#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 -2.42 -2.72 0.00 0.00 -1.26 -4.94 120.51 109.17 1sx4 n ALA 3 Ca 0.00 0.48 -0.25 0.00 0.00 0.00 0.00 53.44 53.67 1sx4 n ALA 3 Cb 0.00 -1.77 -0.07 0.00 0.00 0.00 0.00 19.45 17.61 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 -0.66 2.60 -0.32 0.00 -0.14 -1.26 -3.02 119.74 116.93 1sx4 s LYS 4 Ca 0.72 -1.07 -0.09 0.00 -1.36 0.00 0.00 55.97 54.18 1sx4 s LYS 4 Cb -0.98 -2.44 0.01 0.00 -1.68 0.00 0.00 37.83 32.74 1sx4 s LYS 4 CO 0.56 0.45 0.14 0.34 -0.76 0.00 0.00 175.35 176.07 1sx4 s ASP 5 N -3.19 5.43 -0.15 2.83 -1.08 -0.23 -4.82 116.67 115.46 1sx4 s ASP 5 Ca 0.30 -0.75 -0.06 0.00 -0.52 0.00 0.00 52.55 51.52 1sx4 s ASP 5 Cb -0.09 -1.95 -0.04 0.00 -1.46 0.00 0.00 42.92 39.38 1sx4 s ASP 5 CO 0.21 -0.25 0.06 0.68 0.52 0.00 0.00 175.17 176.39 1sx4 s VAL 6 N 1.54 4.81 0.02 1.11 -7.23 -1.26 -2.93 120.40 116.47 1sx4 s VAL 6 Ca 0.03 -0.04 0.09 0.00 -1.81 0.00 0.00 61.98 60.25 1sx4 s VAL 6 Cb -0.18 -3.12 -0.03 0.00 0.56 0.00 0.00 36.38 33.61 1sx4 s VAL 6 CO 0.05 0.53 -0.26 -0.54 -0.31 0.00 0.00 175.10 174.56 1sx4 s LYS 7 N -0.19 1.89 0.27 4.82 1.02 0.10 -4.97 119.74 122.70 1sx4 s LYS 7 Ca 0.08 -1.03 0.11 0.00 0.02 0.00 0.00 55.97 55.15 1sx4 s LYS 7 Cb -0.12 -1.97 -0.05 0.00 -0.52 0.00 0.00 37.83 35.17 1sx4 s LYS 7 CO 0.01 0.52 -0.16 -0.06 -0.92 0.00 0.00 175.35 174.74 1sx4 s PHE 8 N -0.73 2.38 0.00 3.18 0.40 -1.26 -0.48 117.98 121.47 1sx4 s PHE 8 Ca 0.11 -0.31 0.00 0.00 -0.60 0.00 0.00 56.93 56.13 1sx4 s PHE 8 Cb -0.10 -1.04 0.00 0.00 0.51 0.00 0.00 43.02 42.39 1sx4 s PHE 8 CO 0.01 0.69 0.00 0.41 0.70 0.00 0.00 175.22 177.03 1sx4 n GLY 9 N -0.62 1.17 0.28 4.36 0.00 0.41 -2.15 105.19 108.64 1sx4 n GLY 9 Ca -0.06 0.02 -0.02 0.00 0.00 0.00 0.00 46.02 45.97 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 0.70 -0.43 1.61 -1.24 -1.94 0.12 115.58 114.39 1sx4 h ASN 10 Ca 0.00 0.01 0.04 0.00 0.71 0.00 0.00 56.30 57.06 1sx4 h ASN 10 Cb 0.00 -0.13 -0.05 0.00 0.73 0.00 0.00 38.32 38.86 1sx4 h ASN 10 CO 0.00 0.46 -0.28 -0.78 -1.29 0.00 0.00 177.43 175.55 1sx4 h ASP 11 N 0.83 -1.01 -0.57 1.15 3.58 -1.98 0.15 116.42 118.57 1sx4 h ASP 11 Ca 0.31 0.15 0.00 0.00 0.42 0.00 0.00 57.03 57.91 1sx4 h ASP 11 Cb 0.11 0.44 -0.03 0.00 1.72 0.00 0.00 39.33 41.57 1sx4 h ASP 11 CO -0.15 -0.12 0.37 0.00 -2.88 0.00 0.00 179.24 176.47 1sx4 h ALA 12 N -0.35 0.72 0.38 -0.78 0.00 -0.31 -3.04 119.26 115.88 1sx4 h ALA 12 Ca 0.07 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1sx4 h ALA 12 Cb 0.21 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1sx4 h ALA 12 CO -0.42 0.17 -0.18 0.00 0.00 0.00 0.00 179.25 178.81 1sx4 h ARG 13 N 0.77 -0.50 -0.93 0.00 3.08 -0.95 0.48 114.38 116.34 1sx4 h ARG 13 Ca 0.21 0.03 0.21 0.00 0.07 0.00 0.00 59.98 60.51 1sx4 h ARG 13 Cb -0.08 0.11 -0.17 0.00 0.08 0.00 0.00 29.97 29.91 1sx4 h ARG 13 CO -0.04 -0.32 -0.11 0.28 -1.07 0.00 0.00 179.97 178.71 1sx4 h VAL 14 N -0.54 0.09 -0.01 2.04 2.07 -0.65 0.57 116.25 119.83 1sx4 h VAL 14 Ca -0.05 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 1sx4 h VAL 14 Cb 0.41 0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 30.25 1sx4 h VAL 14 CO 0.09 0.00 0.00 0.11 0.02 0.00 0.00 177.57 177.79 1sx4 h LYS 15 N 0.02 0.01 -0.88 1.57 1.79 -1.34 -1.08 116.57 116.66 1sx4 h LYS 15 Ca 0.50 -0.00 0.19 0.00 -2.18 0.00 0.00 60.65 59.16 1sx4 h LYS 15 Cb 0.88 -0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 31.47 1sx4 h LYS 15 CO -0.91 0.23 0.58 1.98 -1.08 0.00 0.00 179.45 180.25 1sx4 h MET 16 N -0.21 0.40 -0.15 3.15 4.05 0.22 -0.94 114.93 121.46 1sx4 h MET 16 Ca 0.00 -0.02 -0.10 0.00 -0.28 0.00 0.00 59.70 59.30 1sx4 h MET 16 Cb 0.22 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 30.93 1sx4 h MET 16 CO -0.00 0.27 -0.28 1.25 0.23 0.00 0.00 176.91 178.37 1sx4 h LEU 17 N 0.42 0.50 -0.70 3.39 5.85 -0.20 -1.47 115.31 123.09 1sx4 h LEU 17 Ca 0.45 -0.55 0.11 0.00 0.84 0.00 0.00 57.88 58.73 1sx4 h LEU 17 Cb 1.11 -0.14 -0.08 0.00 0.37 0.00 0.00 40.66 41.91 1sx4 h LEU 17 CO -0.17 0.96 0.31 0.03 -0.34 0.00 0.00 178.44 179.23 1sx4 h ARG 18 N 0.07 0.48 0.44 1.25 3.08 0.12 0.68 114.38 120.50 1sx4 h ARG 18 Ca 0.01 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 1sx4 h ARG 18 Cb 0.87 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.81 1sx4 h ARG 18 CO 0.06 0.32 -0.30 0.78 -1.07 0.00 0.00 179.97 179.76 1sx4 h GLY 19 N 0.50 -0.77 -0.53 0.04 0.00 -1.29 0.38 103.07 101.40 1sx4 h GLY 19 Ca 0.36 0.33 0.12 0.00 0.00 0.00 0.00 47.33 48.14 1sx4 h GLY 19 CO -0.33 -0.28 -0.34 -2.08 0.00 0.00 0.00 176.54 173.51 1sx4 h VAL 20 N -0.72 0.14 -0.47 4.60 2.07 -0.76 -3.09 116.25 118.03 1sx4 h VAL 20 Ca -0.05 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.53 1sx4 h VAL 20 Cb 0.60 0.14 -0.05 0.00 -1.52 0.00 0.00 31.29 30.46 1sx4 h VAL 20 CO 0.03 0.00 0.19 0.78 0.02 0.00 0.00 177.57 178.59 1sx4 h ASN 21 N -0.12 0.23 -0.13 0.57 -0.26 0.11 0.18 115.58 116.16 1sx4 h ASN 21 Ca 0.26 0.05 0.03 0.00 -0.56 0.00 0.00 56.30 56.07 1sx4 h ASN 21 Cb 0.56 0.02 -0.03 0.00 -1.06 0.00 0.00 38.32 37.81 1sx4 h ASN 21 CO -0.74 0.16 -0.04 0.58 -1.06 0.00 0.00 177.43 176.33 1sx4 h VAL 22 N 0.38 0.85 0.98 2.81 2.07 -0.90 0.21 116.25 122.64 1sx4 h VAL 22 Ca 0.22 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.69 1sx4 h VAL 22 Cb 0.20 0.85 0.01 0.00 -1.52 0.00 0.00 31.29 30.82 1sx4 h VAL 22 CO -0.20 0.00 -0.47 0.25 0.02 0.00 0.00 177.57 177.17 1sx4 h LEU 23 N -0.02 -1.11 -0.88 2.57 7.12 -1.39 -2.11 115.31 119.50 1sx4 h LEU 23 Ca 0.06 0.04 0.20 0.00 0.13 0.00 0.00 57.88 58.31 1sx4 h LEU 23 Cb 0.11 0.29 -0.11 0.00 -0.53 0.00 0.00 40.66 40.42 1sx4 h LEU 23 CO -0.14 -0.78 0.40 0.00 -0.13 0.00 0.00 178.44 177.80 1sx4 h ALA 24 N -1.36 1.38 0.00 1.25 0.00 -0.46 0.24 119.26 120.30 1sx4 h ALA 24 Ca -0.13 0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1sx4 h ALA 24 Cb 1.00 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1sx4 h ALA 24 CO 0.22 -0.26 -0.44 -0.44 0.00 0.00 0.00 179.25 178.33 1sx4 h ASP 25 N 0.47 0.00 0.86 0.00 5.19 -0.46 0.06 116.42 122.53 1sx4 h ASP 25 Ca 0.53 0.00 -0.08 0.00 -0.62 0.00 0.00 57.03 56.85 1sx4 h ASP 25 Cb 0.93 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.43 1sx4 h ASP 25 CO -0.48 0.44 -0.40 0.00 -3.12 0.00 0.00 179.24 175.68 1sx4 h ALA 26 N 1.56 0.98 0.02 3.45 0.00 0.07 -3.26 119.26 122.08 1sx4 h ALA 26 Ca -0.00 -0.36 -0.21 0.00 0.00 0.00 0.00 54.91 54.33 1sx4 h ALA 26 Cb 0.89 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1sx4 h ALA 26 CO 0.06 0.50 -0.99 0.28 0.00 0.00 0.00 179.25 179.10 1sx4 h VAL 27 N 0.00 1.61 0.00 0.00 2.07 0.20 -3.33 116.25 116.80 1sx4 h VAL 27 Ca -0.00 -3.10 -0.03 0.00 0.82 0.00 0.00 66.70 64.39 1sx4 h VAL 27 Cb 0.94 2.73 -0.00 0.00 -1.52 0.00 0.00 31.29 33.44 1sx4 h VAL 27 CO 0.05 0.89 -0.17 0.11 0.02 0.00 0.00 177.57 178.48 1sx4 h LYS 28 N 0.03 0.00 0.00 1.57 1.57 -1.08 -2.88 116.57 115.79 1sx4 h LYS 28 Ca -0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1sx4 h LYS 28 Cb 1.70 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.01 1sx4 h LYS 28 CO 0.14 0.17 0.00 -0.39 -0.57 0.00 0.00 179.45 178.80 1sx4 h VAL 29 N 0.00 0.00 -0.68 0.50 -1.51 -1.68 -0.11 116.25 112.77 1sx4 h VAL 29 Ca -0.00 -0.12 0.00 0.00 -1.23 0.00 0.00 66.70 65.35 1sx4 h VAL 29 Cb 0.30 0.80 0.00 0.00 -2.13 0.00 0.00 31.29 30.26 1sx4 h VAL 29 CO 0.02 0.00 0.00 0.35 -1.23 0.00 0.00 177.57 176.71 1sx4 n THR 30 N -2.45 1.69 -3.11 7.19 -2.24 -1.09 -2.15 114.28 112.11 1sx4 n THR 30 Ca -0.00 -1.15 -0.39 0.00 -2.27 0.00 0.00 64.05 60.23 1sx4 n THR 30 Cb 0.12 0.19 -0.05 0.00 -2.10 0.00 0.00 70.33 68.49 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 -1.69 4.41 0.08 3.22 2.96 -0.06 -4.55 118.68 123.05 1sx4 s LEU 31 Ca 0.52 1.25 0.00 0.00 -0.22 0.00 0.00 54.13 55.67 1sx4 s LEU 31 Cb 0.32 -3.04 0.00 0.00 0.50 0.00 0.00 46.19 43.97 1sx4 s LEU 31 CO 0.27 0.04 0.00 0.61 -1.32 0.00 0.00 176.35 175.95 1sx4 n GLY 32 N 2.55 -1.50 0.35 7.98 0.00 -1.26 -3.71 105.19 109.59 1sx4 n GLY 32 Ca -0.05 -1.45 -0.02 0.00 0.00 0.00 0.00 46.02 44.51 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 -0.31 1.07 -1.11 1.61 0.13 -1.91 0.07 132.00 131.54 1sx4 h PRO 33 Ca 0.00 -0.11 -0.04 0.00 -0.87 0.00 0.00 66.00 64.97 1sx4 h PRO 33 Cb 0.31 -0.21 -0.03 0.00 0.13 0.00 0.00 31.00 31.20 1sx4 h PRO 33 CO 0.00 0.78 0.06 1.63 -0.23 0.00 0.00 178.00 180.24 1sx4 n LYS 34 N -4.36 1.11 -1.35 0.86 5.02 -1.26 -4.92 118.16 113.26 1sx4 n LYS 34 Ca 0.08 -0.25 -0.31 0.00 -2.02 0.00 0.00 58.31 55.81 1sx4 n LYS 34 Cb 0.09 -1.10 0.09 0.00 -0.02 0.00 0.00 35.03 34.09 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 0.91 1.66 0.42 0.72 0.00 0.01 -4.60 107.32 106.44 1sx4 s GLY 35 Ca 0.05 0.13 0.04 0.00 0.00 0.00 0.00 44.72 44.93 1sx4 s GLY 35 CO 0.01 0.49 0.04 0.50 0.00 0.00 0.00 173.10 174.14 1sx4 s ARG 36 N -4.97 1.94 0.30 2.90 0.52 -0.91 -4.94 118.95 113.79 1sx4 s ARG 36 Ca 0.61 -2.15 0.08 0.00 -0.52 0.00 0.00 55.73 53.74 1sx4 s ARG 36 Cb -0.16 -1.22 -0.03 0.00 0.52 0.00 0.00 34.95 34.05 1sx4 s ARG 36 CO 0.56 -0.25 0.21 -0.80 0.02 0.00 0.00 175.30 175.03 1sx4 s ASN 37 N -3.68 5.19 0.18 0.23 0.01 -1.26 -3.84 114.94 111.77 1sx4 s ASN 37 Ca 0.25 -0.47 0.10 0.00 -0.71 0.00 0.00 52.86 52.03 1sx4 s ASN 37 Cb 0.06 -1.06 -0.04 0.00 0.41 0.00 0.00 41.25 40.62 1sx4 s ASN 37 CO 0.13 -0.20 -0.15 -0.69 -1.51 0.00 0.00 177.10 174.67 1sx4 s VAL 38 N -2.27 2.90 -0.17 1.60 1.01 0.31 -4.95 120.40 118.82 1sx4 s VAL 38 Ca 0.37 -1.75 -0.01 0.00 0.00 0.00 0.00 61.98 60.59 1sx4 s VAL 38 Cb -0.06 -2.41 -0.00 0.00 0.00 0.00 0.00 36.38 33.91 1sx4 s VAL 38 CO 0.25 -0.09 -0.13 -0.69 0.00 0.00 0.00 175.10 174.44 1sx4 s VAL 39 N -1.63 2.84 -0.18 2.92 1.01 -1.26 -1.28 120.40 122.83 1sx4 s VAL 39 Ca 0.23 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.49 1sx4 s VAL 39 Cb -0.09 -2.23 -0.01 0.00 0.00 0.00 0.00 36.38 34.06 1sx4 s VAL 39 CO 0.13 0.50 -0.09 -0.76 0.00 0.00 0.00 175.10 174.88 1sx4 s LEU 40 N 0.97 2.82 0.96 3.92 1.43 -0.56 -4.97 118.68 123.26 1sx4 s LEU 40 Ca -0.02 -0.35 -0.15 0.00 -1.03 0.00 0.00 54.13 52.58 1sx4 s LEU 40 Cb -0.15 -1.68 0.19 0.00 0.03 0.00 0.00 46.19 44.58 1sx4 s LEU 40 CO -0.02 0.08 1.26 -0.62 0.23 0.00 0.00 176.35 177.27 1sx4 s ASP 41 N 0.90 3.10 -0.30 2.29 2.15 -1.26 -1.88 116.67 121.67 1sx4 s ASP 41 Ca -0.02 0.46 -0.10 0.00 0.43 0.00 0.00 52.55 53.32 1sx4 s ASP 41 Cb -0.15 -0.65 0.17 0.00 -0.30 0.00 0.00 42.92 41.99 1sx4 s ASP 41 CO 0.00 -2.76 0.84 -0.54 -0.17 0.00 0.00 175.17 172.55 1sx4 s LYS 42 N -5.73 0.40 0.33 4.34 1.02 -1.26 -4.82 119.74 114.03 1sx4 s LYS 42 Ca 0.71 0.87 0.07 0.00 0.02 0.00 0.00 55.97 57.63 1sx4 s LYS 42 Cb -0.07 0.51 0.75 0.00 -0.52 0.00 0.00 37.83 38.50 1sx4 s LYS 42 CO 0.53 -0.27 1.85 0.66 -0.92 0.00 0.00 175.35 177.20 1sx4 h SER 43 N 7.83 0.73 0.00 2.83 4.64 -1.98 -3.25 113.55 124.34 1sx4 h SER 43 Ca -0.17 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 1sx4 h SER 43 Cb 1.13 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 1sx4 h SER 43 CO 0.09 0.36 0.00 0.49 -0.87 0.00 0.00 176.83 176.90 1sx4 n PHE 44 N -4.60 0.00 0.00 4.77 3.72 -1.26 -5.03 117.46 115.06 1sx4 n PHE 44 Ca 0.18 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.58 1sx4 n PHE 44 Cb 0.46 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.00 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 5.48 3.69 1.37 0.00 -1.23 -5.12 105.19 109.38 1sx4 n GLY 45 Ca 0.00 -0.89 -0.38 0.00 0.00 0.00 