00 47.33 47.95 1sx4 h GLY 439 CO -0.06 -0.19 -0.32 -2.22 0.00 0.00 0.00 176.54 173.75 1sx4 h ILE 440 N -0.41 0.25 -0.67 2.60 2.04 0.18 -2.02 117.51 119.48 1sx4 h ILE 440 Ca 0.02 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.91 1sx4 h ILE 440 Cb 0.42 0.25 -0.04 0.00 -0.74 0.00 0.00 36.82 36.71 1sx4 h ILE 440 CO -0.10 0.00 0.44 0.11 0.00 0.00 0.00 178.15 178.60 1sx4 h LYS 441 N -0.27 0.78 -0.51 2.37 6.56 -0.49 0.34 116.57 125.36 1sx4 h LYS 441 Ca 0.16 -0.05 0.10 0.00 -1.06 0.00 0.00 60.65 59.80 1sx4 h LYS 441 Cb 0.53 -0.18 -0.08 0.00 -0.57 0.00 0.00 32.23 31.94 1sx4 h LYS 441 CO -0.50 0.52 0.04 0.28 -2.06 0.00 0.00 179.45 177.73 1sx4 h VAL 442 N 0.81 0.64 -0.34 0.50 2.07 0.18 -2.03 116.25 118.07 1sx4 h VAL 442 Ca 0.27 -0.05 -0.17 0.00 0.82 0.00 0.00 66.70 67.56 1sx4 h VAL 442 Cb 0.07 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 30.30 1sx4 h VAL 442 CO -0.07 0.03 -0.46 0.00 0.02 0.00 0.00 177.57 177.09 1sx4 h ALA 443 N 1.44 0.53 -0.55 1.67 0.00 0.02 -2.80 119.26 119.57 1sx4 h ALA 443 Ca 0.26 -0.48 0.03 0.00 0.00 0.00 0.00 54.91 54.71 1sx4 h ALA 443 Cb 0.38 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 1sx4 h ALA 443 CO -0.40 0.68 0.33 -0.07 0.00 0.00 0.00 179.25 179.79 1sx4 h LEU 444 N 0.72 0.53 -1.13 0.00 3.38 -0.94 -0.75 115.31 117.13 1sx4 h LEU 444 Ca 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1sx4 h LEU 444 Cb 1.06 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.66 1sx4 h LEU 444 CO 0.11 0.37 0.41 -0.09 0.09 0.00 0.00 178.44 179.33 1sx4 h ARG 445 N 0.65 1.02 -0.20 1.13 2.43 -1.36 -0.77 114.38 117.26 1sx4 h ARG 445 Ca 0.22 -0.11 -0.10 0.00 -0.81 0.00 0.00 59.98 59.19 1sx4 h ARG 445 Cb 0.02 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 1sx4 h ARG 445 CO -0.10 0.74 -0.29 0.00 -1.51 0.00 0.00 179.97 178.81 1sx4 h ALA 446 N 1.43 1.12 -0.11 2.80 0.00 -0.98 -2.90 119.26 120.62 1sx4 h ALA 446 Ca 0.26 -0.36 0.03 0.00 0.00 0.00 0.00 54.91 54.85 1sx4 h ALA 446 Cb 0.01 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1sx4 h ALA 446 CO -0.04 0.55 0.35 0.52 0.00 0.00 0.00 179.25 180.63 1sx4 h MET 447 N 0.35 0.00 0.00 0.00 2.86 0.26 0.95 114.93 119.34 1sx4 h MET 447 Ca 0.05 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 1sx4 h MET 447 Cb 0.70 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.36 1sx4 h MET 447 CO 0.05 0.00 0.00 0.39 1.06 0.00 0.00 176.91 178.41 1sx4 n GLU 448 N -3.14 0.42 -0.00 1.72 1.02 -1.09 -4.03 120.64 115.55 1sx4 n GLU 448 Ca 0.00 0.06 -0.13 0.00 -0.02 0.00 0.00 57.16 57.08 1sx4 n GLU 448 Cb 0.43 -1.50 -0.09 0.00 -0.02 0.00 0.00 31.44 30.26 1sx4 n GLU 448 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1sx4 h ALA 449 N 3.13 -0.01 -0.46 0.62 0.00 0.75 -0.95 119.26 122.34 1sx4 h ALA 449 Ca 0.00 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 54.78 1sx4 h ALA 449 Cb 0.14 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 1sx4 h ALA 449 CO 0.00 -0.30 0.12 -1.35 0.00 0.00 0.00 179.25 177.72 1sx4 h PRO 450 N -0.42 0.26 -0.30 0.00 0.11 -1.78 0.12 132.00 129.99 1sx4 h PRO 450 Ca -0.00 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.09 1sx4 h PRO 450 Cb 0.41 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.45 1sx4 h PRO 450 CO 0.00 0.17 0.16 1.25 -0.21 0.00 0.00 178.00 179.37 1sx4 h LEU 451 N 0.27 0.39 -1.50 2.35 6.46 -1.69 0.25 115.31 121.84 1sx4 h LEU 451 Ca 0.22 -0.10 -0.03 0.00 -0.12 0.00 0.00 57.88 57.86 1sx4 h LEU 451 Cb 0.27 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 40.08 1sx4 h LEU 451 CO -0.27 0.38 0.05 0.03 -0.62 0.00 0.00 178.44 178.01 1sx4 h ARG 452 N 0.37 0.37 0.03 1.25 3.08 0.61 -2.24 114.38 117.84 1sx4 h ARG 452 Ca 0.11 -0.05 -0.24 0.00 0.07 0.00 0.00 59.98 59.86 1sx4 h ARG 452 Cb 0.09 -0.07 0.01 0.00 0.08 0.00 0.00 29.97 30.08 1sx4 h ARG 452 CO -0.02 0.36 -1.02 1.96 -1.07 0.00 0.00 179.97 180.19 1sx4 h GLN 453 N 0.37 0.44 -0.59 0.04 1.08 -0.47 -2.00 115.11 113.99 1sx4 h GLN 453 Ca 0.09 -0.51 0.08 0.00 -1.45 0.00 0.00 58.65 56.85 1sx4 h GLN 453 Cb 0.17 0.15 -0.06 0.00 -0.05 0.00 0.00 27.48 27.69 1sx4 h GLN 453 CO -0.00 1.17 0.26 0.82 -0.95 0.00 0.00 178.83 180.12 1sx4 h ILE 454 N 0.23 0.84 -0.18 2.54 2.04 -0.40 0.66 117.51 123.25 1sx4 h ILE 454 Ca -0.10 -0.16 -0.14 0.00 1.00 0.00 0.00 64.86 65.46 1sx4 h ILE 454 Cb 1.67 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 38.08 1sx4 h ILE 454 CO 0.18 0.09 -0.43 0.58 0.00 0.00 0.00 178.15 178.56 1sx4 h VAL 455 N 0.47 1.33 -0.61 1.67 2.07 -1.38 -2.79 116.25 117.01 1sx4 h VAL 455 Ca 0.29 -1.68 0.02 0.00 0.82 0.00 0.00 66.70 66.15 1sx4 h VAL 455 Cb 0.30 1.93 -0.03 0.00 -1.52 0.00 0.00 31.29 31.96 1sx4 h VAL 455 CO -0.25 0.52 0.40 0.25 0.02 0.00 0.00 177.57 178.51 1sx4 h LEU 456 N 0.28 0.64 -0.59 2.57 5.85 -1.02 -1.47 115.31 121.57 1sx4 h LEU 456 Ca -0.00 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1sx4 h LEU 456 Cb 1.04 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.92 1sx4 h LEU 456 CO 0.09 0.45 0.00 0.59 -0.34 0.00 0.00 178.44 179.23 1sx4 n ASN 457 N -4.46 0.52 -0.19 1.25 5.03 0.19 -0.98 115.26 116.62 1sx4 n ASN 457 Ca 0.07 0.64 0.12 0.00 0.87 0.00 0.00 54.58 56.28 1sx4 n ASN 457 Cb 0.11 -0.74 0.26 0.00 -1.02 0.00 0.00 39.78 38.38 1sx4 n ASN 457 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1sx4 n GLY 459 N 1.41 1.05 0.61 0.00 0.00 -0.15 -5.03 105.19 103.08 1sx4 n GLY 459 Ca 0.09 -0.62 -0.04 0.00 0.00 0.00 0.00 46.02 45.45 1sx4 n GLY 459 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1sx4 n GLU 460 N -2.71 1.29 -3.22 1.61 1.02 -1.12 -5.04 120.64 112.46 1sx4 n GLU 460 Ca -0.09 -0.54 -0.44 0.00 -0.02 0.00 0.00 57.16 56.07 1sx4 n GLU 460 Cb 0.29 0.04 -0.07 0.00 -0.02 0.00 0.00 31.44 31.68 1sx4 n GLU 460 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1sx4 s GLU 