0.00 46.02 44.75 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 0.91 -0.28 4.61 0.00 -1.26 -4.62 120.51 116.87 1sx4 n ALA 46 Ca 0.00 0.05 -0.16 0.00 0.00 0.00 0.00 53.44 53.33 1sx4 n ALA 46 Cb 0.00 -2.25 0.26 0.00 0.00 0.00 0.00 19.45 17.46 1sx4 n ALA 46 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1sx4 n PRO 47 N -1.23 -4.16 -4.46 0.00 -0.02 -1.26 -4.74 135.00 119.12 1sx4 n PRO 47 Ca 0.13 -1.31 -0.24 0.00 -2.02 0.00 0.00 63.50 60.07 1sx4 n PRO 47 Cb 0.46 -1.82 -0.17 0.00 -0.02 0.00 0.00 33.50 31.96 1sx4 n PRO 47 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1sx4 s THR 48 N -2.09 1.02 -0.23 3.45 2.01 -0.79 -4.96 115.64 114.05 1sx4 s THR 48 Ca 0.60 -0.40 -0.09 0.00 0.31 0.00 0.00 61.69 62.11 1sx4 s THR 48 Cb -0.11 -0.96 -0.04 0.00 0.01 0.00 0.00 72.50 71.41 1sx4 s THR 48 CO 0.50 0.33 0.11 -0.63 -0.69 0.00 0.00 174.62 174.25 1sx4 s ILE 49 N 0.79 4.90 0.05 1.82 1.01 -1.26 -1.50 121.20 127.00 1sx4 s ILE 49 Ca -0.13 0.02 -0.04 0.00 0.00 0.00 0.00 60.65 60.51 1sx4 s ILE 49 Cb -0.15 -3.27 -0.02 0.00 0.01 0.00 0.00 42.46 39.02 1sx4 s ILE 49 CO 0.02 0.36 0.04 0.28 0.00 0.00 0.00 174.94 175.65 1sx4 s THR 50 N 1.12 0.16 -1.16 2.92 -1.32 -0.40 -4.48 115.64 112.48 1sx4 s THR 50 Ca 0.06 -1.35 0.11 0.00 -1.21 0.00 0.00 61.69 59.29 1sx4 s THR 50 Cb -0.14 -1.11 0.21 0.00 -1.51 0.00 0.00 72.50 69.95 1sx4 s THR 50 CO 0.04 -0.75 1.08 1.17 -2.21 0.00 0.00 174.62 173.96 1sx4 n LYS 51 N 0.51 1.85 -3.58 7.08 4.81 -1.26 -0.53 118.16 127.04 1sx4 n LYS 51 Ca -0.17 -1.67 -0.40 0.00 -0.87 0.00 0.00 58.31 55.20 1sx4 n LYS 51 Cb 0.60 -1.25 -0.11 0.00 0.02 0.00 0.00 35.03 34.28 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 -0.98 5.81 0.27 3.14 2.15 -1.26 -4.88 116.67 120.92 1sx4 s ASP 52 Ca 0.19 -0.60 0.00 0.00 0.43 0.00 0.00 52.55 52.57 1sx4 s ASP 52 Cb 0.11 -2.07 0.54 0.00 -0.30 0.00 0.00 42.92 41.20 1sx4 s ASP 52 CO 0.15 -0.26 1.81 1.23 -0.17 0.00 0.00 175.17 177.93 1sx4 h GLY 53 N 8.44 1.53 2.00 2.66 0.00 -1.91 0.23 103.07 116.02 1sx4 h GLY 53 Ca -0.30 -0.36 -0.02 0.00 0.00 0.00 0.00 47.33 46.65 1sx4 h GLY 53 CO 0.64 0.08 -0.11 -0.24 0.00 0.00 0.00 176.54 176.92 1sx4 h VAL 54 N 0.84 0.43 -0.17 4.60 3.04 -1.85 0.35 116.25 123.50 1sx4 h VAL 54 Ca 0.48 -0.56 -0.09 0.00 -1.01 0.00 0.00 66.70 65.51 1sx4 h VAL 54 Cb 0.55 1.39 -0.00 0.00 -2.01 0.00 0.00 31.29 31.22 1sx4 h VAL 54 CO -0.30 0.11 -0.26 0.28 -1.01 0.00 0.00 177.57 176.39 1sx4 h SER 55 N 0.00 0.51 -0.18 3.17 0.02 -1.36 -2.49 113.55 113.22 1sx4 h SER 55 Ca -0.00 -0.53 -0.04 0.00 -0.84 0.00 0.00 61.79 60.38 1sx4 h SER 55 Cb 0.38 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 1sx4 h SER 55 CO 0.01 0.94 -0.04 0.58 -1.14 0.00 0.00 176.83 177.18 1sx4 h VAL 56 N 0.10 1.29 0.68 2.27 2.07 -1.36 -3.24 116.25 118.06 1sx4 h VAL 56 Ca 0.02 -1.01 -0.03 0.00 0.82 0.00 0.00 66.70 66.49 1sx4 h VAL 56 Cb 0.83 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 32.18 1sx4 h VAL 56 CO 0.06 0.30 -0.47 0.00 0.02 0.00 0.00 177.57 177.48 1sx4 h ALA 57 N 0.72 -1.23 -0.64 1.67 0.00 -0.74 -0.35 119.26 118.69 1sx4 h ALA 57 Ca 0.05 -0.22 0.19 0.00 0.00 0.00 0.00 54.91 54.92 1sx4 h ALA 57 Cb 0.48 0.62 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1sx4 h ALA 57 CO 0.02 -1.20 1.09 0.54 0.00 0.00 0.00 179.25 179.69 1sx4 n ARG 58 N -5.38 0.02 0.15 0.00 5.12 -0.96 -0.09 116.66 115.52 1sx4 n ARG 58 Ca -0.13 0.95 0.13 0.00 -1.93 0.00 0.00 57.85 56.86 1sx4 n ARG 58 Cb 0.47 -2.42 0.29 0.00 -1.16 0.00 0.00 32.46 29.64 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 -5.99 5.56 4.39 -1.08 -3.46 114.58 114.00 1sx4 h GLU 59 Ca 0.30 0.00 -0.58 0.00 0.34 0.00 0.00 59.36 59.42 1sx4 h GLU 59 Cb 2.48 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 31.06 1sx4 h GLU 59 CO -0.00 0.00 0.63 0.42 -1.16 0.00 0.00 179.01 178.89 1sx4 s ILE 60 N -3.15 4.76 -0.00 3.13 -1.09 0.87 -4.99 121.20 120.73 1sx4 s ILE 60 Ca 0.09 1.84 -0.00 0.00 -2.23 0.00 0.00 60.65 60.34 1sx4 s ILE 60 Cb 0.09 -4.23 0.00 0.00 -1.58 0.00 0.00 42.46 36.75 1sx4 s ILE 60 CO 0.64 -0.10 0.01 -0.70 -1.23 0.00 0.00 174.94 173.55 1sx4 s GLU 61 N 2.85 0.00 0.33 2.79 2.12 -1.26 -4.85 118.70 120.68 1sx4 s GLU 61 Ca 0.41 0.02 0.10 0.00 0.36 0.00 0.00 54.97 55.85 1sx4 s GLU 61 Cb -0.16 -0.01 -0.06 0.00 0.26 0.00 0.00 34.13 34.17 1sx4 s GLU 61 CO 0.08 -0.01 -0.09 -0.51 -0.54 0.00 0.00 175.26 174.19 1sx4 s LEU 62 N 0.06 2.77 -0.07 2.70 1.02 -1.26 -5.04 118.68 118.86 1sx4 s LEU 62 Ca -0.00 -1.09 0.06 0.00 0.02 0.00 0.00 54.13 53.12 1sx4 s LEU 62 Cb -0.01 -1.13 -0.24 0.00 0.02 0.00 0.00 46.19 44.83 1sx4 s LEU 62 CO -0.00 -0.15 0.55 1.21 0.02 0.00 0.00 176.35 177.98 1sx4 n GLU 63 N -0.79 0.68 -1.97 1.70 2.13 -1.26 -4.61 120.64 116.51 1sx4 n GLU 63 Ca -0.05 0.28 -0.43 0.00 0.66 0.00 0.00 57.16 57.63 1sx4 n GLU 63 Cb 0.62 -1.76 -0.03 0.00 0.27 0.00 0.00 31.44 30.55 1sx4 n GLU 63 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 1sx4 s ASP 64 N -6.39 6.40 0.50 4.31 2.15 -1.26 -4.88 116.67 117.50 1sx4 s ASP 64 Ca -0.11 2.00 0.34 0.00 0.43 0.00 0.00 52.55 55.21 1sx4 s ASP 64 Cb 0.07 -2.53 1.63 0.00 -0.30 0.00 0.00 42.92 41.80 1sx4 s ASP 64 CO 0.81 -1.18 2.01 0.11 -0.17 0.00 0.00 175.17 176.75 1sx4 h LYS 65 N 10.70 0.00 0.12 4.34 1.79 -1.92 0.46 116.57 132.06 1sx4 h LYS 65 Ca -0.38 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 57.75 1sx4 h LYS 65 Cb 1.18 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.82 1sx4 h LYS 65 CO 0.97 0.00 -1.79 0.74 -1.08 0.00 0.00 179.45 178.29 1sx4 h PHE 66 N 0.00 0.47 -0.32 -1.35 0.04 -1.94 -2.80 116.94 111.04 1sx4 h PHE 66 Ca 0.00 -0.34 -0.08 0.00 2.80 0.00 0.00 57.97 60.35 1sx4 h PHE 66 Cb 0.22 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.34 1sx4 h PHE 66 CO 0.00 1.56 -0.11 0.93 -0.60 0.00 0.00 178.31 180.09 1sx4 h GLU 67 N 0.07 0.63 -0.41 1.51 5.08 -1.16 -2.18 114.58 118.12 1sx4 h GLU 67 Ca -0.34 -0.26 0.09 0.00 -1.00 0.00 0.00 59.36 57.85 1sx4 h GLU 67 Cb 2.04 -0.03 -0.09 0.00 0.50 0.00 0.00 28.75 31.18 1sx4 h GLU 67 CO 0.13 0.83 -0.16 -0.97 -1.00 0.00 0.00 179.01 177.84 1sx4 h ASN 68 N 0.40 -0.56 -0.82 1.42 -1.24 -0.28 -1.28 115.58 113.23 1sx4 h ASN 68 Ca 0.08 0.14 0.20 0.00 0.71 0.00 0.00 56.30 57.43 1sx4 h ASN 68 Cb 0.62 0.32 -0.12 0.00 0.73 0.00 0.00 38.32 39.87 1sx4 h ASN 68 CO 0.04 -0.19 0.25 0.24 -1.29 0.00 0.00 177.43 176.48 1sx4 h MET 69 N -0.07 0.29 -0.46 6.67 2.86 -1.14 0.76 114.93 123.84 1sx4 h MET 69 Ca 0.20 -0.02 0.08 0.00 -2.06 0.00 0.00 59.70 57.91 1sx4 h MET 69 Cb 0.38 -0.06 -0.07 0.00 0.06 0.00 0.00 31.60 31.91 1sx4 h MET 69 CO -0.47 0.19 0.04 0.78 1.06 0.00 0.00 176.91 178.51 1sx4 h GLY 70 N 0.30 0.51 2.00 8.32 0.00 -0.66 -2.32 103.07 111.21 1sx4 h GLY 70 Ca 0.49 0.02 -0.14 0.00 0.00 0.00 0.00 47.33 47.70 1sx4 h GLY 70 CO -0.55 -0.10 -0.66 0.00 0.00 0.00 0.00 176.54 175.23 1sx4 h ALA 71 N 1.39 0.65 0.00 3.60 0.00 0.89 -2.28 119.26 123.50 1sx4 h ALA 71 Ca 0.23 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1sx4 h ALA 71 Cb 0.32 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1sx4 h ALA 71 CO -0.35 0.83 -0.23 1.04 0.00 0.00 0.00 179.25 180.54 1sx4 n GLN 72 N -3.38 0.14 -0.07 0.00 1.13 0.97 -1.92 117.38 114.24 1sx4 n GLN 72 Ca 0.01 0.08 -0.08 0.00 -1.94 0.00 0.00 57.00 55.06 1sx4 n GLN 72 Cb 0.76 -1.63 -0.04 0.00 0.11 0.00 0.00 30.24 29.44 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 -0.62 -1.09 2.86 -0.86 -3.36 114.93 111.86 1sx4 h MET 73 Ca 0.00 0.00 0.14 0.00 -2.06 0.00 0.00 59.70 57.78 1sx4 h MET 73 Cb 0.62 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.25 1sx4 h MET 73 CO 0.00 0.27 0.43 -0.39 1.06 0.00 0.00 176.91 178.28 1sx4 h VAL 74 N -1.00 0.78 -0.24 -2.22 -1.51 -1.55 0.18 116.25 110.69 1sx4 h VAL 74 Ca -0.08 -0.07 0.07 0.00 -1.23 0.00 0.00 66.70 65.39 1sx4 h VAL 74 Cb 0.63 0.55 -0.01 0.00 -2.13 0.00 0.00 31.29 30.32 1sx4 h VAL 74 CO -0.05 0.04 0.46 0.50 -1.23 0.00 0.00 177.57 177.30 1sx4 h LYS 75 N 0.22 0.00 0.00 5.19 3.64 -1.53 0.17 116.57 124.26 1sx4 h LYS 75 Ca 0.30 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 1sx4 h LYS 75 Cb 0.88 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.70 1sx4 h LYS 75 CO -0.06 0.00 0.00 -1.91 -2.27 0.00 0.00 179.45 175.21 1sx4 n GLU 76 N -3.27 0.21 0.02 1.90 2.13 0.05 -1.57 120.64 120.11 1sx4 n GLU 76 Ca 0.04 0.19 -0.18 0.00 0.66 0.00 0.00 57.16 57.86 1sx4 n GLU 76 Cb 0.58 -1.75 -0.12 0.00 0.27 0.00 0.00 31.44 30.43 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 1.43 -0.31 6.31 -1.51 -0.82 -0.31 116.25 121.04 1sx4 h VAL 77 Ca 0.00 -2.20 -0.06 0.00 -1.23 0.00 0.00 66.70 63.20 1sx4 h VAL 77 Cb 0.66 2.72 -0.02 0.00 -2.13 0.00 0.00 31.29 32.53 1sx4 h VAL 77 CO 0.00 0.64 -0.08 0.00 -1.23 0.00 0.00 177.57 176.91 1sx4 h ALA 78 N 0.27 1.29 -0.25 5.19 0.00 -1.52 0.21 119.26 124.45 1sx4 h ALA 78 Ca -0.10 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.44 1sx4 h ALA 78 Cb 1.43 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 1sx4 h ALA 78 CO 0.14 0.47 -0.33 1.03 0.00 0.00 0.00 179.25 180.56 1sx4 h SER 79 N 0.48 0.72 0.09 0.00 0.87 -1.07 -3.09 113.55 111.55 1sx4 h SER 79 Ca 0.09 -0.50 -0.00 0.00 -1.23 0.00 0.00 61.79 60.15 1sx4 h SER 79 Cb 0.43 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.19 1sx4 h SER 79 CO 0.02 1.08 -0.04 0.11 -0.53 0.00 0.00 176.83 177.47 1sx4 h LYS 80 N 0.38 -0.12 -0.82 2.24 1.79 -0.81 -1.99 116.57 117.24 1sx4 h LYS 80 Ca 0.03 0.01 0.27 0.00 -2.18 0.00 0.00 60.65 58.78 1sx4 h LYS 80 Cb 0.91 0.03 -0.15 0.00 -1.58 0.00 0.00 32.23 31.44 1sx4 h LYS 80 CO 0.08 0.34 0.18 0.00 -1.08 0.00 0.00 179.45 178.97 1sx4 n ALA 81 N -2.42 0.58 0.05 3.86 0.00 0.04 -1.15 120.51 121.47 1sx4 n ALA 81 Ca -0.08 0.87 -0.07 0.00 0.00 0.00 0.00 53.44 54.15 1sx4 n ALA 81 Cb 0.26 -0.72 -0.12 0.00 0.00 0.00 0.00 19.45 18.87 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 0.01 1.47 0.00 -0.73 -1.29 -2.05 115.58 112.99 1sx4 h ASN 82 Ca 0.57 -0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.74 1sx4 h ASN 82 Cb 1.33 -0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.92 1sx4 h ASN 82 CO -0.72 1.00 0.00 0.44 -0.37 0.00 0.00 177.43 177.78 1sx4 h ASP 83 N 0.00 0.00 0.07 1.15 3.32 -0.67 0.71 116.42 120.99 1sx4 h ASP 83 Ca -0.06 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.73 1sx4 h ASP 83 Cb 1.81 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.35 1sx4 h ASP 83 CO 0.12 0.00 -1.40 0.00 -1.72 0.00 0.00 179.24 176.24 1sx4 h ALA 84 N 2.16 0.25 0.00 3.45 0.00 -1.13 -3.43 119.26 120.57 1sx4 h ALA 84 Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 54.91 53.74 1sx4 h ALA 84 Cb 0.73 0.60 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1sx4 h ALA 84 CO 0.00 0.83 -0.23 0.00 0.00 0.00 0.00 179.25 179.86 1sx4 n ALA 85 N -3.13 1.67 -4.24 0.00 0.00 -0.79 -5.01 120.51 109.01 1sx4 n ALA 85 Ca -0.28 -0.99 -0.38 0.00 0.00 0.00 0.00 53.44 51.78 1sx4 n ALA 85 Cb 0.82 -0.27 -0.07 0.00 0.00 0.00 0.00 19.45 19.94 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 -0.19 -0.35 3.59 0.00 0.00 0.24 -4.29 105.19 104.18 1sx4 n GLY 86 Ca 0.02 0.07 -0.04 0.00 0.00 0.00 0.00 46.02 46.06 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 -3.06 -0.17 0.00 1.61 -1.08 -1.26 -4.68 116.67 108.02 1sx4 s ASP 87 Ca 0.73 -0.04 0.00 0.00 -0.52 0.00 0.00 52.55 52.72 1sx4 s ASP 87 Cb -0.43 0.21 0.00 0.00 -1.46 0.00 0.00 42.92 41.24 1sx4 s ASP 87 CO 0.93 -0.34 0.00 0.61 0.52 0.00 0.00 175.17 176.88 1sx4 n GLY 88 N -0.19 0.79 0.37 2.66 0.00 -1.26 -4.71 105.19 102.85 1sx4 n GLY 88 Ca -0.03 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.16 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 0.62 -0.13 2.61 1.35 -1.89 0.21 112.91 115.69 1sx4 h THR 89 Ca 0.00 -0.21 -0.08 0.00 -0.55 0.00 0.00 66.41 65.57 1sx4 h THR 89 Cb 0.00 -0.03 -0.00 0.00 -1.73 0.00 0.00 68.15 66.39 1sx4 h THR 89 CO 0.00 0.11 -0.23 0.74 -0.25 0.00 0.00 175.52 175.89 1sx4 h THR 90 N 0.60 1.37 -0.21 6.82 2.02 -1.91 -1.60 112.91 119.99 1sx4 h THR 90 Ca 0.59 -1.47 0.05 0.00 0.77 0.00 0.00 66.41 66.34 1sx4 h THR 90 Cb 1.14 2.00 -0.07 0.00 -1.74 0.00 0.00 68.15 69.48 1sx4 h THR 90 CO -0.36 0.43 -0.47 0.74 0.37 0.00 0.00 175.52 176.23 1sx4 h THR 91 N -0.01 0.08 -0.55 3.16 2.02 -1.73 0.49 112.91 116.37 1sx4 h THR 91 Ca 0.01 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.25 1sx4 h THR 91 Cb 0.80 0.08 -0.09 0.00 -1.74 0.00 0.00 68.15 67.21 1sx4 h THR 91 CO 0.05 0.00 -0.51 0.00 0.37 0.00 0.00 175.52 175.43 1sx4 h ALA 92 N 0.05 -0.66 -0.59 6.16 0.00 -0.60 0.41 119.26 124.04 1sx4 h ALA 92 Ca 0.08 0.04 0.12 0.00 0.00 0.00 0.00 54.91 55.14 1sx4 h ALA 92 Cb 0.64 1.18 -0.10 0.00 0.00 0.00 0.00 17.79 19.50 1sx4 h ALA 92 CO -0.46 -0.95 -0.05 1.15 0.00 0.00 0.00 179.25 178.94 1sx4 h THR 93 N -0.24 0.48 -0.69 0.00 2.02 -0.03 0.56 112.91 115.01 1sx4 h THR 93 Ca 0.09 -0.02 0.03 0.00 0.77 0.00 0.00 66.41 67.28 1sx4 h THR 93 Cb 0.48 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 67.25 1sx4 h THR 93 CO -0.65 0.01 0.43 0.58 0.37 0.00 0.00 175.52 176.27 1sx4 h VAL 94 N 0.07 1.09 -0.13 3.16 2.07 0.78 0.21 116.25 123.50 1sx4 h VAL 94 Ca 0.30 -0.29 -0.08 0.00 0.82 0.00 0.00 66.70 67.45 1sx4 h VAL 94 Cb 0.47 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1sx4 h VAL 94 CO -0.54 0.15 -0.30 -0.07 0.02 0.00 0.00 177.57 176.84 1sx4 h LEU 95 N 0.84 0.25 0.07 2.57 3.38 0.44 -2.58 115.31 120.28 1sx4 h LEU 95 Ca 0.28 -0.08 -0.21 0.00 0.09 0.00 0.00 57.88 57.96 1sx4 h LEU 95 Cb 0.03 -0.07 0.02 0.00 0.09 0.00 0.00 40.66 40.73 1sx4 h LEU 95 CO -0.11 0.55 -0.84 0.00 0.09 0.00 0.00 178.44 178.12 1sx4 h ALA 96 N 1.47 0.01 -0.13 1.53 0.00 -0.33 0.09 119.26 121.90 1sx4 h ALA 96 Ca 0.03 -0.66 0.04 0.00 0.00 0.00 0.00 54.91 54.32 1sx4 h ALA 96 Cb 0.64 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1sx4 h ALA 96 CO 0.05 0.46 0.38 0.37 0.00 0.00 0.00 179.25 180.50 1sx4 h GLN 97 N -0.05 0.00 0.00 0.00 5.75 -0.90 -1.07 115.11 118.84 1sx4 h GLN 97 Ca -0.12 0.00 -0.07 0.00 -0.15 0.00 0.00 58.65 58.30 1sx4 h GLN 97 Cb 1.57 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 30.11 1sx4 h GLN 97 CO 0.16 0.00 -0.62 0.00 -2.65 0.00 0.00 178.83 175.73 1sx4 h ALA 98 N 1.37 0.09 -0.69 3.38 0.00 -0.95 -2.17 119.26 120.28 1sx4 h ALA 98 Ca 0.06 -0.66 0.09 0.00 0.00 0.00 0.00 54.91 54.40 1sx4 h ALA 98 Cb 0.82 0.45 -0.07 0.00 0.00 0.00 0.00 17.79 18.99 1sx4 h ALA 98 CO -0.00 0.44 0.35 0.82 0.00 0.00 0.00 179.25 180.86 1sx4 h ILE 99 N -1.00 0.87 0.46 0.00 2.04 -0.25 -2.04 117.51 117.59 1sx4 h ILE 99 Ca -0.11 -0.21 -0.02 0.00 1.00 0.00 0.00 64.86 65.52 1sx4 h ILE 99 Cb 0.74 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 37.03 1sx4 h ILE 99 CO -0.07 0.11 -0.22 0.40 0.00 0.00 0.00 178.15 178.37 1sx4 h ILE 100 N 0.61 0.55 -0.06 -0.67 2.04 -1.35 0.18 117.51 118.81 1sx4 h ILE 100 Ca 0.34 -0.04 0.04 0.00 1.00 0.00 0.00 64.86 66.20 1sx4 h ILE 100 Cb 0.33 0.56 -0.06 0.00 -0.74 0.00 0.00 36.82 36.91 1sx4 h ILE 100 CO -0.25 0.01 -0.33 0.74 0.00 0.00 0.00 178.15 178.32 1sx4 h THR 101 N -0.64 0.28 -0.41 -0.27 2.02 -0.93 0.35 112.91 113.30 1sx4 h THR 101 Ca -0.06 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.06 1sx4 h THR 101 Cb 0.49 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 67.16 1sx4 h THR 101 CO 0.10 0.00 0.04 -0.33 0.37 0.00 0.00 175.52 175.71 1sx4 h GLU 102 N -0.45 0.70 0.05 6.66 4.39 -1.35 -2.85 114.58 121.73 1sx4 h GLU 102 Ca 0.08 -0.20 -0.00 0.00 0.34 0.00 0.00 59.36 59.57 1sx4 h GLU 102 Cb 0.56 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 29.14 1sx4 h GLU 102 CO -0.31 0.76 -0.03 0.78 -1.16 0.00 0.00 179.01 179.04 1sx4 h GLY 103 N 0.54 -0.08 1.39 -3.84 0.00 0.13 -1.50 103.07 99.71 1sx4 h GLY 103 Ca 0.12 0.04 0.07 0.00 0.00 0.00 0.00 47.33 47.56 1sx4 h GLY 103 CO 0.01 -0.04 0.24 1.41 0.00 0.00 0.00 176.54 178.16 1sx4 h LEU 104 N -0.09 0.00 -0.83 3.11 3.38 -0.92 0.39 115.31 120.35 1sx4 h LEU 104 Ca -0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 1sx4 h LEU 104 Cb 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1sx4 h LEU 104 CO 0.00 0.00 -0.58 0.50 0.09 0.00 0.00 178.44 178.45 1sx4 h LYS 105 N 0.00 0.00 0.00 1.13 3.64 -1.05 -0.60 116.57 119.68 1sx4 h LYS 105 Ca 0.12 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1sx4 h LYS 105 Cb 0.59 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 1sx4 h LYS 105 CO -0.00 0.58 -0.40 0.00 -2.27 0.00 0.00 179.45 177.36 1sx4 n ALA 106 N -2.43 3.16 0.10 5.00 0.00 0.07 -1.95 120.51 124.46 1sx4 n ALA 106 Ca -0.01 -0.27 -0.23 0.00 0.00 0.00 0.00 53.44 52.93 1sx4 n ALA 106 Cb 0.59 -1.21 -0.15 0.00 0.00 0.00 0.00 19.45 18.67 1sx4 n ALA 106 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1sx4 h VAL 107 N 0.00 1.11 0.00 0.00 2.07 -0.74 -2.51 116.25 116.18 1sx4 h VAL 107 Ca 0.00 -2.64 -0.02 0.00 0.82 0.00 0.00 66.70 64.86 1sx4 h VAL 107 Cb 0.55 2.88 -0.00 0.00 -1.52 0.00 0.00 31.29 33.19 1sx4 h VAL 107 CO 0.00 0.84 -0.08 0.00 0.02 0.00 0.00 177.57 178.35 1sx4 h ALA 108 N 0.20 1.25 0.00 1.67 0.00 -1.06 0.11 119.26 121.42 1sx4 h ALA 108 Ca -0.29 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 1sx4 h ALA 108 Cb 2.11 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.89 1sx4 h ALA 108 CO 0.21 0.10 -0.01 0.00 0.00 0.00 0.00 179.25 179.55 1sx4 h ALA 109 N 1.92 1.04 0.00 0.00 0.00 -1.26 -3.46 119.26 117.49 1sx4 h ALA 109 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1sx4 h ALA 109 Cb 0.28 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1sx4 h ALA 109 CO 0.01 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.69 1sx4 n GLY 110 N -0.56 1.05 3.78 0.00 0.00 0.38 -5.09 105.19 104.74 1sx4 n GLY 110 Ca -0.01 0.00 -0.36 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 -0.01 3.79 -0.48 1.61 -1.94 -0.96 -4.99 119.30 116.32 1sx4 s MET 111 Ca 0.00 1.57 -0.28 0.00 -1.71 0.00 0.00 55.69 55.27 1sx4 s MET 111 Cb 0.00 -2.28 -0.00 0.00 2.01 0.00 0.00 34.83 34.56 1sx4 s MET 111 CO 0.00 -0.48 1.63 1.21 -0.01 0.00 0.00 175.02 177.37 1sx4 s ASN 112 N -1.65 5.89 0.43 3.03 2.47 -1.26 -4.63 114.94 119.21 1sx4 s ASN 112 Ca 0.65 0.68 0.10 0.00 0.42 0.00 0.00 52.86 54.71 1sx4 s ASN 112 Cb -0.23 -2.54 0.95 0.00 -1.45 0.00 0.00 41.25 37.99 1sx4 s ASN 112 CO 0.28 -1.82 2.04 -0.65 -3.72 0.00 0.00 177.10 173.22 1sx4 h PRO 113 N 12.45 0.45 -0.32 0.43 0.11 -1.94 0.39 132.00 143.57 1sx4 h PRO 113 Ca -0.29 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 65.82 1sx4 h PRO 113 Cb 1.13 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 1sx4 h PRO 113 CO 1.13 0.30 0.22 0.52 -0.21 0.00 0.00 178.00 179.95 1sx4 h MET 114 N 0.46 0.33 -0.02 1.05 2.86 -1.93 -0.69 114.93 117.00 1sx4 h MET 114 Ca 0.19 -0.02 -0.16 0.00 -2.06 0.00 0.00 59.70 57.65 1sx4 h MET 114 Cb 0.17 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.74 1sx4 h MET 114 CO -0.05 0.22 -0.72 -0.44 1.06 0.00 0.00 176.91 176.98 1sx4 h ASP 115 N 0.34 0.12 -0.58 1.22 3.32 -0.63 -2.66 116.42 117.55 1sx4 h ASP 115 Ca 0.13 -0.08 -0.06 0.00 0.02 0.00 0.00 57.03 57.04 1sx4 h ASP 115 Cb 0.10 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.59 1sx4 h ASP 115 CO -0.03 0.79 0.14 -0.07 -1.72 0.00 0.00 179.24 178.35 1sx4 h LEU 116 N 0.06 0.92 0.23 1.55 3.38 -0.83 -0.59 115.31 120.04 1sx4 h LEU 116 Ca -0.01 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 1sx4 h LEU 116 Cb 1.27 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1sx4 h LEU 116 CO 0.10 0.90 -0.11 0.50 0.09 0.00 0.00 178.44 179.92 1sx4 h LYS 117 N 0.93 -0.30 -0.94 1.13 3.64 -1.08 -1.56 116.57 118.39 1sx4 h LYS 117 Ca 0.20 0.02 0.21 0.00 -1.27 0.00 0.00 60.65 59.81 1sx4 h LYS 117 Cb 0.35 0.07 -0.12 0.00 -0.41 0.00 0.00 32.23 32.12 1sx4 h LYS 117 CO 0.00 -0.06 0.51 0.00 -2.27 0.00 0.00 179.45 177.63 1sx4 h ARG 118 N -0.51 0.55 0.05 1.90 3.08 -1.09 0.34 114.38 118.70 1sx4 h ARG 118 Ca -0.03 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 1sx4 h ARG 118 Cb 0.38 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.31 1sx4 h ARG 118 CO 0.05 0.36 -0.02 0.78 -1.07 0.00 0.00 179.97 180.07 1sx4 h GLY 119 N 0.56 -0.07 -0.13 0.04 0.00 -0.96 0.32 103.07 102.83 1sx4 h GLY 119 Ca 0.57 0.03 0.11 0.00 0.00 0.00 0.00 47.33 48.04 1sx4 h GLY 119 CO -0.46 -0.03 -0.14 -2.22 0.00 0.00 0.00 176.54 173.70 1sx4 h ILE 120 N -0.51 0.44 -0.31 2.60 2.04 -0.75 0.20 117.51 121.21 1sx4 h ILE 120 Ca -0.01 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.76 1sx4 h ILE 120 Cb 0.46 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 1sx4 h ILE 120 CO 0.01 0.00 -0.17 0.44 0.00 0.00 0.00 178.15 178.43 1sx4 h ASP 121 N -0.00 0.69 -0.02 1.72 3.32 0.12 -0.99 116.42 121.25 1sx4 h ASP 121 Ca 0.27 -0.42 0.03 0.00 0.02 0.00 0.00 57.03 56.93 1sx4 h ASP 121 Cb 0.41 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 39.73 1sx4 h ASP 121 CO -0.58 0.96 -0.22 0.50 -1.72 0.00 0.00 179.24 178.18 1sx4 h LYS 122 N 0.42 -0.32 -0.97 3.56 3.64 0.17 0.13 116.57 123.20 1sx4 h LYS 122 Ca 0.07 0.02 0.24 0.00 -1.27 0.00 0.00 60.65 59.71 1sx4 h LYS 122 Cb 0.71 0.07 -0.18 0.00 -0.41 0.00 0.00 32.23 32.42 1sx4 h LYS 122 CO 0.05 -0.22 -0.05 0.00 -2.27 0.00 0.00 179.45 176.96 1sx4 h ALA 123 N 0.55 0.99 -0.18 5.00 0.00 -0.40 -1.66 119.26 123.55 1sx4 h ALA 123 Ca 0.07 0.34 -0.20 0.00 0.00 0.00 0.00 54.91 55.12 1sx4 h ALA 123 Cb 0.42 0.62 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1sx4 h ALA 123 CO -0.21 -0.51 -0.68 0.28 0.00 0.00 0.00 179.25 178.13 1sx4 h VAL 124 N 0.01 1.30 -0.13 0.00 2.07 0.56 -0.87 116.25 119.19 1sx4 h VAL 124 Ca 0.55 -1.91 -0.03 0.00 0.82 0.00 0.00 66.70 66.13 1sx4 h VAL 124 Cb 1.04 1.88 -0.01 0.00 -1.52 0.00 0.00 31.29 32.68 1sx4 h VAL 124 CO -0.93 0.60 -0.04 0.74 0.02 0.00 0.00 177.57 177.97 1sx4 h THR 125 N 0.53 1.11 0.16 2.57 2.02 -0.29 0.17 112.91 119.17 1sx4 h THR 125 Ca -0.02 -0.46 -0.01 0.00 0.77 0.00 0.00 66.41 66.69 1sx4 h THR 125 Cb 1.29 1.06 0.00 0.00 -1.74 0.00 0.00 68.15 68.76 1sx4 h THR 125 CO 0.14 0.15 -0.08 0.00 0.37 0.00 0.00 175.52 176.10 1sx4 h ALA 126 N 1.78 -0.21 -1.00 6.16 0.00 -1.13 -3.08 119.26 121.77 1sx4 h ALA 126 Ca 0.04 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.79 1sx4 h ALA 126 Cb 0.20 0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 1sx4 h ALA 126 CO 0.01 -0.37 0.65 0.00 0.00 0.00 0.00 179.25 179.54 1sx4 h ALA 127 N -0.03 1.38 -0.45 0.00 0.00 -0.17 -0.98 119.26 119.01 1sx4 h ALA 127 Ca -0.02 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.89 1sx4 h ALA 127 Cb 0.51 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1sx4 h ALA 127 CO 0.04 0.49 0.23 0.28 0.00 0.00 0.00 179.25 180.29 1sx4 h VAL 128 N 1.22 0.97 0.06 0.00 2.07 -0.73 -1.07 116.25 118.77 1sx4 h VAL 128 Ca 0.42 -0.16 0.02 0.00 0.82 0.00 0.00 66.70 67.80 1sx4 h VAL 128 Cb 0.09 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 1sx4 h VAL 128 CO -0.15 0.08 -0.16 -0.33 0.02 0.00 0.00 177.57 177.03 1sx4 h GLU 129 N 0.45 -0.29 -0.54 1.57 3.07 -1.28 -0.04 114.58 117.53 1sx4 h GLU 129 Ca 0.20 