461 N -2.37 3.11 0.34 3.49 2.02 -1.26 -3.94 118.70 120.09 1sx4 s GLU 461 Ca 0.06 -0.90 0.13 0.00 0.02 0.00 0.00 54.97 54.28 1sx4 s GLU 461 Cb -0.00 -4.07 0.99 0.00 0.10 0.00 0.00 34.13 31.15 1sx4 s GLU 461 CO 0.04 -1.10 1.72 -1.35 0.02 0.00 0.00 175.26 174.59 1sx4 h PRO 462 N 8.89 0.46 0.00 0.39 0.11 -1.86 -1.05 132.00 138.95 1sx4 h PRO 462 Ca -0.27 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1sx4 h PRO 462 Cb 1.10 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1sx4 h PRO 462 CO 0.91 0.31 -0.28 0.66 -0.21 0.00 0.00 178.00 179.39 1sx4 h SER 463 N 0.48 0.00 0.03 -2.05 4.64 -1.92 0.74 113.55 115.47 1sx4 h SER 463 Ca 0.66 -0.05 -0.11 0.00 -0.47 0.00 0.00 61.79 61.82 1sx4 h SER 463 Cb 1.42 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.50 1sx4 h SER 463 CO -0.46 0.03 -0.55 0.58 -0.87 0.00 0.00 176.83 175.56 1sx4 h VAL 464 N 0.00 1.46 0.68 0.95 2.07 -1.66 -2.38 116.25 117.37 1sx4 h VAL 464 Ca 0.00 -2.33 -0.03 0.00 0.82 0.00 0.00 66.70 65.16 1sx4 h VAL 464 Cb 0.84 3.00 -0.01 0.00 -1.52 0.00 0.00 31.29 33.61 1sx4 h VAL 464 CO 0.00 0.55 -0.43 0.58 0.02 0.00 0.00 177.57 178.29 1sx4 h VAL 465 N -0.87 0.13 -0.78 2.57 2.07 -1.26 -2.29 116.25 115.82 1sx4 h VAL 465 Ca -0.14 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.55 1sx4 h VAL 465 Cb 1.22 0.13 -0.11 0.00 -1.52 0.00 0.00 31.29 31.01 1sx4 h VAL 465 CO -0.03 0.00 0.25 0.00 0.02 0.00 0.00 177.57 177.80 1sx4 h ALA 466 N -0.84 1.08 -0.28 1.67 0.00 -0.99 0.45 119.26 120.36 1sx4 h ALA 466 Ca -0.09 0.16 0.06 0.00 0.00 0.00 0.00 54.91 55.05 1sx4 h ALA 466 Cb 0.85 0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.77 1sx4 h ALA 466 CO 0.08 -0.32 -0.13 -0.91 0.00 0.00 0.00 179.25 177.97 1sx4 h ASN 467 N 0.33 -0.45 0.05 0.00 4.21 -1.15 0.45 115.58 119.02 1sx4 h ASN 467 Ca 0.45 0.11 -0.10 0.00 1.21 0.00 0.00 56.30 57.97 1sx4 h ASN 467 Cb 0.77 0.25 -0.01 0.00 -1.12 0.00 0.00 38.32 38.21 1sx4 h ASN 467 CO -0.50 -0.17 -0.31 0.71 -1.29 0.00 0.00 177.43 175.87 1sx4 h THR 468 N -0.10 1.28 -0.31 2.81 1.35 -0.75 0.20 112.91 117.40 1sx4 h THR 468 Ca 0.15 -1.34 -0.13 0.00 -0.55 0.00 0.00 66.41 64.54 1sx4 h THR 468 Cb 0.32 1.47 -0.01 0.00 -1.73 0.00 0.00 68.15 68.19 1sx4 h THR 468 CO -0.34 0.42 -0.33 0.58 -0.25 0.00 0.00 175.52 175.60 1sx4 h VAL 469 N 0.34 1.28 -0.37 6.82 2.07 -0.28 -2.51 116.25 123.60 1sx4 h VAL 469 Ca 0.04 -1.46 -0.14 0.00 0.82 0.00 0.00 66.70 65.97 1sx4 h VAL 469 Cb 0.72 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 1sx4 h VAL 469 CO 0.05 0.47 -0.32 0.11 0.02 0.00 0.00 177.57 177.91 1sx4 h LYS 470 N 0.56 0.81 0.00 1.57 1.57 0.35 -1.57 116.57 119.87 1sx4 h LYS 470 Ca 0.06 -0.38 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 1sx4 h LYS 470 Cb 0.83 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.13 1sx4 h LYS 470 CO 0.07 1.01 0.05 0.41 -0.57 0.00 0.00 179.45 180.42 1sx4 n GLY 471 N -0.05 -0.40 0.00 3.86 0.00 0.66 -4.75 105.19 104.51 1sx4 n GLY 471 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1sx4 n GLY 471 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sx4 n GLY 472 N -1.39 1.97 3.14 -0.02 0.00 -0.59 -5.07 105.19 103.23 1sx4 n GLY 472 Ca 0.00 -1.93 -0.10 0.00 0.00 0.00 0.00 46.02 43.98 1sx4 n GLY 472 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1sx4 s ASP 473 N -0.97 0.08 0.03 1.61 -0.00 -1.26 -5.03 116.67 111.13 1sx4 s ASP 473 Ca 0.00 -0.39 0.00 0.00 -0.00 0.00 0.00 52.55 52.16 1sx4 s ASP 473 Cb 0.00 0.25 0.00 0.00 -0.00 0.00 0.00 42.92 43.17 1sx4 s ASP 473 CO 0.00 -0.50 0.00 0.61 -0.00 0.00 0.00 175.17 175.28 1sx4 n GLY 474 N 0.88 1.97 1.57 0.21 0.00 -1.26 -1.25 105.19 107.32 1sx4 n GLY 474 Ca -0.20 0.49 0.08 0.00 0.00 0.00 0.00 46.02 46.39 1sx4 n GLY 474 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1sx4 n ASN 475 N 3.28 5.09 -4.73 1.61 5.03 -1.26 -4.94 115.26 119.34 1sx4 n ASN 475 Ca 0.00 -2.87 -0.42 0.00 0.87 0.00 0.00 54.58 52.17 1sx4 n ASN 475 Cb 0.00 -0.63 -0.03 0.00 -1.02 0.00 0.00 39.78 38.11 1sx4 n ASN 475 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1sx4 s TYR 476 N -2.62 3.06 0.33 3.10 5.04 -0.38 -0.64 117.35 125.24 1sx4 s TYR 476 Ca 0.50 0.90 -0.18 0.00 -2.44 0.00 0.00 57.07 55.85 1sx4 s TYR 476 Cb 0.38 -3.84 0.05 0.00 0.35 0.00 0.00 41.96 38.91 1sx4 s TYR 476 CO 0.15 -2.86 0.83 0.20 -1.34 0.00 0.00 175.55 172.53 1sx4 s GLY 477 N 0.67 0.24 -0.22 8.97 0.00 0.10 -4.77 107.32 112.31 1sx4 s GLY 477 Ca 0.63 -0.58 -0.11 0.00 0.00 0.00 0.00 44.72 44.66 1sx4 s GLY 477 CO 0.38 0.16 0.16 -0.47 0.00 0.00 0.00 173.10 173.33 1sx4 s TYR 478 N -2.56 3.36 -0.54 1.90 5.04 -1.26 -1.03 117.35 122.25 1sx4 s TYR 478 Ca 0.16 0.30 -0.20 0.00 -2.44 0.00 0.00 57.07 54.88 1sx4 s TYR 478 Cb -0.05 -2.24 0.06 0.00 0.35 0.00 0.00 41.96 40.09 1sx4 s TYR 478 CO 0.09 0.16 0.73 1.21 -1.34 0.00 0.00 175.55 176.40 1sx4 s ASN 479 N 0.76 6.24 0.30 4.32 3.84 -0.10 -4.85 114.94 125.44 1sx4 s ASN 479 Ca 0.08 -0.86 -0.01 0.00 0.21 0.00 0.00 52.86 52.28 1sx4 s ASN 479 Cb -0.13 -2.33 0.46 0.00 -0.55 0.00 0.00 41.25 38.70 1sx4 s ASN 479 CO 0.02 -1.04 1.94 0.00 -2.79 0.00 0.00 177.10 175.23 1sx4 h ALA 480 N 9.14 1.38 -0.27 1.71 0.00 -1.96 -1.08 119.26 128.17 1sx4 h ALA 480 Ca -0.28 -0.09 -0.16 0.00 0.00 0.00 0.00 54.91 54.38 1sx4 h ALA 480 Cb 1.09 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1sx4 h ALA 480 CO 1.03 0.53 -0.49 0.00 0.00 0.00 0.00 179.25 180.32 1sx4 h ALA 481 N 1.46 0.64 -0.34 0.00 0.00 -1.95 -3.03 119.26 116.03 1sx4 h ALA 481 Ca 0.26 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1sx4 h ALA 481 Cb -0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1sx4 h ALA 481 CO -0.05 0.68 0.01 0.25 0.00 0.00 0.00 179.25 180.14 1sx4 n THR 482 N -4.01 2.42 -2.75 0.00 -2.24 -1.10 -4.93 114.28 101.68 1sx4 n THR 482 Ca -0.03 -1.80 -0.14 0.00 -2.27 0.00 0.00 64.05 59.81 1sx4 n THR 482 Cb 0.58 -0.27 -0.03 0.00 -2.10 0.00 0.00 70.33 68.52 1sx4 n THR 482 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1sx4 n GLU 483 N -0.27 -0.92 -4.10 -0.78 0.28 -0.46 -4.93 120.64 109.46 1sx4 n GLU 483 Ca 0.24 0.05 -0.12 0.00 -0.16 0.00 0.00 57.16 57.16 1sx4 n GLU 483 Cb 0.98 -1.59 -0.11 0.00 1.43 0.00 0.00 31.44 32.16 1sx4 n GLU 483 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 177.13 175.14 1sx4 s GLU 484 N -3.62 0.64 0.67 3.44 -1.05 -0.91 -4.96 118.70 112.92 1sx4 s GLU 484 Ca 0.22 -0.99 -0.11 0.00 -0.15 0.00 0.00 54.97 53.93 1sx4 s GLU 484 Cb -0.13 -0.22 -0.01 0.00 -0.44 0.00 0.00 34.13 33.33 1sx4 s GLU 484 CO 0.37 0.01 1.06 0.71 0.95 0.00 0.00 175.26 178.36 1sx4 s TYR 485 N -2.35 3.40 -3.19 4.83 1.51 -1.26 -0.93 117.35 119.36 1sx4 s TYR 485 Ca -0.01 1.23 0.00 0.00 -1.01 0.00 0.00 57.07 57.28 1sx4 s TYR 485 Cb -0.03 -2.88 0.00 0.00 -0.11 0.00 0.00 41.96 38.94 1sx4 s TYR 485 CO -0.02 -1.00 0.00 0.41 -1.11 0.00 0.00 175.55 173.83 1sx4 n GLY 486 N -2.66 -1.07 3.59 0.71 0.00 -0.20 -4.85 105.19 100.71 1sx4 n GLY 486 Ca 0.07 -1.03 -0.42 0.00 0.00 0.00 0.00 46.02 44.64 1sx4 n GLY 486 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1sx4 s ASN 487 N -4.00 6.51 0.34 1.61 3.84 -1.26 0.02 114.94 121.99 1sx4 s ASN 487 Ca 0.00 0.34 0.02 0.00 0.21 0.00 0.00 52.86 53.43 1sx4 s ASN 487 Cb 0.00 -2.36 0.60 0.00 -0.55 0.00 0.00 41.25 38.94 1sx4 s ASN 487 CO 0.00 -0.60 1.96 0.24 -2.79 0.00 0.00 177.10 175.91 1sx4 h MET 488 N 8.34 0.79 -0.36 0.43 2.86 -1.19 -1.99 114.93 123.82 1sx4 h MET 488 Ca -0.26 -0.08 -0.15 0.00 -2.06 0.00 0.00 59.70 57.15 1sx4 h MET 488 Cb 1.11 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.60 1sx4 h MET 488 CO 0.85 0.58 -0.38 0.82 1.06 0.00 0.00 176.91 179.84 1sx4 h ILE 489 N 0.79 1.28 -0.42 -1.22 1.08 -1.82 -1.69 117.51 115.52 1sx4 h ILE 489 Ca 0.20 -1.56 -0.07 0.00 -0.39 0.00 0.00 64.86 63.04 1sx4 h ILE 489 Cb 0.02 1.40 -0.02 0.00 -3.07 0.00 0.00 36.82 35.16 1sx4 h ILE 489 CO -0.03 0.52 -0.05 0.44 -0.69 0.00 0.00 178.15 178.33 1sx4 h ASP 490 N 0.71 0.67 0.11 1.72 3.32 -1.89 -2.71 116.42 118.36 1sx4 h ASP 490 Ca 0.06 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 56.94 1sx4 h ASP 490 Cb 0.96 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.33 1sx4 h ASP 490 CO 0.09 0.78 -0.00 0.23 -1.72 0.00 0.00 179.24 178.61 1sx4 n MET 491 N -4.21 0.91 -1.68 3.56 2.81 -0.77 -4.89 117.12 112.85 1sx4 n MET 491 Ca 0.02 -0.03 -0.06 0.00 -1.81 0.00 0.00 57.70 55.81 1sx4 n MET 491 Cb 0.31 -1.50 -0.01 0.00 -0.71 0.00 0.00 33.22 31.31 1sx4 n MET 491 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1sx4 n GLY 492 N 1.06 0.46 3.20 3.03 0.00 -1.02 -4.97 105.19 106.94 1sx4 n GLY 492 Ca 0.22 -0.71 -0.44 0.00 0.00 0.00 0.00 46.02 45.09 1sx4 n GLY 492 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1sx4 n ILE 493 