0.02 0.10 0.00 -0.50 0.00 0.00 59.36 59.18 1sx4 h GLU 129 Cb 0.10 0.07 -0.11 0.00 -0.84 0.00 0.00 28.75 27.97 1sx4 h GLU 129 CO -0.14 -0.19 -0.31 0.93 -1.40 0.00 0.00 179.01 177.90 1sx4 h GLU 130 N -0.30 -0.16 -0.67 2.33 4.39 -0.78 0.30 114.58 119.69 1sx4 h GLU 130 Ca 0.03 0.01 0.09 0.00 0.34 0.00 0.00 59.36 59.83 1sx4 h GLU 130 Cb 0.34 0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 28.96 1sx4 h GLU 130 CO -0.11 -0.11 0.33 -0.07 -1.16 0.00 0.00 179.01 177.89 1sx4 h LEU 131 N -0.17 0.42 -2.15 1.33 3.38 -0.93 -1.14 115.31 116.05 1sx4 h LEU 131 Ca 0.22 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 1sx4 h LEU 131 Cb 0.53 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 1sx4 h LEU 131 CO -0.63 0.25 -0.07 0.11 0.09 0.00 0.00 178.44 178.19 1sx4 h LYS 132 N 0.57 0.00 -0.15 1.13 1.57 0.15 -1.07 116.57 118.77 1sx4 h LYS 132 Ca 0.33 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.88 1sx4 h LYS 132 Cb 0.33 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.65 1sx4 h LYS 132 CO -0.26 0.07 -0.79 0.00 -0.57 0.00 0.00 179.45 177.91 1sx4 h ALA 133 N 1.93 0.30 0.00 3.86 0.00 0.06 -3.28 119.26 122.13 1sx4 h ALA 133 Ca -0.00 -0.60 -0.11 0.00 0.00 0.00 0.00 54.91 54.19 1sx4 h ALA 133 Cb 0.22 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1sx4 h ALA 133 CO 0.01 0.68 -0.54 -0.07 0.00 0.00 0.00 179.25 179.33 1sx4 h LEU 134 N 0.54 0.00 -9.65 0.00 4.07 -0.30 -3.45 115.31 106.53 1sx4 h LEU 134 Ca -0.06 0.00 -0.57 0.00 0.08 0.00 0.00 57.88 57.34 1sx4 h LEU 134 Cb 1.42 0.00 0.08 0.00 1.08 0.00 0.00 40.66 43.24 1sx4 h LEU 134 CO 0.16 0.54 0.69 -0.24 -1.08 0.00 0.00 178.44 178.51 1sx4 n SER 135 N -3.42 3.06 -4.30 -0.43 2.88 -0.50 -4.80 113.62 106.10 1sx4 n SER 135 Ca 0.00 1.14 -0.27 0.00 -1.33 0.00 0.00 58.87 58.42 1sx4 n SER 135 Cb 0.67 -1.48 -0.14 0.00 -0.75 0.00 0.00 64.21 62.52 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 -0.07 1.88 0.47 2.46 -7.23 -0.98 -4.92 120.40 112.00 1sx4 s VAL 136 Ca 0.67 -1.42 -0.25 0.00 -1.81 0.00 0.00 61.98 59.17 1sx4 s VAL 136 Cb -0.60 -1.65 -0.08 0.00 0.56 0.00 0.00 36.38 34.61 1sx4 s VAL 136 CO 0.50 0.15 1.43 -2.84 -0.31 0.00 0.00 175.10 174.03 1sx4 s PRO 137 N -1.53 3.58 -0.29 4.82 0.02 -1.26 -1.61 135.00 138.73 1sx4 s PRO 137 Ca 0.09 2.42 0.01 0.00 0.02 0.00 0.00 61.00 63.55 1sx4 s PRO 137 Cb -0.10 -2.59 0.06 0.00 0.02 0.00 0.00 34.50 31.90 1sx4 s PRO 137 CO 0.03 -0.90 -0.04 0.00 -0.33 0.00 0.00 177.00 175.76 1sx4 n SER 139 N 4.47 0.00 -4.92 0.00 3.41 -1.26 -4.46 113.62 110.87 1sx4 n SER 139 Ca -0.11 -0.25 -0.27 0.00 -0.26 0.00 0.00 58.87 57.98 1sx4 n SER 139 Cb 0.42 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.43 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 0.00 5.10 0.38 4.04 1.47 -1.26 -4.97 116.67 121.42 1sx4 s ASP 140 Ca 0.00 0.62 0.15 0.00 1.18 0.00 0.00 52.55 54.50 1sx4 s ASP 140 Cb 0.00 -1.38 0.75 0.00 -0.34 0.00 0.00 42.92 41.95 1sx4 s ASP 140 CO 0.00 -1.43 1.81 0.28 0.68 0.00 0.00 175.17 176.51 1sx4 h SER 141 N -0.50 0.00 -0.23 2.11 0.02 -1.98 -3.04 113.55 109.93 1sx4 h SER 141 Ca -0.45 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.48 1sx4 h SER 141 Cb 1.29 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.82 1sx4 h SER 141 CO 0.61 0.38 0.05 0.50 -1.14 0.00 0.00 176.83 177.23 1sx4 h LYS 142 N 0.00 0.38 0.01 3.45 3.64 -1.99 -1.98 116.57 120.07 1sx4 h LYS 142 Ca -0.00 -0.10 -0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1sx4 h LYS 142 Cb 0.72 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 1sx4 h LYS 142 CO 0.05 0.50 -0.00 0.00 -2.27 0.00 0.00 179.45 177.72 1sx4 h ALA 143 N 0.86 -0.01 -0.80 5.00 0.00 -1.96 -2.11 119.26 120.24 1sx4 h ALA 143 Ca 0.07 -0.19 0.13 0.00 0.00 0.00 0.00 54.91 54.92 1sx4 h ALA 143 Cb 0.30 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 17.95 1sx4 h ALA 143 CO 0.00 -0.31 -0.35 0.82 0.00 0.00 0.00 179.25 179.40 1sx4 h ILE 144 N -0.39 0.09 -0.81 0.00 2.04 -1.56 0.29 117.51 117.17 1sx4 h ILE 144 Ca -0.00 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.96 1sx4 h ILE 144 Cb 0.38 0.09 -0.06 0.00 -0.74 0.00 0.00 36.82 36.49 1sx4 h ILE 144 CO 0.00 0.00 0.53 0.00 0.00 0.00 0.00 178.15 178.68 1sx4 h ALA 145 N 1.23 1.77 -0.03 1.87 0.00 -1.03 0.12 119.26 123.21 1sx4 h ALA 145 Ca 0.30 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 55.07 1sx4 h ALA 145 Cb 0.58 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1sx4 h ALA 145 CO -0.84 0.05 -0.62 1.96 0.00 0.00 0.00 179.25 179.80 1sx4 h GLN 146 N 0.72 0.10 -0.02 0.00 4.20 -0.09 0.39 115.11 120.41 1sx4 h GLN 146 Ca 0.38 -0.07 -0.04 0.00 0.06 0.00 0.00 58.65 58.98 1sx4 h GLN 146 Cb 0.49 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.28 1sx4 h GLN 146 CO -0.15 0.68 -0.15 -0.39 -0.67 0.00 0.00 178.83 178.16 1sx4 h VAL 147 N 0.07 1.53 -0.80 -0.54 -1.51 0.20 -1.93 116.25 113.26 1sx4 h VAL 147 Ca -0.01 -1.75 0.15 0.00 -1.23 0.00 0.00 66.70 63.86 1sx4 h VAL 147 Cb 1.11 2.63 -0.15 0.00 -2.13 0.00 0.00 31.29 32.74 1sx4 h VAL 147 CO 0.09 0.47 -0.25 1.23 -1.23 0.00 0.00 177.57 177.88 1sx4 h GLY 148 N -0.52 0.43 1.01 5.19 0.00 -1.08 -0.62 103.07 107.47 1sx4 h GLY 148 Ca -0.01 0.32 -0.00 0.00 0.00 0.00 0.00 47.33 47.64 1sx4 h GLY 148 CO 0.03 -0.28 0.49 -0.84 0.00 0.00 0.00 176.54 175.94 1sx4 h THR 149 N -0.03 1.22 -0.01 4.70 2.02 -0.06 -1.26 112.91 119.49 1sx4 h THR 149 Ca 0.36 -0.47 -0.18 0.00 0.77 0.00 0.00 66.41 66.89 1sx4 h THR 149 Cb 0.59 0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 1sx4 h THR 149 CO -0.84 0.23 -0.82 -0.29 0.37 0.00 0.00 175.52 174.18 1sx4 h ILE 150 N 1.10 1.49 -0.31 3.11 6.09 -0.36 -2.00 117.51 126.63 1sx4 h ILE 150 Ca 0.29 -2.52 -0.11 0.00 -1.37 0.00 0.00 64.86 61.15 1sx4 h ILE 150 Cb -0.06 2.39 -0.01 0.00 0.47 0.00 0.00 36.82 39.61 1sx4 h ILE 150 CO -0.06 0.73 -0.26 -1.28 -3.07 0.00 0.00 178.15 174.21 1sx4 h SER 151 N 0.10 0.63 -0.48 2.19 0.87 -0.78 -3.16 113.55 112.93 1sx4 h SER 151 Ca -0.03 -0.23 -0.30 0.00 -1.23 0.00 0.00 61.79 60.00 1sx4 h SER 151 Cb 1.42 -0.17 -0.11 0.00 -0.44 0.00 0.00 62.40 63.09 1sx4 h SER 151 CO 0.12 0.88 0.17 0.00 -0.53 0.00 0.00 176.83 177.47 1sx4 n ALA 152 N -2.49 5.63 -3.56 6.23 0.00 -0.52 -4.77 120.51 121.03 1sx4 n ALA 152 Ca -0.00 -1.86 -0.23 0.00 0.00 0.00 0.00 53.44 51.34 1sx4 n ALA 152 Cb 0.44 -1.76 -0.04 0.00 0.00 0.00 0.00 19.45 18.09 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 1.16 -1.87 -0.27 0.00 4.05 -1.19 -2.00 115.26 115.14 1sx4 n ASN 153 Ca 0.34 -0.44 0.00 0.00 0.45 0.00 0.00 54.58 54.93 1sx4 n ASN 153 Cb 0.63 -1.65 0.00 0.00 1.23 0.00 0.00 39.78 39.99 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 -2.07 -1.30 -4.32 1.20 7.64 -0.79 -4.93 113.62 109.05 1sx4 n SER 154 Ca 0.05 0.00 -0.46 0.00 1.01 0.00 0.00 58.87 59.47 1sx4 n SER 154 Cb 0.49 -0.38 -0.04 0.00 -1.01 0.00 0.00 64.21 63.27 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 -2.75 6.37 0.62 6.43 -1.08 -0.85 -4.91 116.67 120.50 1sx4 s ASP 155 Ca 0.00 -2.08 0.34 0.00 -0.52 0.00 0.00 52.55 50.29 1sx4 s ASP 155 Cb 0.00 -2.21 1.95 0.00 -1.46 0.00 0.00 42.92 41.20 1sx4 s ASP 155 CO 0.00 -0.77 2.23 -0.33 0.52 0.00 0.00 175.17 176.82 1sx4 h GLU 156 N 8.53 0.00 0.02 4.34 5.08 -1.91 -1.62 114.58 129.02 1sx4 h GLU 156 Ca -0.17 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 57.96 1sx4 h GLU 156 Cb 1.08 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.30 1sx4 h GLU 156 CO 0.95 0.00 -1.13 1.15 -1.00 0.00 0.00 179.01 178.97 1sx4 h THR 157 N 0.00 1.57 -0.02 1.13 2.02 -1.96 -1.92 112.91 113.73 1sx4 h THR 157 Ca 0.02 -3.28 -0.01 0.00 0.77 0.00 0.00 66.41 63.92 1sx4 h THR 157 Cb 0.18 2.81 -0.00 0.00 -1.74 0.00 0.00 68.15 69.40 1sx4 h THR 157 CO -0.00 0.91 -0.03 0.58 0.37 0.00 0.00 175.52 177.35 1sx4 h VAL 158 N 0.01 1.41 -0.67 3.16 2.07 -1.68 -2.19 116.25 118.35 1sx4 h VAL 158 Ca -0.07 -1.24 0.14 0.00 0.82 0.00 0.00 66.70 66.36 1sx4 h VAL 158 Cb 1.83 2.20 -0.12 0.00 -1.52 0.00 0.00 31.29 33.68 1sx4 h VAL 158 CO 0.14 0.33 -0.06 1.23 0.02 0.00 0.00 177.57 179.22 1sx4 h GLY 159 N -0.45 0.64 1.17 2.17 0.00 -1.42 -0.70 103.07 104.48 1sx4 h GLY 159 Ca 0.00 0.14 -0.15 0.00 0.00 0.00 0.00 47.33 47.33 1sx4 h GLY 159 CO 0.01 -0.25 -0.34 1.70 0.00 0.00 0.00 176.54 177.66 1sx4 h LYS 160 N 0.06 0.92 -0.32 4.80 3.64 -1.28 -1.19 116.57 123.20 1sx4 h LYS 160 Ca 0.35 -0.45 -0.14 0.00 -1.27 0.00 0.00 60.65 59.14 1sx4 h LYS 160 Cb 0.57 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.38 1sx4 h LYS 160 CO -0.63 1.11 -0.33 1.25 -2.27 0.00 0.00 179.45 178.58 1sx4 h LEU 161 N 0.76 0.85 0.27 5.20 5.85 -0.88 0.55 115.31 127.90 1sx4 h LEU 161 Ca 0.07 -0.47 -0.01 0.00 0.84 0.00 0.00 57.88 58.31 1sx4 h LEU 161 Cb 0.92 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.71 1sx4 h LEU 161 CO 0.09 1.15 -0.13 0.40 -0.34 0.00 0.00 178.44 179.60 1sx4 h ILE 162 N 0.57 0.76 -0.54 4.05 2.04 -1.06 -0.46 117.51 122.87 1sx4 h ILE 162 Ca 0.05 -0.20 0.09 0.00 1.00 0.00 0.00 64.86 65.80 1sx4 h ILE 162 Cb 0.91 0.88 -0.07 0.00 -0.74 0.00 0.00 36.82 37.80 1sx4 h ILE 162 CO 0.08 0.04 0.15 0.00 0.00 0.00 0.00 178.15 178.43 1sx4 h ALA 163 N 0.25 0.64 -0.80 1.87 0.00 -1.01 0.44 119.26 120.65 1sx4 h ALA 163 Ca -0.04 0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1sx4 h ALA 163 Cb 0.35 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 1sx4 h ALA 163 CO 0.06 -0.26 0.52 0.93 0.00 0.00 0.00 179.25 180.50 1sx4 h GLU 164 N 0.31 1.06 0.19 0.00 5.08 0.50 -2.58 114.58 119.13 1sx4 h GLU 164 Ca 0.27 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 1sx4 h GLU 164 Cb 0.35 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1sx4 h GLU 164 CO -0.31 0.71 -0.09 0.00 -1.00 0.00 0.00 179.01 178.32 1sx4 h ALA 165 N 1.29 -0.25 -1.19 3.43 0.00 0.09 -2.69 119.26 119.94 1sx4 h ALA 165 Ca 0.29 -0.19 0.37 0.00 0.00 0.00 0.00 54.91 55.38 1sx4 h ALA 165 Cb -0.11 0.10 -0.12 0.00 0.00 0.00 0.00 17.79 17.65 1sx4 h ALA 165 CO -0.06 -0.45 0.76 0.52 0.00 0.00 0.00 179.25 180.02 1sx4 h MET 166 N -0.64 0.20 -0.13 0.00 2.86 -0.89 0.40 114.93 116.74 1sx4 h MET 166 Ca -0.03 -0.01 -0.23 0.00 -2.06 0.00 0.00 59.70 57.37 1sx4 h MET 166 Cb 0.46 -0.04 0.01 0.00 0.06 0.00 0.00 31.60 32.09 1sx4 h MET 166 CO 0.04 0.13 -0.82 0.22 1.06 0.00 0.00 176.91 177.55 1sx4 h ASP 167 N 0.20 0.91 0.08 1.22 3.58 -1.23 -2.98 116.42 118.20 1sx4 h ASP 167 Ca 0.74 -0.61 -0.20 0.00 0.42 0.00 0.00 57.03 57.37 1sx4 h ASP 167 Cb 2.13 -0.27 -0.00 0.00 1.72 0.00 0.00 39.33 42.91 1sx4 h ASP 167 CO -0.40 1.41 -1.01 0.11 -2.88 0.00 0.00 179.24 176.46 1sx4 h LYS 168 N 0.50 0.18 0.00 0.28 1.57 0.09 -3.32 116.57 115.87 1sx4 h LYS 168 Ca -0.06 -0.30 0.00 0.00 -1.87 0.00 0.00 60.65 58.41 1sx4 h LYS 168 Cb 1.45 0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.87 1sx4 h LYS 168 CO 0.17 1.14 0.00 1.33 -0.57 0.00 0.00 179.45 181.52 1sx4 n VAL 169 N -4.16 0.54 -4.01 0.50 0.24 -0.66 -4.57 118.33 106.22 1sx4 n VAL 169 Ca -0.21 0.09 0.00 0.00 -2.04 0.00 0.00 64.34 62.18 1sx4 n VAL 169 Cb 0.78 -0.78 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 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 0.74 -1.47 0.13 7.63 0.00 -1.13 -2.99 105.19 108.09 1sx4 n GLY 170 Ca 0.05 -1.30 0.07 0.00 0.00 0.00 0.00 46.02 44.84 1sx4 n GLY 170 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sx4 h LYS 171 N 0.00 0.00 -0.44 1.61 1.57 -1.93 -3.32 116.57 114.05 1sx4 h LYS 171 Ca 0.00 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.53 1sx4 h LYS 171 