N -3.46 4.83 -3.82 -0.61 5.41 -0.66 -4.81 119.36 116.24 1sx4 n ILE 493 Ca -0.07 -5.49 -0.36 0.00 1.00 0.00 0.00 62.75 57.84 1sx4 n ILE 493 Cb 0.39 -2.38 -0.10 0.00 -0.71 0.00 0.00 39.64 36.84 1sx4 n ILE 493 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1sx4 s LEU 494 N -1.57 3.82 -0.07 1.39 1.43 -1.26 -1.41 118.68 121.01 1sx4 s LEU 494 Ca 0.32 0.01 -0.10 0.00 -1.03 0.00 0.00 54.13 53.34 1sx4 s LEU 494 Cb -0.03 -2.00 -0.05 0.00 0.03 0.00 0.00 46.19 44.14 1sx4 s LEU 494 CO 0.00 0.08 0.24 -1.81 0.23 0.00 0.00 176.35 175.09 1sx4 s ASP 495 N 0.98 6.55 0.09 2.29 1.01 -0.95 -4.61 116.67 122.02 1sx4 s ASP 495 Ca 0.05 0.65 -0.30 0.00 0.71 0.00 0.00 52.55 53.66 1sx4 s ASP 495 Cb -0.14 -2.14 -0.06 0.00 1.01 0.00 0.00 42.92 41.60 1sx4 s ASP 495 CO 0.03 0.37 1.11 -2.84 0.21 0.00 0.00 175.17 174.05 1sx4 s PRO 496 N -1.11 4.52 0.09 8.23 0.02 -1.26 -1.88 135.00 143.61 1sx4 s PRO 496 Ca 0.19 1.67 -0.29 0.00 0.02 0.00 0.00 61.00 62.59 1sx4 s PRO 496 Cb -0.14 -3.35 -0.12 0.00 0.02 0.00 0.00 34.50 30.91 1sx4 s PRO 496 CO 0.08 -0.09 1.47 1.15 -0.33 0.00 0.00 177.00 179.28 1sx4 h THR 497 N 4.31 0.00 -1.31 0.99 2.02 0.22 0.25 112.91 119.39 1sx4 h THR 497 Ca -0.42 0.00 0.38 0.00 0.77 0.00 0.00 66.41 67.14 1sx4 h THR 497 Cb 1.21 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 67.57 1sx4 h THR 497 CO 0.77 0.00 1.10 1.17 0.37 0.00 0.00 175.52 178.93 1sx4 n LYS 498 N -5.02 0.00 0.03 6.66 4.81 -1.26 -0.75 118.16 122.63 1sx4 n LYS 498 Ca -0.07 0.86 -0.21 0.00 -0.87 0.00 0.00 58.31 58.02 1sx4 n LYS 498 Cb 0.35 -2.05 -0.14 0.00 0.02 0.00 0.00 35.03 33.21 1sx4 n LYS 498 CO 0.00 0.00 0.00 -0.39 1.17 0.00 0.00 177.40 178.18 1sx4 h VAL 499 N 0.00 1.23 -0.61 3.15 -1.51 -0.86 -2.06 116.25 115.58 1sx4 h VAL 499 Ca 0.62 -2.47 0.04 0.00 -1.23 0.00 0.00 66.70 63.67 1sx4 h VAL 499 Cb 2.81 2.92 -0.04 0.00 -2.13 0.00 0.00 31.29 34.85 1sx4 h VAL 499 CO -0.01 0.71 0.41 0.74 -1.23 0.00 0.00 177.57 178.19 1sx4 h THR 500 N -0.32 1.05 0.02 7.19 2.02 -0.86 0.13 112.91 122.13 1sx4 h THR 500 Ca -0.24 -0.23 -0.27 0.00 0.77 0.00 0.00 66.41 66.44 1sx4 h THR 500 Cb 1.72 0.31 0.02 0.00 -1.74 0.00 0.00 68.15 68.47 1sx4 h THR 500 CO 0.10 0.12 -1.06 -0.09 0.37 0.00 0.00 175.52 174.96 1sx4 h ARG 501 N 0.68 0.66 -0.18 6.66 1.12 -1.01 -2.36 114.38 119.95 1sx4 h ARG 501 Ca 0.25 -0.73 -0.13 0.00 -1.11 0.00 0.00 59.98 58.26 1sx4 h ARG 501 Cb 0.15 0.21 0.00 0.00 -0.01 0.00 0.00 29.97 30.32 1sx4 h ARG 501 CO -0.07 1.31 -0.41 0.77 -3.11 0.00 0.00 179.97 178.46 1sx4 h SER 502 N 0.36 0.66 -0.67 -3.80 0.02 -0.79 -1.66 113.55 107.68 1sx4 h SER 502 Ca -0.13 -0.57 0.13 0.00 -0.84 0.00 0.00 61.79 60.38 1sx4 h SER 502 Cb 1.71 -0.19 -0.13 0.00 0.14 0.00 0.00 62.40 63.93 1sx4 h SER 502 CO 0.20 1.11 -0.21 0.00 -1.14 0.00 0.00 176.83 176.79 1sx4 h ALA 503 N 0.57 0.34 -0.45 3.77 0.00 -0.79 -0.91 119.26 121.79 1sx4 h ALA 503 Ca -0.00 0.25 