Cb 0.00 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 32.16 1sx4 h LYS 171 CO 0.00 0.14 -0.07 0.39 -0.57 0.00 0.00 179.45 179.34 1sx4 n GLU 172 N -2.87 2.02 -4.57 3.15 1.02 -1.26 -5.00 120.64 113.13 1sx4 n GLU 172 Ca -0.02 -3.28 -0.33 0.00 -0.02 0.00 0.00 57.16 53.52 1sx4 n GLU 172 Cb 0.65 -1.89 -0.11 0.00 -0.02 0.00 0.00 31.44 30.07 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 -2.55 1.70 0.34 0.62 0.00 -1.21 -3.52 107.32 102.69 1sx4 s GLY 173 Ca 0.47 -0.99 -0.14 0.00 0.00 0.00 0.00 44.72 44.06 1sx4 s GLY 173 CO 0.00 -0.82 0.74 0.14 0.00 0.00 0.00 173.10 173.17 1sx4 s VAL 174 N -0.90 4.70 -0.07 1.40 1.01 -1.24 -4.90 120.40 120.40 1sx4 s VAL 174 Ca 0.15 0.87 0.01 0.00 0.00 0.00 0.00 61.98 63.01 1sx4 s VAL 174 Cb -0.11 -3.64 0.02 0.00 0.00 0.00 0.00 36.38 32.65 1sx4 s VAL 174 CO 0.05 -0.26 -0.09 -0.63 0.00 0.00 0.00 175.10 174.16 1sx4 s ILE 175 N -2.08 0.96 0.09 2.22 1.01 -1.26 -1.56 121.20 120.58 1sx4 s ILE 175 Ca 0.54 -0.35 0.06 0.00 0.00 0.00 0.00 60.65 60.90 1sx4 s ILE 175 Cb -0.10 -0.92 -0.03 0.00 0.01 0.00 0.00 42.46 41.42 1sx4 s ILE 175 CO 0.21 0.33 -0.16 0.42 0.00 0.00 0.00 174.94 175.73 1sx4 s THR 176 N 0.96 1.29 -0.07 2.92 -4.23 -0.75 -5.01 115.64 110.75 1sx4 s THR 176 Ca -0.10 -1.43 0.01 0.00 -1.18 0.00 0.00 61.69 59.00 1sx4 s THR 176 Cb -0.15 -1.26 -0.03 0.00 1.34 0.00 0.00 72.50 72.40 1sx4 s THR 176 CO 0.00 -0.22 -0.09 0.68 -0.54 0.00 0.00 174.62 174.46 1sx4 s VAL 177 N -1.39 3.53 0.19 2.29 -7.23 -1.26 0.03 120.40 116.56 1sx4 s VAL 177 Ca 0.02 -0.54 -0.12 0.00 -1.81 0.00 0.00 61.98 59.53 1sx4 s VAL 177 Cb -0.09 -2.44 0.00 0.00 0.56 0.00 0.00 36.38 34.41 1sx4 s VAL 177 CO 0.03 0.59 0.37 -1.83 -0.31 0.00 0.00 175.10 173.95 1sx4 s GLU 178 N -0.69 1.28 0.41 4.82 -1.05 -0.68 -4.95 118.70 117.85 1sx4 s GLU 178 Ca 0.10 -1.12 -0.27 0.00 -0.15 0.00 0.00 54.97 53.53 1sx4 s GLU 178 Cb -0.11 0.43 -0.10 0.00 -0.44 0.00 0.00 34.13 33.90 1sx4 s GLU 178 CO 0.01 -0.50 1.46 -0.25 0.95 0.00 0.00 175.26 176.94 1sx4 n ASP 179 N -0.28 3.58 -4.98 0.83 8.00 -1.26 -2.87 116.55 119.58 1sx4 n ASP 179 Ca -0.07 1.18 -0.20 0.00 0.71 0.00 0.00 54.79 56.41 1sx4 n ASP 179 Cb 0.63 -1.61 0.01 0.00 -0.02 0.00 0.00 41.12 40.12 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 -0.28 1.67 -0.14 0.44 0.00 -0.78 -4.75 107.32 103.48 1sx4 s GLY 180 Ca 0.57 -1.34 -0.26 0.00 0.00 0.00 0.00 44.72 43.69 1sx4 s GLY 180 CO 0.61 -1.18 0.64 -0.91 0.00 0.00 0.00 173.10 172.27 1sx4 h THR 181 N 0.56 1.53 -0.91 0.90 1.35 -1.91 -3.47 112.91 110.96 1sx4 h THR 181 Ca -0.44 -2.33 0.00 0.00 -0.55 0.00 0.00 66.41 63.08 1sx4 h THR 181 Cb 1.27 3.08 0.00 0.00 -1.73 0.00 0.00 68.15 70.76 1sx4 h THR 181 CO 0.53 0.56 0.00 0.61 -0.25 0.00 0.00 175.52 176.97 1sx4 n GLY 182 N 1.58 1.57 0.07 5.82 0.00 -1.26 -4.98 105.19 107.99 1sx4 n GLY 182 Ca -0.16 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.06 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 0.28 -4.90 0.99 4.77 -1.26 -3.21 117.00 113.67 1sx4 n LEU 183 Ca 0.00 0.12 -0.33 0.00 -0.03 0.00 0.00 56.01 55.77 1sx4 n LEU 183 Cb 0.00 0.20 -0.05 0.00 -2.33 0.00 0.00 43.42 41.24 1sx4 n LEU 183 CO 0.00 0.21 -0.06 -1.10 -1.33 0.00 0.00 177.39 175.11 1sx4 s GLN 184 N -2.98 3.55 0.53 3.23 1.11 -1.26 -3.49 119.66 120.35 1sx4 s GLN 184 Ca -0.07 -0.19 -0.21 0.00 0.01 0.00 0.00 55.36 54.90 1sx4 s GLN 184 Cb 0.09 -3.01 -0.05 0.00 -1.01 0.00 0.00 33.01 29.03 1sx4 s GLN 184 CO 0.85 0.59 1.22 -0.51 0.01 0.00 0.00 175.29 177.45 1sx4 s ASP 185 N -2.12 5.61 -0.02 5.90 1.01 -1.26 -3.96 116.67 121.84 1sx4 s ASP 185 Ca 0.33 2.42 -0.01 0.00 0.71 0.00 0.00 52.55 56.01 1sx4 s ASP 185 Cb -0.13 -2.61 0.01 0.00 1.01 0.00 0.00 42.92 41.21 1sx4 s ASP 185 CO 0.22 -1.31 0.04 -0.70 0.21 0.00 0.00 175.17 173.63 1sx4 s GLU 186 N -3.00 0.02 -0.24 8.23 2.12 0.20 -4.94 118.70 121.09 1sx4 s GLU 186 Ca 0.71 0.11 -0.03 0.00 0.36 0.00 0.00 54.97 56.11 1sx4 s GLU 186 Cb -0.31 -0.07 0.01 0.00 0.26 0.00 0.00 34.13 34.01 1sx4 s GLU 186 CO 0.36 -0.06 -0.04 -1.17 -0.54 0.00 0.00 175.26 173.81 1sx4 s LEU 187 N 0.40 3.06 -0.13 2.70 2.96 -1.26 0.05 118.68 126.46 1sx4 s LEU 187 Ca -0.03 -0.59 -0.08 0.00 -0.22 0.00 0.00 54.13 53.20 1sx4 s LEU 187 Cb -0.05 -1.72 -0.04 0.00 0.50 0.00 0.00 46.19 44.88 1sx4 s LEU 187 CO -0.01 -0.07 0.16 -1.81 -1.32 0.00 0.00 176.35 173.29 1sx4 s ASP 188 N 1.43 6.38 -0.16 3.68 1.01 -0.56 -5.00 116.67 123.45 1sx4 s ASP 188 Ca 0.04 0.45 -0.01 0.00 0.71 0.00 0.00 52.55 53.74 1sx4 s ASP 188 Cb -0.15 -2.09 0.05 0.00 1.01 0.00 0.00 42.92 41.73 1sx4 s ASP 188 CO -0.03 0.35 -0.02 -0.69 0.21 0.00 0.00 175.17 174.99 1sx4 s VAL 189 N -0.71 0.82 -0.06 -1.27 1.01 -1.26 -1.14 120.40 117.80 1sx4 s VAL 189 Ca 0.14 -0.50 -0.25 0.00 0.00 0.00 0.00 61.98 61.37 1sx4 s VAL 189 Cb -0.12 -1.10 -0.03 0.00 0.00 0.00 0.00 36.38 35.13 1sx4 s VAL 189 CO 0.03 0.04 0.79 -0.69 0.00 0.00 0.00 175.10 175.27 1sx4 s VAL 190 N 1.75 4.98 -0.26 2.92 1.01 -0.55 -5.01 120.40 125.24 1sx4 s VAL 190 Ca 0.01 1.63 -0.22 0.00 0.00 0.00 0.00 61.98 63.39 1sx4 s VAL 190 Cb -0.15 -4.13 -0.01 0.00 0.00 0.00 0.00 36.38 32.09 1sx4 s VAL 190 CO -0.07 0.21 0.72 -1.61 0.00 0.00 0.00 175.10 174.35 1sx4 s GLU 191 N 0.98 4.11 5.62 2.72 0.41 -1.26 -3.39 118.70 127.89 1sx4 s GLU 191 Ca 0.42 0.69 0.00 0.00 -0.41 0.00 0.00 54.97 55.67 1sx4 s GLU 191 Cb -0.18 -3.66 0.00 0.00 -1.78 0.00 0.00 34.13 28.50 1sx4 s GLU 191 CO 0.20 -0.49 0.00 0.41 -0.49 0.00 0.00 175.26 174.89 1sx4 n GLY 192 N 4.02 1.68 3.74 -1.39 0.00 -1.26 -4.83 105.19 107.15 1sx4 n GLY 192 Ca 0.02 -0.58 -0.35 0.00 0.00 0.00 0.00 46.02 45.11 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 -4.68 119.30 116.44 1sx4 s MET 193 Ca 0.00 -0.21 -0.26 0.00 -1.25 0.00 0.00 55.69 53.98 1sx4 s MET 193 Cb 0.00 -3.41 0.10 0.00 1.25 0.00 0.00 34.83 32.77 1sx4 s MET 193 CO 0.00 0.32 0.88 -1.14 1.05 0.00 0.00 175.02 176.13 1sx4 s GLN 194 N 0.29 0.68 0.38 4.11 0.74 -1.26 -2.10 119.66 122.51 1sx4 s GLN 194 Ca 0.09 0.73 0.06 0.00 0.05 0.00 0.00 55.36 56.29 1sx4 s GLN 194 Cb -0.11 0.33 -0.02 0.00 1.10 0.00 0.00 33.01 34.31 1sx4 s GLN 194 CO -0.02 -0.10 0.22 -0.59 -0.55 0.00 0.00 175.29 174.26 1sx4 s PHE 195 N 0.16 1.79 -0.26 1.67 -0.71 -0.26 -5.00 117.98 115.37 1sx4 s PHE 195 Ca 0.01 -1.53 -0.01 0.00 -1.04 0.00 0.00 56.93 54.36 1sx4 s PHE 195 Cb -0.05 -0.92 0.15 0.00 -1.21 0.00 0.00 43.02 40.99 1sx4 s PHE 195 CO -0.02 -0.64 2.12 -0.25 -1.34 0.00 0.00 175.22 175.09 1sx4 n ASP 196 N -1.54 6.24 -4.03 1.98 8.00 -1.26 -2.25 116.55 123.68 1sx4 n ASP 196 Ca 0.01 -2.94 -0.28 0.00 0.71 0.00 0.00 54.79 52.30 1sx4 n ASP 196 Cb 0.63 -1.09 -0.17 0.00 -0.02 0.00 0.00 41.12 40.47 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 -1.40 2.04 0.54 -1.24 1.81 -1.09 -4.63 118.95 114.98 1sx4 s ARG 197 Ca 0.28 -0.50 -0.01 0.00 -1.72 0.00 0.00 55.73 53.79 1sx4 s ARG 197 Cb 0.21 -1.77 0.02 0.00 -0.45 0.00 0.00 34.95 32.96 1sx4 s ARG 197 CO -0.02 -0.08 0.78 0.20 -0.68 0.00 0.00 175.30 175.50 1sx4 s GLY 198 N 1.04 1.70 0.64 -3.53 0.00 -1.24 -0.46 107.32 105.47 1sx4 s GLY 198 Ca -0.06 -1.11 -0.17 0.00 0.00 0.00 0.00 44.72 43.37 1sx4 s GLY 198 CO -0.02 -0.86 0.74 1.58 0.00 0.00 0.00 173.10 174.54 1sx4 n TYR 199 N -2.34 -0.01 0.36 1.90 0.18 -1.11 -4.23 117.16 111.90 1sx4 n TYR 199 Ca 0.05 0.41 0.12 0.00 1.88 0.00 0.00 57.90 60.36 1sx4 n TYR 199 Cb 0.59 -2.02 0.12 0.00 -0.38 0.00 0.00 39.34 37.64 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 0.09 0.00 -7.51 -3.48 3.38 -1.55 -3.44 115.31 102.80 1sx4 h LEU 200 Ca -0.47 -0.10 -0.26 0.00 0.09 0.00 0.00 57.88 57.14 1sx4 h LEU 200 Cb 1.37 0.00 -0.32 0.00 0.09 0.00 0.00 40.66 41.80 1sx4 h LEU 200 CO 0.47 0.05 -0.66 -0.94 0.09 0.00 0.00 178.44 177.45 1sx4 s SER 201 N -4.89 -0.03 0.00 -0.43 1.04 -1.26 -5.02 113.70 103.11 1sx4 s SER 201 Ca 0.04 0.17 0.03 0.00 0.48 0.00 0.00 55.95 56.66 1sx4 s SER 201 Cb 0.11 0.08 0.15 0.00 0.10 0.00 0.00 66.02 66.46 1sx4 s SER 201 CO 0.74 -0.12 0.63 -2.65 0.98 0.00 0.00 173.24 172.82 1sx4 n PRO 202 N 3.96 0.08 0.13 4.02 -0.02 -1.26 -2.20 135.00 139.70 1sx4 n PRO 202 Ca -0.24 0.00 0.01 0.00 -2.02 0.00 0.00 63.50 61.25 1sx4 n PRO 202 Cb 0.53 -1.49 0.01 0.00 -0.02 0.00 0.00 33.50 32.52 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 0.00 6.00 0.05 -1.99 -3.23 116.97 117.81 1sx4 h TYR 203 Ca 0.00 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.78 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 0.56 -0.02 0.74 -1.05 0.00 0.00 178.16 178.39 1sx4 h PHE 204 N 0.00 0.00 -1.58 4.88 0.04 -1.78 -3.43 116.94 115.07 1sx4 h PHE 204 Ca -0.01 0.00 -0.58 0.00 2.80 0.00 0.00 57.97 60.18 1sx4 h PHE 204 Cb 1.43 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.58 1sx4 h PHE 204 CO 0.00 0.02 1.52 -0.89 -0.60 0.00 0.00 178.31 178.36 1sx4 n ILE 205 N -3.85 0.19 1.31 -0.55 5.41 -1.22 -4.84 119.36 115.81 1sx4 n ILE 205 Ca -0.03 -0.47 0.13 0.00 1.00 0.00 0.00 62.75 63.39 1sx4 n ILE 205 Cb 0.10 -2.29 0.37 0.00 -0.71 0.00 0.00 39.64 37.11 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 12.13 1.68 -3.52 4.38 0.23 -1.26 -4.60 115.26 124.30 1sx4 n ASN 206 Ca 0.36 -1.43 -0.29 0.00 -0.53 0.00 0.00 54.58 52.70 1sx4 n ASN 206 Cb 0.40 0.08 -0.12 0.00 -2.08 0.00 0.00 39.78 38.05 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 -2.17 0.90 0.54 -3.83 1.02 -1.20 -4.99 119.74 110.01 1sx4 s LYS 207 Ca 0.31 -1.77 0.30 0.00 0.02 0.00 0.00 55.97 54.82 1sx4 s LYS 207 Cb 0.20 -1.67 1.57 0.00 -0.52 0.00 0.00 37.83 37.41 1sx4 s LYS 207 CO 0.40 -1.25 2.11 -1.00 -0.92 0.00 0.00 175.35 174.69 1sx4 h PRO 208 N 6.53 0.00 -0.69 -1.68 0.13 -1.81 -2.76 132.00 131.72 1sx4 h PRO 208 Ca 0.10 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.22 1sx4 h PRO 208 Cb 0.93 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.03 1sx4 h PRO 208 CO 0.36 0.09 0.40 0.93 -0.23 0.00 0.00 178.00 179.55 1sx4 h GLU 209 N 0.00 0.93 0.00 0.86 3.07 -1.95 -0.87 114.58 116.62 1sx4 h GLU 209 Ca -0.00 -0.09 -0.14 0.00 -0.50 0.00 0.00 59.36 58.63 1sx4 h GLU 209 Cb 0.28 -0.19 -0.02 0.00 -0.84 0.00 0.00 28.75 27.98 1sx4 h GLU 209 CO 0.01 0.67 -0.89 1.15 -1.40 0.00 0.00 179.01 178.55 1sx4 h THR 210 N 0.95 0.85 -0.42 1.13 2.02 -2.00 -3.47 112.91 111.97 1sx4 h THR 210 Ca 0.25 -2.31 -0.08 0.00 0.77 0.00 0.00 66.41 65.03 1sx4 h THR 210 Cb -0.01 2.35 -0.02 0.00 -1.74 0.00 0.00 68.15 68.73 1sx4 h THR 210 CO -0.04 0.49 -0.09 0.61 0.37 0.00 0.00 175.52 176.85 1sx4 n GLY 211 N 1.30 0.40 3.09 2.16 0.00 -0.33 -5.04 105.19 106.77 1sx4 n GLY 211 Ca -0.02 -0.79 -0.08 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.18 0.57 -0.06 4.61 0.00 -1.09 -4.48 121.76 119.13 1sx4 s ALA 212 Ca 0.00 -1.16 -0.09 0.00 0.00 0.00 0.00 51.96 50.71 1sx4 s ALA 212 Cb 0.00 0.23 -0.05 0.00 0.00 0.00 0.00 23.12 23.30 1sx4 s ALA 212 CO 0.00 -0.31 0.25 0.08 0.00 0.00 0.00 175.76 175.78 1sx4 s VAL 213 N -3.51 5.32 -0.07 0.00 1.01 0.74 -3.26 120.40 120.63 1sx4 s VAL 213 Ca 0.05 0.40 -0.03 0.00 0.00 0.00 0.00 61.98 62.40 1sx4 s VAL 213 Cb 0.05 -3.53 0.04 0.00 0.00 0.00 0.00 36.38 32.95 1sx4 s VAL 213 CO -0.08 0.56 0.14 -0.70 0.00 0.00 0.00 175.10 175.03 1sx4 s GLU 214 N -1.17 0.03 0.04 2.72 2.12 -1.26 -0.74 118.70 120.44 1sx4 s GLU 214 Ca 0.20 0.49 0.05 0.00 0.36 0.00 0.00 54.97 56.06 1sx4 s GLU 214 Cb -0.14 -0.28 -0.02 0.00 0.26 0.00 0.00 34.13 33.96 1sx4 s GLU 214 CO 0.09 -0.27 -0.13 -0.51 -0.54 0.00 0.00 175.26 173.89 1sx4 s LEU 215 N 1.99 2.17 -0.05 2.70 1.43 -0.83 -4.92 118.68 121.16 1sx4 s LEU 215 Ca 