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 1sx4 h ALA 503 Cb 1.02 0.59 -0.02 0.00 0.00 0.00 0.00 17.79 19.38 1sx4 h ALA 503 CO 0.09 -0.48 0.17 1.25 0.00 0.00 0.00 179.25 180.28 1sx4 h LEU 504 N -0.04 0.63 0.19 0.00 6.46 -1.09 -2.21 115.31 119.25 1sx4 h LEU 504 Ca 0.31 -0.18 -0.01 0.00 -0.12 0.00 0.00 57.88 57.88 1sx4 h LEU 504 Cb 0.52 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 40.29 1sx4 h LEU 504 CO -0.71 0.64 -0.09 1.56 -0.62 0.00 0.00 178.44 179.23 1sx4 h GLN 505 N 0.58 -0.24 -0.20 1.25 4.20 -0.68 -1.73 115.11 118.29 1sx4 h GLN 505 Ca 0.15 0.02 -0.17 0.00 0.06 0.00 0.00 58.65 58.70 1sx4 h GLN 505 Cb 0.22 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.06 1sx4 h GLN 505 CO -0.01 -0.08 -0.56 1.88 -0.67 0.00 0.00 178.83 179.39 1sx4 h TYR 506 N -0.35 0.94 0.03 2.96 0.05 -1.24 -1.11 116.97 118.25 1sx4 h TYR 506 Ca -0.03 -0.37 0.02 0.00 0.05 0.00 0.00 58.73 58.41 1sx4 h TYR 506 Cb 0.27 -0.16 -0.03 0.00 1.01 0.00 0.00 36.73 37.82 1sx4 h TYR 506 CO -0.04 1.17 -0.18 0.00 -1.05 0.00 0.00 178.16 178.07 1sx4 h ALA 507 N 0.59 -0.25 -0.29 3.88 0.00 -1.43 -2.11 119.26 119.65 1sx4 h ALA 507 Ca -0.01 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1sx4 h ALA 507 Cb 1.18 0.30 -0.02 0.00 0.00 0.00 0.00 17.79 19.25 1sx4 h ALA 507 CO 0.12 -0.68 -0.02 0.00 0.00 0.00 0.00 179.25 178.67 1sx4 h ALA 508 N 0.58 1.44 -0.59 0.00 0.00 -1.17 -0.32 119.26 119.21 1sx4 h ALA 508 Ca 0.05 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 1sx4 h ALA 508 Cb 0.36 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1sx4 h ALA 508 CO -0.15 0.39 0.01 1.03 0.00 0.00 0.00 179.25 180.53 1sx4 h SER 509 N 0.42 1.00 0.13 0.00 0.87 -0.53 0.93 113.55 116.37 1sx4 h SER 509 Ca 0.09 -0.27 -0.34 0.00 -1.23 0.00 0.00 61.79 60.04 1sx4 h SER 509 Cb 0.31 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.99 1sx4 h SER 509 CO 0.01 1.05 -1.80 -0.37 -0.53 0.00 0.00 176.83 175.19 1sx4 h VAL 510 N 0.94 0.78 -0.64 2.23 -1.51 -1.39 -3.34 116.25 113.32 1sx4 h VAL 510 Ca 0.17 -2.38 0.10 0.00 -1.23 0.00 0.00 66.70 63.37 1sx4 h VAL 510 Cb 0.53 2.58 -0.08 0.00 -2.13 0.00 0.00 31.29 32.19 1sx4 h VAL 510 CO 0.03 0.82 0.24 0.00 -1.23 0.00 0.00 177.57 177.43 1sx4 h ALA 511 N 0.02 0.85 -0.57 5.19 0.00 -0.93 -0.76 119.26 123.05 1sx4 h ALA 511 Ca -0.38 0.09 0.12 0.00 0.00 0.00 0.00 54.91 54.73 1sx4 h ALA 511 Cb 1.95 0.06 -0.10 0.00 0.00 0.00 0.00 17.79 19.71 1sx4 h ALA 511 CO 0.08 -0.19 -0.07 0.78 0.00 0.00 0.00 179.25 179.85 1sx4 h GLY 512 N 0.42 0.51 1.00 0.00 0.00 0.76 -2.14 103.07 103.62 1sx4 h GLY 512 Ca 0.33 0.13 -0.12 0.00 0.00 0.00 0.00 47.33 47.68 1sx4 h GLY 512 CO -0.33 -0.20 -0.23 1.41 0.00 0.00 0.00 176.54 177.19 1sx4 h LEU 513 N 0.06 0.81 -1.08 3.11 3.38 -1.36 -2.76 115.31 117.46 1sx4 h LEU 513 Ca 0.29 -0.43 0.12 0.00 0.09 0.00 0.00 57.88 57.95 1sx4 h LEU 513 Cb 0.45 -0.23 -0.08 0.00 0.09 0.00 0.00 40.66 