0.00 -0.45 0.06 0.00 -1.03 0.00 0.00 54.13 52.72 1sx4 s LEU 215 Cb -0.12 -0.56 -0.01 0.00 0.03 0.00 0.00 46.19 45.53 1sx4 s LEU 215 CO -0.05 0.02 -0.25 -1.61 0.23 0.00 0.00 176.35 174.69 1sx4 s GLU 216 N -1.11 2.41 -1.47 1.70 2.02 -1.26 -0.52 118.70 120.45 1sx4 s GLU 216 Ca 0.01 -0.89 -0.11 0.00 0.02 0.00 0.00 54.97 54.00 1sx4 s GLU 216 Cb -0.08 -2.09 0.07 0.00 0.10 0.00 0.00 34.13 32.14 1sx4 s GLU 216 CO 0.01 0.40 0.80 0.43 0.02 0.00 0.00 175.26 176.92 1sx4 n SER 217 N 2.87 -4.72 -4.80 -0.19 7.64 -0.22 -4.62 113.62 109.57 1sx4 n SER 217 Ca -0.17 -0.61 -0.36 0.00 1.01 0.00 0.00 58.87 58.74 1sx4 n SER 217 Cb 0.52 -3.81 -0.06 0.00 -1.01 0.00 0.00 64.21 59.85 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 -6.34 4.42 0.59 1.43 0.04 -1.20 -4.62 135.00 129.33 1sx4 s PRO 218 Ca 0.55 1.14 -0.16 0.00 0.04 0.00 0.00 61.00 62.57 1sx4 s PRO 218 Cb -0.27 -2.74 -0.04 0.00 0.04 0.00 0.00 34.50 31.49 1sx4 s PRO 218 CO 0.68 0.27 1.06 -0.06 0.04 0.00 0.00 177.00 178.99 1sx4 s PHE 219 N -1.67 2.97 -0.13 0.56 0.08 -0.24 -2.69 117.98 116.86 1sx4 s PHE 219 Ca 0.50 1.51 0.00 0.00 0.12 0.00 0.00 56.93 59.06 1sx4 s PHE 219 Cb -0.17 -3.02 0.02 0.00 -0.57 0.00 0.00 43.02 39.29 1sx4 s PHE 219 CO 0.21 -1.13 -0.13 0.42 -0.10 0.00 0.00 175.22 174.49 1sx4 s ILE 220 N -2.43 1.43 -0.35 0.64 1.01 0.22 -0.30 121.20 121.42 1sx4 s ILE 220 Ca 0.64 -0.55 -0.15 0.00 0.00 0.00 0.00 60.65 60.59 1sx4 s ILE 220 Cb -0.16 -1.36 -0.01 0.00 0.01 0.00 0.00 42.46 40.94 1sx4 s ILE 220 CO 0.36 0.43 0.33 -0.22 0.00 0.00 0.00 174.94 175.85 1sx4 s LEU 221 N 1.44 4.54 -0.36 2.97 2.96 0.16 -0.34 118.68 130.06 1sx4 s LEU 221 Ca 0.03 -0.36 -0.11 0.00 -0.22 0.00 0.00 54.13 53.46 1sx4 s LEU 221 Cb -0.13 -2.27 0.02 0.00 0.50 0.00 0.00 46.19 44.30 1sx4 s LEU 221 CO -0.08 -0.33 0.21 -0.76 -1.32 0.00 0.00 176.35 174.06 1sx4 s LEU 222 N 1.92 4.60 -0.25 -0.68 1.43 -1.26 -1.14 118.68 123.30 1sx4 s LEU 222 Ca 0.10 -0.84 0.02 0.00 -1.03 0.00 0.00 54.13 52.38 1sx4 s LEU 222 Cb -0.17 -2.04 0.05 0.00 0.03 0.00 0.00 46.19 44.06 1sx4 s LEU 222 CO 0.11 -0.34 -0.11 0.00 0.23 0.00 0.00 176.35 176.24 1sx4 s ALA 223 N 1.59 2.55 -1.39 4.21 0.00 -0.73 -1.51 121.76 126.49 1sx4 s ALA 223 Ca 0.03 -1.69 -0.11 0.00 0.00 0.00 0.00 51.96 50.19 1sx4 s ALA 223 Cb -0.19 -1.56 0.09 0.00 0.00 0.00 0.00 23.12 21.47 1sx4 s ALA 223 CO 0.07 -1.08 2.16 -3.47 0.00 0.00 0.00 175.76 173.44 1sx4 n ASP 224 N 4.47 5.15 0.00 0.00 2.03 -1.04 -2.18 116.55 124.99 1sx4 n ASP 224 Ca -0.15 -2.96 0.00 0.00 0.52 0.00 0.00 54.79 52.20 1sx4 n ASP 224 Cb 0.43 -1.55 0.00 0.00 -0.72 0.00 0.00 41.12 39.28 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 4.57 0.00 -1.75 -0.67 2.85 -1.26 -4.36 118.16 117.53 1sx4 n LYS 225 Ca 0.50 0.00 -0.38 0.00 -1.05 0.00 0.00 58.31 57.38 1sx4 n LYS 225 Cb 0.35 0.00 0.06 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 -1.97 2.80 -0.28 -1.58 1.02 -1.26 -3.11 119.74 115.36 1sx4 s LYS 226 Ca 0.00 2.15 0.03 0.00 0.02 0.00 0.00 55.97 58.17 1sx4 s LYS 226 Cb 0.00 -2.02 0.07 0.00 -0.52 0.00 0.00 37.83 35.36 1sx4 s LYS 226 CO 0.00 -1.43 -0.05 0.42 -0.92 0.00 0.00 175.35 173.37 1sx4 s ILE 227 N -1.35 2.04 -0.17 2.17 1.01 -0.15 -4.91 121.20 119.83 1sx4 s ILE 227 Ca 0.78 -1.73 -0.05 0.00 0.00 0.00 0.00 60.65 59.64 1sx4 s ILE 227 Cb -0.39 -2.27 -0.09 0.00 0.01 0.00 0.00 42.46 39.72 1sx4 s ILE 227 CO 0.43 -0.21 -0.20 -1.20 0.00 0.00 0.00 174.94 173.76 1sx4 n SER 228 N 4.44 1.77 -4.71 3.58 7.64 -1.26 -2.80 113.62 122.28 1sx4 n SER 228 Ca -0.09 0.11 -0.39 0.00 1.01 0.00 0.00 58.87 59.52 1sx4 n SER 228 Cb 0.42 -0.43 -0.06 0.00 -1.01 0.00 0.00 64.21 63.14 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 -6.25 6.75 0.43 6.43 0.01 -1.26 -0.12 114.94 120.92 1sx4 s ASN 229 Ca -0.24 0.89 0.22 0.00 -0.71 0.00 0.00 52.86 53.03 1sx4 s ASN 229 Cb 0.08 -2.32 0.92 0.00 0.41 0.00 0.00 41.25 40.34 1sx4 s ASN 229 CO 0.34 -0.07 1.84 -0.29 -1.51 0.00 0.00 177.10 177.40 1sx4 h ILE 230 N 4.81 0.72 -0.82 0.60 2.10 -1.89 -3.19 117.51 119.84 1sx4 h ILE 230 Ca -0.39 -1.16 0.20 0.00 1.08 0.00 0.00 64.86 64.58 1sx4 h ILE 230 Cb 1.18 1.74 -0.13 0.00 -1.09 0.00 0.00 36.82 38.52 1sx4 h ILE 230 CO 0.76 0.26 0.17 0.03 -1.08 0.00 0.00 178.15 178.29 1sx4 h ARG 231 N 0.00 0.20 0.00 2.19 3.08 -2.00 0.27 114.38 118.11 1sx4 h ARG 231 Ca -0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1sx4 h ARG 231 Cb 0.72 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.72 1sx4 h ARG 231 CO 0.03 0.13 0.05 0.93 -1.07 0.00 0.00 179.97 180.05 1sx4 h GLU 232 N 0.21 0.00 0.06 0.04 5.08 -1.98 -2.95 114.58 115.03 1sx4 h GLU 232 Ca 0.49 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 58.48 1sx4 h GLU 232 Cb 0.93 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.13 1sx4 h GLU 232 CO -0.62 0.00 -2.13 -1.33 -1.00 0.00 0.00 179.01 173.93 1sx4 n MET 233 N -2.85 0.69 -0.37 2.33 2.81 0.91 -2.81 117.12 117.83 1sx4 n MET 233 Ca -0.02 0.26 0.00 0.00 -1.81 0.00 0.00 57.70 56.13 1sx4 n MET 233 Cb 0.11 -1.63 0.06 0.00 -0.71 0.00 0.00 33.22 31.05 1sx4 n MET 233 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1sx4 n LEU 234 N -3.57 -0.58 -0.16 4.03 4.77 -1.06 0.10 117.00 120.53 1sx4 n LEU 234 Ca -0.39 1.70 0.23 0.00 -0.03 0.00 0.00 56.01 57.52 1sx4 n LEU 234 Cb 0.98 -0.41 0.64 0.00 -2.33 0.00 0.00 43.42 42.29 1sx4 n LEU 234 CO 0.31 -1.54 1.23 1.55 -1.33 0.00 0.00 177.39 177.61 1sx4 h PRO 235 N 0.00 0.15 0.00 3.23 0.13 -1.84 -2.58 132.00 131.08 1sx4 h PRO 235 Ca 0.36 -0.01 -0.04 0.00 -0.87 0.00 0.00 66.00 65.45 1sx4 h PRO 235 Cb 0.61 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.70 1sx4 h PRO 235 CO -0.97 0.10 -0.44 0.28 -0.23 0.00 0.00 178.00 176.74 1sx4 h VAL 236 N 0.15 0.33 -1.19 1.56 2.07 -0.58 -3.15 116.25 115.45 1sx4 h VAL 236 Ca 0.40 -1.33 0.34 0.00 0.82 0.00 0.00 66.70 66.94 1sx4 h VAL 236 Cb 1.33 0.70 -0.05 0.00 -1.52 0.00 0.00 31.29 31.75 1sx4 h VAL 236 CO -0.07 0.11 0.93 -0.07 0.02 0.00 0.00 177.57 178.50 1sx4 h LEU 237 N -1.00 0.00 0.05 2.57 3.38 -1.21 0.11 115.31 119.21 1sx4 h LEU 237 Ca -0.06 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.59 1sx4 h LEU 237 Cb 0.54 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 1sx4 h LEU 237 CO -0.03 0.00 -1.81 -0.62 0.09 0.00 0.00 178.44 176.07 1sx4 n GLU 238 N -3.97 0.68 0.12 1.13 1.02 -0.99 -1.96 120.64 116.67 1sx4 n GLU 238 Ca 0.26 0.29 0.04 0.00 -0.02 0.00 0.00 57.16 57.72 1sx4 n GLU 238 Cb 1.32 -1.77 0.45 0.00 -0.02 0.00 0.00 31.44 31.43 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 0.66 1.67 -0.01 0.62 0.00 -0.97 -2.70 119.26 118.53 1sx4 h ALA 239 Ca -0.33 -0.11 -0.24 0.00 0.00 0.00 0.00 54.91 54.23 1sx4 h ALA 239 Cb 2.02 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 19.73 1sx4 h ALA 239 CO 0.08 0.25 -0.95 0.28 0.00 0.00 0.00 179.25 178.91 1sx4 h VAL 240 N 0.26 1.36 0.00 0.00 2.07 -1.30 -3.12 116.25 115.53 1sx4 h VAL 240 Ca 0.06 -2.36 -0.02 0.00 0.82 0.00 0.00 66.70 65.20 1sx4 h VAL 240 Cb 0.18 2.38 -0.00 0.00 -1.52 0.00 0.00 31.29 32.32 1sx4 h VAL 240 CO 0.00 0.71 -0.08 0.00 0.02 0.00 0.00 177.57 178.22 1sx4 h ALA 241 N 0.65 1.59 0.09 1.67 0.00 -1.22 -2.26 119.26 119.79 1sx4 h ALA 241 Ca -0.09 -0.08 -0.26 0.00 0.00 0.00 0.00 54.91 54.49 1sx4 h ALA 241 Cb 1.59 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.37 1sx4 h ALA 241 CO 0.17 0.10 -1.16 0.87 0.00 0.00 0.00 179.25 179.24 1sx4 h LYS 242 N 0.00 0.24 0.00 0.00 1.57 -1.51 -3.24 116.57 113.63 1sx4 h LYS 242 Ca -0.00 -0.38 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 1sx4 h LYS 242 Cb 0.18 0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1sx4 h LYS 242 CO 0.01 1.16 -0.05 0.00 -0.57 0.00 0.00 179.45 180.00 1sx4 n ALA 243 N -2.50 2.43 -1.53 3.86 0.00 -1.05 -4.95 120.51 116.77 1sx4 n ALA 243 Ca -0.07 -0.11 -0.12 0.00 0.00 0.00 0.00 53.44 53.14 1sx4 n ALA 243 Cb 0.98 -1.44 -0.04 0.00 0.00 0.00 0.00 19.45 18.95 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 1.47 1.01 3.64 0.00 0.00 -0.87 -5.02 105.19 105.42 1sx4 n GLY 244 Ca 0.07 -0.46 -0.28 0.00 0.00 0.00 0.00 46.02 45.35 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 -3.33 2.33 1.01 1.61 1.02 -1.24 -5.07 119.74 116.07 1sx4 s LYS 245 Ca 0.00 -1.04 -0.13 0.00 0.02 0.00 0.00 55.97 54.82 1sx4 s LYS 245 Cb 0.00 -2.37 0.20 0.00 -0.52 0.00 0.00 37.83 35.14 1sx4 s LYS 245 CO 0.00 0.49 1.11 -1.25 -0.92 0.00 0.00 175.35 174.77 1sx4 s PRO 246 N -2.59 0.30 -0.05 -1.68 0.04 -1.26 -4.74 135.00 125.01 1sx4 s PRO 246 Ca 0.25 0.36 -0.02 0.00 0.04 0.00 0.00 61.00 61.63 1sx4 s PRO 246 Cb -0.10 -1.74 0.03 0.00 0.04 0.00 0.00 34.50 32.73 1sx4 s PRO 246 CO 0.17 -2.78 0.11 -1.17 0.04 0.00 0.00 177.00 173.37 1sx4 s LEU 247 N -6.44 0.91 -0.09 -3.56 2.96 0.11 -1.08 118.68 111.49 1sx4 s LEU 247 Ca 0.66 0.23 -0.09 0.00 -0.22 0.00 0.00 54.13 54.71 1sx4 s LEU 247 Cb -0.16 0.26 -0.04 0.00 0.50 0.00 0.00 46.19 46.74 1sx4 s LEU 247 CO 0.56 -0.13 0.21 -0.22 -1.32 0.00 0.00 176.35 175.45 1sx4 s LEU 248 N 1.02 4.41 -0.30 -0.68 2.96 0.59 -1.65 118.68 125.04 1sx4 s LEU 248 Ca -0.08 0.59 0.01 0.00 -0.22 0.00 0.00 54.13 54.43 1sx4 s LEU 248 Cb -0.11 -2.21 0.07 0.00 0.50 0.00 0.00 46.19 44.44 1sx4 s LEU 248 CO -0.05 0.38 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.71 1sx4 s ILE 249 N -1.05 2.55 -0.43 6.68 -1.09 0.35 0.39 121.20 128.60 1sx4 s ILE 249 Ca 0.17 -1.69 -0.06 0.00 -2.23 0.00 0.00 60.65 56.85 1sx4 s ILE 249 Cb -0.13 -2.56 0.10 0.00 -1.58 0.00 0.00 42.46 38.29 1sx4 s ILE 249 CO 0.07 -0.19 0.25 -0.63 -1.23 0.00 0.00 174.94 173.21 1sx4 s ILE 250 N 1.13 3.75 0.47 2.92 1.01 -0.29 -2.01 121.20 128.18 1sx4 s ILE 250 Ca -0.03 -1.80 0.04 0.00 0.00 0.00 0.00 60.65 58.85 1sx4 s ILE 250 Cb -0.20 -3.46 -0.03 0.00 0.01 0.00 0.00 42.46 38.77 1sx4 s ILE 250 CO -0.04 -0.65 0.04 0.00 0.00 0.00 0.00 174.94 174.29 1sx4 s ALA 251 N 1.27 3.79 0.42 9.38 0.00 -1.24 -1.77 121.76 133.62 1sx4 s ALA 251 Ca 0.06 -1.20 0.14 0.00 0.00 0.00 0.00 51.96 50.95 1sx4 s ALA 251 Cb -0.24 -0.01 1.00 0.00 0.00 0.00 0.00 23.12 23.88 1sx4 s ALA 251 CO -0.02 -0.09 1.95 1.49 0.00 0.00 0.00 175.76 179.09 1sx4 h GLU 252 N 1.45 0.44 -1.27 0.00 4.81 -1.37 0.78 114.58 119.42 1sx4 h GLU 252 Ca -0.43 -0.03 0.26 0.00 -0.13 0.00 0.00 59.36 59.03 1sx4 h GLU 252 Cb 1.29 -0.10 -0.22 0.00 0.63 0.00 0.00 28.75 30.35 1sx4 h GLU 252 CO 0.75 0.29 0.87 0.34 -0.73 0.00 0.00 179.01 180.54 1sx4 s ASP 253 N -6.12 -0.10 -0.24 1.04 2.15 -1.26 -4.21 116.67 107.95 1sx4 s ASP 253 Ca -0.08 0.03 0.01 0.00 0.43 0.00 0.00 52.55 52.94 1sx4 s ASP 253 Cb 0.20 0.09 0.06 0.00 -0.30 0.00 0.00 42.92 42.98 1sx4 s ASP 253 CO 0.76 -0.14 -0.04 -0.69 -0.17 0.00 0.00 175.17 174.88 1sx4 s VAL 254 N -1.92 1.51 0.12 1.11 1.01 -1.26 -0.98 120.40 119.98 1sx4 s VAL 254 Ca 0.09 -1.24 0.00 0.00 0.00 0.00 0.00 61.98 60.83 1sx4 s VAL 254 Cb -0.01 -1.80 0.02 0.00 0.00 0.00 0.00 36.38 34.60 1sx4 s VAL 254 CO -0.04 -0.13 0.16 -0.62 0.00 0.00 0.00 175.10 174.47 1sx4 n GLU 255 N 4.67 0.52 0.00 2.72 1.02 -1.12 -4.75 120.64 123.70 1sx4 n GLU 255 Ca -0.11 -0.44 0.00 0.00 -0.02 0.00 0.00 57.16 56.59 1sx4 n GLU 255 Cb 0.44 -0.11 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 3.76 -2.43 0.46 0.62 0.00 -1.26 -1.42 105.19 104.92 1sx4 n GLY 256 Ca 0.03 0.52 -0.15 0.00 0.00 0.00 0.00 46.02 46.42 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 -0.50 0.66 1.61 4.22 -1.92 0.17 114.58 118.82 1sx4 h GLU 257 Ca 0.00 0.03 -0.03 0.00 0.08 0.00 0.00 59.36 59.45 1sx4 h GLU 257 Cb 0.00 