40.89 1sx4 h LEU 513 CO -0.54 1.07 0.62 0.24 0.09 0.00 0.00 178.44 179.92 1sx4 h MET 514 N 0.56 0.90 0.00 1.13 2.86 -0.54 -1.55 114.93 118.29 1sx4 h MET 514 Ca 0.07 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1sx4 h MET 514 Cb 0.79 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.25 1sx4 h MET 514 CO 0.06 0.60 0.00 0.44 1.06 0.00 0.00 176.91 179.07 1sx4 n ILE 515 N -4.59 0.00 -0.83 -1.22 -5.35 -1.01 -1.67 119.36 104.69 1sx4 n ILE 515 Ca 0.18 0.00 0.08 0.00 -0.27 0.00 0.00 62.75 62.74 1sx4 n ILE 515 Cb 0.37 -0.45 0.26 0.00 -1.74 0.00 0.00 39.64 38.08 1sx4 n ILE 515 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1sx4 n THR 516 N -0.92 2.08 -2.04 7.28 -2.24 -0.58 -4.86 114.28 112.99 1sx4 n THR 516 Ca 0.19 -1.66 -0.42 0.00 -2.27 0.00 0.00 64.05 59.89 1sx4 n THR 516 Cb 0.09 -0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 68.18 1sx4 n THR 516 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1sx4 s THR 517 N -2.46 2.83 0.00 4.28 2.01 -0.67 -4.93 115.64 116.71 1sx4 s THR 517 Ca 0.40 0.64 0.00 0.00 0.31 0.00 0.00 61.69 63.04 1sx4 s THR 517 Cb 0.31 -3.41 0.00 0.00 0.01 0.00 0.00 72.50 69.41 1sx4 s THR 517 CO 0.11 0.08 0.00 1.21 -0.69 0.00 0.00 174.62 175.33 1sx4 n GLU 518 N 3.18 2.98 -4.11 4.92 4.07 -1.26 -4.81 120.64 125.60 1sx4 n GLU 518 Ca 0.10 0.00 -0.10 0.00 -0.06 0.00 0.00 57.16 57.10 1sx4 n GLU 518 Cb 0.40 -0.71 -0.10 0.00 -0.06 0.00 0.00 31.44 30.97 1sx4 n GLU 518 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1sx4 s MET 520 N -3.11 0.08 -0.03 0.00 -1.94 0.32 -4.95 119.30 109.66 1sx4 s MET 520 Ca 0.03 0.27 0.06 0.00 -1.71 0.00 0.00 55.69 54.34 1sx4 s MET 520 Cb 0.01 -0.12 -0.01 0.00 2.01 0.00 0.00 34.83 36.72 1sx4 s MET 520 CO -0.05 -0.12 -0.21 0.08 -0.01 0.00 0.00 175.02 174.71 1sx4 s VAL 521 N 0.83 1.69 0.04 -6.03 1.01 -1.26 -0.15 120.40 116.52 1sx4 s VAL 521 Ca -0.06 -0.89 -0.03 0.00 0.00 0.00 0.00 61.98 60.99 1sx4 s VAL 521 Cb -0.09 -1.42 0.01 0.00 0.00 0.00 0.00 36.38 34.89 1sx4 s VAL 521 CO -0.04 0.48 0.17 1.07 0.00 0.00 0.00 175.10 176.78 1sx4 n THR 522 N 2.81 0.00 -2.83 3.92 5.66 -1.13 -5.01 114.28 117.70 1sx4 n THR 522 Ca -0.17 -0.12 -0.23 0.00 -3.05 0.00 0.00 64.05 60.48 1sx4 n THR 522 Cb 0.53 0.15 0.02 0.00 -1.55 0.00 0.00 70.33 69.47 1sx4 n THR 522 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 1sx4 s ASP 523 N -1.42 5.70 0.37 1.09 1.11 -1.26 -1.33 116.67 120.92 1sx4 s ASP 523 Ca 0.04 0.30 -0.26 0.00 0.18 0.00 0.00 52.55 52.81 1sx4 s ASP 523 Cb -0.01 -1.45 -0.09 0.00 1.07 0.00 0.00 42.92 42.45 1sx4 s ASP 523 CO 0.01 -0.83 1.07 -0.76 1.18 0.00 0.00 175.17 175.84 1sx4 s LEU 524 N -4.66 4.25 0.00 1.23 1.43 -1.14 -4.32 118.68 115.47 1sx4 s LEU 524 Ca 0.51 2.13 0.00 0.00 -1.03 0.00 0.00 54.13 55.73 1sx4 s LEU 524 Cb -0.10 -4.02 0.00 0.00 0.03 0.00 0.00 46.19 42.10 1sx4 s LEU 524 CO 0.39 -0.42 0.48 -0.81 0.23 0.00 0.00 176.35 176.22