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 1sx4 h GLU 257 CO 0.00 -0.33 -0.42 0.00 -2.18 0.00 0.00 179.01 176.07 1sx4 h ALA 258 N -0.25 -1.21 -0.28 2.92 0.00 -0.63 -2.98 119.26 116.82 1sx4 h ALA 258 Ca 0.04 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.78 1sx4 h ALA 258 Cb 0.64 0.55 -0.06 0.00 0.00 0.00 0.00 17.79 18.92 1sx4 h ALA 258 CO -0.47 -1.18 -0.45 1.25 0.00 0.00 0.00 179.25 178.40 1sx4 h LEU 259 N -1.02 -1.48 -0.90 0.00 5.85 -1.01 -0.74 115.31 116.02 1sx4 h LEU 259 Ca -0.09 0.19 0.11 0.00 0.84 0.00 0.00 57.88 58.94 1sx4 h LEU 259 Cb 0.82 0.60 -0.13 0.00 0.37 0.00 0.00 40.66 42.32 1sx4 h LEU 259 CO 0.08 -0.34 -0.43 0.00 -0.34 0.00 0.00 178.44 177.41 1sx4 n ALA 260 N -2.99 -0.31 -0.23 1.25 0.00 0.59 0.18 120.51 119.00 1sx4 n ALA 260 Ca -0.03 0.84 -0.06 0.00 0.00 0.00 0.00 53.44 54.19 1sx4 n ALA 260 Cb 0.28 -0.28 0.04 0.00 0.00 0.00 0.00 19.45 19.49 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 1.19 -0.57 0.00 2.02 -1.17 0.83 112.91 115.21 1sx4 h THR 261 Ca 0.24 -0.46 0.06 0.00 0.77 0.00 0.00 66.41 67.02 1sx4 h THR 261 Cb 0.47 0.35 -0.05 0.00 -1.74 0.00 0.00 68.15 67.17 1sx4 h THR 261 CO -0.87 0.21 0.28 -0.07 0.37 0.00 0.00 175.52 175.43 1sx4 h LEU 262 N 0.86 0.37 -0.49 2.58 3.38 0.62 0.17 115.31 122.81 1sx4 h LEU 262 Ca 0.22 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.25 1sx4 h LEU 262 Cb 0.01 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1sx4 h LEU 262 CO -0.04 0.25 0.32 0.58 0.09 0.00 0.00 178.44 179.63 1sx4 h VAL 263 N 0.52 1.11 -0.52 1.22 2.07 0.50 -0.35 116.25 120.81 1sx4 h VAL 263 Ca 0.26 -0.22 -0.04 0.00 0.82 0.00 0.00 66.70 67.53 1sx4 h VAL 263 Cb 0.21 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 1sx4 h VAL 263 CO -0.20 0.12 0.17 0.58 0.02 0.00 0.00 177.57 178.25 1sx4 h VAL 264 N 0.65 1.20 -0.09 2.57 2.07 -0.01 -2.27 116.25 120.37 1sx4 h VAL 264 Ca 0.18 -0.68 -0.23 0.00 0.82 0.00 0.00 66.70 66.78 1sx4 h VAL 264 Cb -0.06 0.63 0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1sx4 h VAL 264 CO -0.05 0.26 -0.86 0.78 0.02 0.00 0.00 177.57 177.73 1sx4 h ASN 265 N 0.75 0.91 -0.22 0.57 -0.26 -0.10 -3.09 115.58 114.13 1sx4 h ASN 265 Ca 0.17 -0.67 -0.19 0.00 -0.56 0.00 0.00 56.30 55.05 1sx4 h ASN 265 Cb 0.21 -0.27 0.00 0.00 -1.06 0.00 0.00 38.32 37.20 1sx4 h ASN 265 CO -0.01 1.45 -0.61 0.71 -1.06 0.00 0.00 177.43 177.91 1sx4 h THR 266 N 0.45 1.28 0.02 2.81 1.35 -1.10 -2.83 112.91 114.88 1sx4 h THR 266 Ca -0.08 -1.80 0.03 0.00 -0.55 0.00 0.00 66.41 64.01 1sx4 h THR 266 Cb 1.50 1.72 -0.05 0.00 -1.73 0.00 0.00 68.15 69.59 1sx4 h THR 266 CO 0.17 0.58 -0.44 -0.03 -0.25 0.00 0.00 175.52 175.55 1sx4 h MET 267 N 0.62 -0.58 0.00 4.72 -1.53 -1.46 -2.81 114.93 113.88 1sx4 h MET 267 Ca -0.00 0.04 0.00 0.00 -3.44 0.00 0.00 59.70 56.30 1sx4 h MET 267 Cb 1.21 0.13 0.00 0.00 -0.55 0.00 0.00 31.60 32.40 1sx4 h MET 267 CO 0.13 -0.39 0.00 0.54 0.14 0.00 0.00 176.91 177.33 1sx4 n ARG 268 N -5.46 0.46 -2.08 0.39 1.74 -1.17 -4.79 116.66 105.76 1sx4 n ARG 268 Ca -0.06 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.92 1sx4 n ARG 268 Cb 0.38 -1.14 -0.01 0.00 -1.02 0.00 0.00 32.46 30.67 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 -0.05 0.10 0.02 -0.13 0.00 -1.06 -4.98 105.19 99.10 1sx4 n GLY 269 Ca 0.03 -0.50 -0.01 0.00 0.00 0.00 0.00 46.02 45.54 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 -3.55 -0.61 2.04 -1.69 -3.47 117.51 110.23 1sx4 h ILE 270 Ca -0.22 -0.10 -0.35 0.00 1.00 0.00 0.00 64.86 65.19 1sx4 h ILE 270 Cb 1.11 0.00 -0.33 0.00 -0.74 0.00 0.00 36.82 36.86 1sx4 h ILE 270 CO 0.27 0.00 -0.75 -0.69 0.00 0.00 0.00 178.15 176.98 1sx4 s VAL 271 N -1.67 0.29 -0.36 1.67 1.01 -1.24 -5.02 120.40 115.08 1sx4 s VAL 271 Ca -0.01 -0.01 -0.29 0.00 0.00 0.00 0.00 61.98 61.68 1sx4 s VAL 271 Cb 0.00 -0.35 -0.00 0.00 0.00 0.00 0.00 36.38 36.03 1sx4 s VAL 271 CO 0.02 0.16 1.57 -0.54 0.00 0.00 0.00 175.10 176.30 1sx4 s LYS 272 N 0.80 3.52 0.08 2.72 3.01 -1.26 -4.01 119.74 124.60 1sx4 s LYS 272 Ca -0.09 1.19 0.01 0.00 -1.01 0.00 0.00 55.97 56.07 1sx4 s LYS 272 Cb -0.12 -4.08 -0.04 0.00 -1.01 0.00 0.00 37.83 32.58 1sx4 s LYS 272 CO -0.01 -1.63 -0.05 0.08 0.51 0.00 0.00 175.35 174.24 1sx4 s VAL 273 N 5.90 0.52 0.06 3.17 1.01 -1.26 -0.71 120.40 129.09 1sx4 s VAL 273 Ca 0.69 -1.83 -0.13 0.00 0.00 0.00 0.00 61.98 60.71 1sx4 s VAL 273 Cb -0.18 -1.55 0.02 0.00 0.00 0.00 0.00 36.38 34.67 1sx4 s VAL 273 CO 0.32 -0.88 0.29 0.00 0.00 0.00 0.00 175.10 174.83 1sx4 s ALA 274 N -3.57 -0.60 -0.02 5.51 0.00 -0.66 -4.88 121.76 117.54 1sx4 s ALA 274 Ca 0.09 -0.14 -0.08 0.00 0.00 0.00 0.00 51.96 51.83 1sx4 s ALA 274 Cb 0.05 0.39 0.01 0.00 0.00 0.00 0.00 23.12 23.57 1sx4 s ALA 274 CO -0.06 -0.45 0.17 0.00 0.00 0.00 0.00 175.76 175.41 1sx4 s ALA 275 N -2.93 -0.41 -0.26 0.00 0.00 -1.26 -0.50 121.76 116.41 1sx4 s ALA 275 Ca -0.02 0.10 -0.22 0.00 0.00 0.00 0.00 51.96 51.81 1sx4 s ALA 275 Cb 0.00 -0.01 0.07 0.00 0.00 0.00 0.00 23.12 23.18 1sx4 s ALA 275 CO -0.06 -0.18 0.69 0.14 0.00 0.00 0.00 175.76 176.35 1sx4 s VAL 276 N -0.95 -0.00 0.94 0.00 -7.23 -0.85 -1.20 120.40 111.10 1sx4 s VAL 276 Ca -0.10 0.00 -0.11 0.00 -1.81 0.00 0.00 61.98 59.96 1sx4 s VAL 276 Cb -0.06 -0.97 0.11 0.00 0.56 0.00 0.00 36.38 36.03 1sx4 s VAL 276 CO 0.01 0.00 0.85 0.29 -0.31 0.00 0.00 175.10 175.94 1sx4 n LYS 277 N 3.06 -0.43 -1.91 4.82 5.02 -1.26 -3.59 118.16 123.87 1sx4 n LYS 277 Ca -0.15 -0.07 -0.32 0.00 -2.02 0.00 0.00 58.31 55.74 1sx4 n LYS 277 Cb 0.56 -2.17 0.02 0.00 -0.02 0.00 0.00 35.03 33.42 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 -2.54 2.69 0.23 7.82 0.00 0.27 -4.74 121.76 125.48 1sx4 s ALA 278 Ca 0.63 0.35 -0.30 0.00 0.00 0.00 0.00 51.96 52.64 1sx4 s ALA 278 Cb -0.22 -3.23 -0.09 0.00 0.00 0.00 0.00 23.12 19.58 1sx4 s ALA 278 CO 0.62 -0.95 1.13 -1.25 0.00 0.00 0.00 175.76 175.30 1sx4 s PRO 279 N -4.27 4.58 2.13 0.00 0.04 -1.26 -4.87 135.00 131.35 1sx4 s PRO 279 Ca 0.63 1.81 0.00 0.00 0.04 0.00 0.00 61.00 63.48 1sx4 s PRO 279 Cb -0.16 -3.22 0.00 0.00 0.04 0.00 0.00 34.50 31.16 1sx4 s PRO 279 CO 0.41 0.09 0.00 0.41 0.04 0.00 0.00 177.00 177.95 1sx4 n GLY 280 N 1.67 -0.44 0.00 0.56 0.00 -1.26 -4.25 105.19 101.47 1sx4 n GLY 280 Ca 0.01 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.12 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 -1.44 0.00 -0.88 1.61 -1.74 -1.26 -4.80 117.46 108.96 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 1.07 3.28 0.12 4.97 0.00 -1.26 -3.03 105.19 110.33 1sx4 n GLY 282 Ca 0.00 -0.14 -0.19 0.00 0.00 0.00 0.00 46.02 45.70 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 1.76 0.46 0.01 1.61 3.32 -2.00 -3.33 116.42 118.24 1sx4 h ASP 283 Ca 0.00 -0.67 -0.04 0.00 0.02 0.00 0.00 57.03 56.34 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 1.56 -0.08 0.08 -1.72 0.00 0.00 179.24 179.08 1sx4 h ARG 284 N 0.08 0.19 -0.46 3.56 0.11 -1.96 -3.19 114.38 112.72 1sx4 h ARG 284 Ca -0.28 -0.03 0.05 0.00 0.10 0.00 0.00 59.98 59.81 1sx4 h ARG 284 Cb 2.05 -0.03 -0.08 0.00 1.11 0.00 0.00 29.97 33.02 1sx4 h ARG 284 CO 0.16 0.29 -0.50 -0.09 0.10 0.00 0.00 179.97 179.93 1sx4 h ARG 285 N 0.18 -0.28 -0.62 0.08 2.43 -1.65 1.15 114.38 115.69 1sx4 h ARG 285 Ca 0.04 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.28 1sx4 h ARG 285 Cb 0.27 0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.83 1sx4 h ARG 285 CO 0.01 -0.18 0.35 0.87 -1.51 0.00 0.00 179.97 179.51 1sx4 h LYS 286 N -0.29 0.64 -0.59 0.20 1.57 -1.77 1.04 116.57 117.38 1sx4 h LYS 286 Ca 0.08 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 1sx4 h LYS 286 Cb 0.49 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.63 1sx4 h LYS 286 CO -0.58 0.43 0.15 0.00 -0.57 0.00 0.00 179.45 178.88 1sx4 h ALA 287 N 1.31 0.78 -0.01 3.86 0.00 -1.40 -1.93 119.26 121.87 1sx4 h ALA 287 Ca 0.27 -0.22 -0.21 0.00 0.00 0.00 0.00 54.91 54.75 1sx4 h ALA 287 Cb 0.13 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1sx4 h ALA 287 CO -0.15 0.47 -0.88 1.98 0.00 0.00 0.00 179.25 180.66 1sx4 h MET 288 N 0.85 0.32 -0.52 0.00 4.05 0.24 -2.28 114.93 117.58 1sx4 h MET 288 Ca 0.19 -0.33 -0.03 0.00 -0.28 0.00 0.00 59.70 59.25 1sx4 h MET 288 Cb 0.33 0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 31.20 1sx4 h MET 288 CO -0.00 1.02 0.19 1.25 0.23 0.00 0.00 176.91 179.60 1sx4 h LEU 289 N 0.18 0.68 -0.92 3.39 6.46 0.11 -1.88 115.31 123.34 1sx4 h LEU 289 Ca -0.06 -0.09 0.05 0.00 -0.12 0.00 0.00 57.88 57.66 1sx4 h LEU 289 Cb 1.51 -0.18 -0.06 0.00 -0.73 0.00 0.00 40.66 41.20 1sx4 h LEU 289 CO 0.15 0.63 0.59 -0.61 -0.62 0.00 0.00 178.44 178.57 1sx4 h GLN 290 N 0.74 1.08 -0.23 1.25 5.75 -0.96 -1.27 115.11 121.47 1sx4 h GLN 290 Ca 0.18 -0.07 0.06 0.00 -0.15 0.00 0.00 58.65 58.67 1sx4 h GLN 290 Cb 0.17 -0.24 -0.07 0.00 1.07 0.00 0.00 27.48 28.41 1sx4 h GLN 290 CO -0.01 0.72 -0.25 -0.44 -2.65 0.00 0.00 178.83 176.19 1sx4 h ASP 291 N 1.11 -0.80 -0.94 -0.69 3.32 -0.79 -0.92 116.42 116.72 1sx4 h ASP 291 Ca 0.38 0.14 0.07 0.00 0.02 0.00 0.00 57.03 57.64 1sx4 h ASP 291 Cb 0.07 0.37 -0.07 0.00 0.22 0.00 0.00 39.33 39.93 1sx4 h ASP 291 CO -0.14 -0.29 0.59 0.40 -1.72 0.00 0.00 179.24 178.08 1sx4 h ILE 292 N -0.26 1.05 0.31 0.35 2.04 -1.11 -0.90 117.51 118.98 1sx4 h ILE 292 Ca 0.13 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.63 1sx4 h ILE 292 Cb 0.47 -0.11 -0.04 0.00 -0.74 0.00 0.00 36.82 36.41 1sx4 h ILE 292 CO -0.38 0.19 -0.50 0.00 0.00 0.00 0.00 178.15 177.46 1sx4 h ALA 293 N 1.44 -1.03 -0.39 1.87 0.00 -0.38 -2.73 119.26 118.04 1sx4 h ALA 293 Ca 0.41 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 55.26 1sx4 h ALA 293 Cb 0.21 0.79 -0.08 0.00 0.00 0.00 0.00 17.79 18.71 1sx4 h ALA 293 CO -0.19 -1.14 -0.12 1.15 0.00 0.00 0.00 179.25 178.96 1sx4 h THR 294 N -0.87 0.56 -0.03 0.00 2.02 -0.25 0.41 112.91 114.76 1sx4 h THR 294 Ca -0.03 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.13 1sx4 h THR 294 Cb 0.81 0.56 -0.00 0.00 -1.74 0.00 0.00 68.15 67.78 1sx4 h THR 294 CO -0.17 0.00 -0.05 0.25 0.37 0.00 0.00 175.52 175.91 1sx4 h LEU 295 N -0.04 0.03 -2.02 2.58 7.12 -1.11 -2.42 115.31 119.45 1sx4 h LEU 295 Ca 0.19 -0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.20 1sx4 h LEU 295 Cb 0.32 -0.01 0.00 0.00 -0.53 0.00 0.00 40.66 40.44 1sx4 h LEU 295 CO -0.42 0.10 0.00 0.35 -0.13 0.00 0.00 178.44 178.34 1sx4 n THR 296 N -4.45 0.43 -3.45 1.05 -2.24 -0.84 -2.42 114.28 102.36 1sx4 n THR 296 Ca -0.02 -0.72 -0.18 0.00 -2.27 0.00 0.00 64.05 60.86 1sx4 n THR 296 Cb 0.15 0.89 0.09 0.00 -2.10 0.00 0.00 70.33 69.36 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 0.44 -0.38 3.73 3.38 0.00 0.13 -0.80 105.19 111.68 1sx4 n GLY 297 Ca 0.07 0.12 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 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 -4.23 2.85 -0.18 -0.02 0.00 -0.38 -4.46 107.32 100.90 1sx4 s GLY 298 Ca 0.07 -0.97 0.01 0.00 0.00 0.00 0.00 44.72 43.83 1sx4 s GLY 298 CO 0.73 -2.16 -0.20 -1.59 0.00 0.00 0.00 173.10 169.88 1sx4 s THR 299 N -2.82 2.06 0.25 0.90 2.01 0.30 -4.47 115.64 113.87 1sx4 s THR 299 Ca 0.15 -0.94 -0.31 0.00 0.31 0.00 0.00 61.69 60.90 1sx4 s THR 299 Cb 0.04 -1.85 -0.12 0.00 0.01 0.00 0.00 72.50 70.58 1sx4 s THR 299 CO 0.08 0.54 1.65 -0.69 -0.69 0.00 0.00 174.62 175.51 1sx4 s VAL 300 N 1.24 2.07 -0.67 3.82 1.01 -1.26 -4.69 120.40 121.92 1sx4 s VAL 300 Ca 0.04 0.06 -0.03 0.00 0.00 0.00 0.00 61.98 62.05 1sx4 s VAL 300 Cb -0.13 -3.04 0.17 0.00 0.00 0.00 0.00 36.38 33.38 1sx4 s VAL 300 CO -0.12 0.01 0.49 -0.63 0.00 0.00 0.00 175.10 174.85 1sx4 s ILE 301 N 0.57 3.79 0.02 2.22 1.01 -0.57 -4.98 121.20 123.26 1sx4 s ILE 301 Ca 0.69 -3.13 0.05 0.00 0.00 0.00 0.00 60.65 58.25 1sx4 s ILE 301 Cb -0.48 -3.45 -0.03 0.00 0.01 0.00 0.00 42.46 38.50 1sx4 s ILE 301 CO 0.40 -0.91 -0.13 -0.94 0.00 0.00 0.00 174.94 173.36 1sx4 s SER 302 N 0.50 4.18 0.00 3.58 1.04 -1.26 -2.49 113.70 119.24 1sx4 s SER 302 Ca 0.19 -0.28 0.16 0.00 0.48 0.00 0.00 55.95 56.49 1sx4 s SER 302 Cb -0.18 -0.84 0.93 0.00 0.10 0.00 0.00 66.02 66.03 1sx4 s SER 302 CO -0.05 0.27 1.35 -0.62 0.98 0.00 0.00 173.24 175.18 1sx4 n GLU 303 N 1.61 0.56 0.12 4.02 1.02 -1.26 -3.02 120.64 123.69 1sx4 n GLU 303 Ca -0.16 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.75 1sx4 n GLU 303 Cb 0.52 -1.43 -0.15 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 0.57 -0.44 3.49 5.08 -1.90 -3.01 114.58 118.36 1sx4 h GLU 304 Ca 0.00 -0.87 0.00 0.00 -1.00 0.00 0.00 59.36 57.49 1sx4 h GLU 304 Cb 0.00 0.31 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1sx4 h GLU 304 CO 0.00 1.40 0.00 -0.89 -1.00 0.00 0.00 179.01 178.52 1sx4 n ILE 305 N -3.78 0.32 -2.95 3.13 5.41 -1.17 -4.90 119.36 115.42 1sx4 n ILE 305 Ca -0.15 -0.22 -0.05 0.00 1.00 0.00 0.00 62.75 63.33 1sx4 n ILE 305 Cb 1.03 -0.12 0.02 0.00 -0.71 0.00 0.00 39.64 39.87 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 0.49 -1.07 3.27 7.39 0.00 -1.14 -5.05 105.19 109.08 1sx4 n GLY 306 Ca 0.05 0.43 -0.21 0.00 0.00 0.00 0.00 46.02 46.29 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 -3.45 1.08 -0.03 1.61 -1.94 -1.18 -5.02 119.30 110.37 1sx4 s MET 307 Ca 0.15 -1.19 0.06 0.00 -1.71 0.00 0.00 55.69 53.00 1sx4 s MET 307 Cb -0.02 -1.18 -0.01 0.00 2.01 0.00 0.00 34.83 35.63 1sx4 s MET 307 CO 0.66 0.26 -0.21 -1.21 -0.01 0.00 0.00 175.02 174.51 1sx4 s GLU 308 N -2.21 1.86 0.22 2.03 2.02 -1.26 -4.19 118.70 117.17 1sx4 s GLU 308 Ca 0.07 -0.75 -0.09 0.00 0.02 0.00 0.00 54.97 54.23 1sx4 s GLU 308 Cb -0.08 -1.71 0.33 0.00 0.10 0.00 0.00 34.13 32.76 1sx4 s GLU 308 CO 0.04 0.40 1.70 -0.07 0.02 0.00 0.00 175.26 177.35 1sx4 h LEU 309 N 5.82 -0.02 -0.82 1.80 3.38 -1.91 -2.20 115.31 121.36 1sx4 h LEU 309 Ca -0.37 0.12 0.17 0.00 0.09 0.00 0.00 57.88 57.90 1sx4 h LEU 309 Cb 1.15 0.17 -0.11 0.00 0.09 0.00 0.00 40.66 41.96 1sx4 h LEU 309 CO 0.48 -0.01 0.34 -0.33 0.09 0.00 0.00 178.44 179.00 1sx4 h GLU 310 N 0.25 0.42 -3.47 1.13 3.07 -1.86 -2.37 114.58 111.74 1sx4 h GLU 310 Ca 0.34 -0.03 -0.76 0.00 -0.50 0.00 0.00 59.36 58.41 1sx4 h GLU 310 Cb 0.52 -0.09 -0.15 0.00 -0.84 0.00 0.00 28.75 28.18 1sx4 h GLU 310 CO -0.43 0.28 2.06 1.63 -1.40 0.00 0.00 179.01 181.14 1sx4 n LYS 311 N -5.02 3.64 -3.50 2.33 5.02 -0.83 -4.75 118.16 115.05 1sx4 n LYS 311 Ca 0.18 -3.51 -0.19 0.00 -2.02 0.00 0.00 58.31 52.76 1sx4 n LYS 311 Cb 0.51 -2.92 -0.13 0.00 -0.02 0.00 0.00 35.03 32.47 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 0.37 -0.19 0.90 7.82 0.00 -0.89 -4.70 121.76 125.06 1sx4 s ALA 312 Ca 0.40 0.14 -0.13 0.00 0.00 0.00 0.00 51.96 52.37 1sx4 s ALA 312 Cb 0.10 -1.32 0.14 0.00 0.00 0.00 0.00 23.12 22.03 1sx4 s ALA 312 CO 0.00 -1.24 1.18 0.95 0.00 0.00 0.00 175.76 176.65 1sx4 s THR 313 N 2.30 1.98 0.38 0.00 -4.23 -1.26 -4.56 115.64 110.25 1sx4 s THR 313 Ca 0.07 0.00 0.19 0.00 -1.18 0.00 0.00 61.69 60.76 1sx4 s THR 313 Cb -0.16 -2.86 0.38 0.00 1.34 0.00 0.00 72.50 71.20 1sx4 s THR 313 CO -0.13 0.00 1.70 -0.07 -0.54 0.00 0.00 174.62 175.57 1sx4 h LEU 314 N -1.43 0.45 -1.12 4.79 3.38 -1.93 -2.51 115.31 116.93 1sx4 h LEU 314 Ca -0.48 0.14 0.12 0.00 0.09 0.00 0.00 57.88 57.75 1sx4 h LEU 314 Cb 1.31 0.08 -0.08 0.00 0.09 0.00 0.00 40.66 42.07 1sx4 h LEU 314 CO 0.58 -0.05 0.61 -0.08 0.09 0.00 0.00 178.44 179.59 1sx4 h GLU 315 N 0.32 0.87 0.00 1.13 4.81 -2.00 -1.13 114.58 118.58 1sx4 h GLU 315 Ca 0.70 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.85 1sx4 h GLU 315 Cb 1.77 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 30.95 1sx4 h GLU 315 CO -0.45 0.58 -0.15 -0.44 -0.73 0.00 0.00 179.01 177.82 1sx4 h ASP 316 N 0.90 0.00 -3.61 1.04 3.32 -1.81 -3.44 116.42 112.81 1sx4 h ASP 316 Ca 0.47 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 57.00 1sx4 h ASP 316 Cb 0.53 0.00 0.05 0.00 0.22 0.00 0.00 39.33 40.12 1sx4 h ASP 316 CO -0.23 0.15 0.64 -0.76 -1.72 0.00 0.00 179.24 177.32 1sx4 s LEU 317 N -7.91 4.43 1.08 1.55 1.02 -0.43 0.11 118.68 118.53 1sx4 s LEU 317 Ca -0.03 2.53 -0.15 0.00 0.02 0.00 0.00 54.13 56.49 1sx4 s LEU 317 Cb 0.14 -3.63 0.23 0.00 0.02 0.00 0.00 46.19 42.96 1sx4 s LEU 317 CO 0.63 -0.51 1.10 -0.83 0.02 0.00 0.00 176.35 176.76 1sx4 s GLY 318 N -0.08 1.57 -0.01 -3.19 0.00 0.54 -4.41 107.32 101.74 1sx4 s GLY 318 Ca 0.53 -0.60 -0.16 0.00 0.00 0.00 0.00 44.72 44.49 1sx4 s GLY 318 CO 0.44 0.12 0.34 1.62 0.00 0.00 0.00 173.10 175.62 1sx4 s GLN 319 N -5.13 0.71 0.34 2.90 0.74 0.02 0.70 119.66 119.95 1sx4 s GLN 319 Ca 0.67 -0.20 0.02 0.00 0.05 0.00 0.00 55.36 55.91 1sx4 s GLN 319 Cb -0.15 0.32 -0.01 0.00 1.10 0.00 0.00 33.01 34.26 1sx4 s GLN 319 CO 0.57 -0.20 0.40 0.00 -0.55 0.00 0.00 175.29 175.51 1sx4 s ALA 320 N -1.46 1.25 -0.16 1.58 0.00 -1.10 -1.92 121.76 119.95 1sx4 s ALA 320 Ca -0.12 -1.77 0.18 0.00 0.00 0.00 0.00 51.96 50.25 1sx4 s ALA 320 Cb -0.04 1.29 -0.08 0.00 0.00 0.00 0.00 23.12 24.28 1sx4 s ALA 320 CO 0.04 -0.74 0.93 0.87 0.00 0.00 0.00 175.76 176.86 1sx4 h LYS 321 N 2.11 0.00 -1.61 0.00 1.57 -1.28 -3.18 116.57 114.18 1sx4 h LYS 321 Ca -0.27 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.57 1sx4 h LYS 321 Cb 1.24 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 33.31 1sx4 h LYS 321 CO 0.38 0.21 0.48 1.03 -0.57 0.00 0.00 179.45 180.97 1sx4 s ARG 322 N -3.06 0.59 0.03 3.15 0.52 -1.19 -1.06 118.95 117.93 1sx4 s ARG 322 Ca -0.02 0.35 0.03 0.00 -0.52 0.00 0.00 55.73 55.57 1sx4 s ARG 322 Cb 0.09 0.28 -0.02 0.00 0.52 0.00 0.00 34.95 35.82 1sx4 s ARG 322 CO 0.80 -0.14 -0.09 0.14 0.02 0.00 0.00 175.30 176.03 1sx4 s VAL 323 N -0.55 0.64 -0.11 3.52 -7.23 0.32 -0.79 120.40 116.21 1sx4 s VAL 323 Ca -0.00 -0.90 -0.01 0.00 -1.81 0.00 0.00 61.98 59.25 1sx4 s VAL 323 Cb -0.02 -0.65 0.03 0.00 0.56 0.00 0.00 36.38 36.30 1sx4 s VAL 323 CO -0.01 -0.21 -0.02 -0.69 -0.31 0.00 0.00 175.10 173.86 1sx4 s VAL 324 N -1.03 0.63 -0.05 1.32 1.01 -0.11 -1.97 120.40 120.20 1sx4 s VAL 324 Ca -0.05 -0.13 0.03 0.00 0.00 0.00 0.00 61.98 61.82 1sx4 s VAL 324 Cb -0.08 -0.79 0.01 0.00 0.00 0.00 0.00 36.38 35.52 1sx4 s VAL 324 CO 0.01 0.22 -0.12 0.27 0.00 0.00 0.00 175.10 175.48 1sx4 s ILE 325 N 1.86 1.09 0.00 2.22 -4.36 0.08 -0.54 121.20 121.56 1sx4 s ILE 325 Ca 0.04 -0.48 0.00 0.00 -0.26 0.00 0.00 60.65 59.95 1sx4 s ILE 325 Cb -0.13 -0.99 0.00 0.00 1.25 0.00 0.00 42.46 42.59 1sx4 s ILE 325 CO -0.07 0.34 0.00 0.59 0.24 0.00 0.00 174.94 176.04 1sx4 n ASN 326 N 3.65 0.51 -0.01 4.36 3.02 0.11 -0.18 115.26 126.72 1sx4 n ASN 326 Ca -0.22 -0.50 0.07 0.00 -0.03 0.00 0.00 54.58 53.90 1sx4 n ASN 326 Cb 0.52 0.00 0.47 0.00 -0.61 0.00 0.00 39.78 40.16 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 0.44 -0.06 3.52 3.64 -1.92 -2.93 116.57 119.26 1sx4 h LYS 327 Ca 0.00 -0.03 -0.17 0.00 -1.27 0.00 0.00 60.65 59.18 1sx4 h LYS 327 Cb 0.00 -0.10 -0.31 0.00 -0.41 0.00 0.00 32.23 31.41 1sx4 h LYS 327 CO 0.00 0.29 -0.82 -0.40 -2.27 0.00 0.00 179.45 176.25 1sx4 n ASP 328 N -4.48 0.43 -3.34 4.20 5.68 -1.26 -3.69 116.55 114.09 1sx4 n ASP 328 Ca 0.05 -2.02 -0.10 0.00 -0.50 0.00 0.00 54.79 52.23 1sx4 n ASP 328 Cb 0.17 -0.12 -0.07 0.00 -1.14 0.00 0.00 41.12 39.96 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 -0.48 -0.60 0.15 2.12 2.01 -1.10 -2.67 115.64 115.07 1sx4 s THR 329 Ca 0.23 -0.18 -0.16 0.00 0.31 0.00 0.00 61.69 61.89 1sx4 s THR 329 Cb 0.29 -0.88 -0.07 0.00 0.01 0.00 0.00 72.50 71.84 1sx4 s THR 329 CO -0.11 -0.20 0.59 -0.89 -0.69 0.00 0.00 174.62 173.32 1sx4 s THR 330 N 2.53 4.77 -0.14 -0.82 2.01 0.39 -0.71 115.64 123.68 1sx4 s THR 330 Ca 0.11 0.99 -0.06 0.00 0.31 0.00 0.00 61.69 63.04 1sx4 s THR 330 Cb -0.14 -3.79 0.06 0.00 0.01 0.00 0.00 72.50 68.64 1sx4 s THR 330 CO -0.22 0.28 0.31 0.28 -0.69 0.00 0.00 174.62 174.58 1sx4 s THR 331 N -1.42 -0.21 -0.21 -0.82 -1.32 0.30 -1.10 115.64 110.86 1sx4 s THR 331 Ca 0.38 0.18 -0.13 0.00 -1.21 0.00 0.00 61.69 60.90 1sx4 s THR 331 Cb -0.16 -0.48 -0.05 0.00 -1.51 0.00 0.00 72.50 70.30 1sx4 s THR 331 CO 0.19 0.07 0.25 -0.63 -2.21 0.00 0.00 174.62 172.29 1sx4 s ILE 332 N 1.77 5.31 -0.29 5.08 1.01 -0.89 -0.93 121.20 132.26 1sx4 s ILE 332 Ca -0.06 0.40 -0.10 0.00 0.00 0.00 0.00 60.65 60.89 1sx4 s ILE 332 Cb -0.11 -3.58 -0.03 0.00 0.01 0.00 0.00 42.46 38.75 1sx4 s ILE 332 CO -0.10 0.34 0.16 -0.63 0.00 0.00 0.00 174.94 174.71 1sx4 s ILE 333 N 0.95 4.89 -0.29 2.92 1.01 0.03 -4.05 121.20 126.66 1sx4 s ILE 333 Ca 0.12 -0.11 -0.02 0.00 0.00 0.00 0.00 60.65 60.65 1sx4 s ILE 333 Cb -0.13 -3.39 0.01 0.00 0.01 0.00 0.00 42.46 38.95 1sx4 s ILE 333 CO 0.05 0.19 0.03 -0.67 0.00 0.00 0.00 174.94 174.54 1sx4 n ASP 334 N 5.02 -7.11 -4.88 3.58 2.03 -1.26 -2.88 116.55 111.05 1sx4 n ASP 334 Ca -0.14 1.44 -0.30 0.00 0.52 0.00 0.00 54.79 56.30 1sx4 n ASP 334 Cb 0.51 -5.35 -0.04 0.00 -0.72 0.00 0.00 41.12 35.52 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 -1.52 2.02 0.50 0.27 0.00 -1.26 -2.12 107.32 105.22 1sx4 s GLY 335 Ca -0.04 -0.23 0.29 0.00 0.00 0.00 0.00 44.72 44.75 1sx4 s GLY 335 CO 0.79 -0.06 1.89 -2.08 0.00 0.00 0.00 173.10 173.65 1sx4 h VAL 336 N 1.37 0.20 -1.62 1.40 2.07 -1.39 -3.46 116.25 114.82 1sx4 h VAL 336 Ca -0.47 -0.78 -0.71 0.00 0.82 0.00 0.00 66.70 65.56 1sx4 h VAL 336 Cb 1.18 1.65 0.03 0.00 -1.52 0.00 0.00 31.29 32.63 1sx4 h VAL 336 CO 0.65 0.08 0.77 0.61 0.02 0.00 0.00 177.57 179.71 1sx4 n GLY 337 N 0.17 0.78 3.77 2.17 0.00 -1.02 -4.83 105.19 106.23 1sx4 n GLY 337 Ca 0.01 0.85 -0.40 0.00 0.00 0.00 0.00 46.02 46.48 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 2.60 3.89 0.00 1.61 2.02 -1.26 -4.81 118.70 122.75 1sx4 s GLU 338 Ca 0.94 2.35 0.10 0.00 0.02 0.00 0.00 54.97 58.38 1sx4 s GLU 338 Cb -1.01 -2.77 0.42 0.00 0.10 0.00 0.00 34.13 30.87 1sx4 s GLU 338 CO 0.59 -0.63 1.31 0.39 0.02 0.00 0.00 175.26 176.94 1sx4 n GLU 339 N 0.08 0.00 0.27 1.61 1.02 -1.26 -1.33 120.64 121.02 1sx4 n GLU 339 Ca 0.04 0.34 -0.16 0.00 -0.02 0.00 0.00 57.16 57.35 1sx4 n GLU 339 Cb 0.42 -1.51 -0.08 0.00 -0.02 0.00 0.00 31.44 30.25 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 2.33 -0.65 -0.06 0.62 0.00 -1.99 0.37 119.26 119.90 1sx4 h ALA 340 Ca 0.00 -0.14 -0.19 0.00 0.00 0.00 0.00 54.91 54.58 1sx4 h ALA 340 Cb 0.17 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1sx4 h ALA 340 CO 0.00 -0.87 -0.79 0.00 0.00 0.00 0.00 179.25 177.59 1sx4 h ALA 341 N -0.11 0.53 0.76 0.00 0.00 -1.58 -2.67 119.26 116.19 1sx4 h ALA 341 Ca -0.06 -0.64 -0.04 0.00 0.00 0.00 0.00 54.91 54.18 1sx4 h ALA 341 Cb 0.51 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.26 1sx4 h ALA 341 CO 0.08 0.78 -0.37 0.82 0.00 0.00 0.00 179.25 180.57 1sx4 h ILE 342 N 0.26 0.25 -0.67 0.00 2.04 -1.36 -2.04 117.51 115.99 1sx4 h ILE 342 Ca -0.04 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.90 1sx4 h ILE 342 Cb 1.38 0.25 -0.04 0.00 -0.74 0.00 0.00 36.82 37.67 1sx4 h ILE 342 CO 0.13 0.00 0.44 -0.61 0.00 0.00 0.00 178.15 178.12 1sx4 h GLN 343 N -1.02 0.56 0.31 2.37 5.75 -0.99 -1.83 115.11 120.25 1sx4 h GLN 343 Ca -0.10 -0.03 -0.02 0.00 -0.15 0.00 0.00 58.65 58.35 1sx4 h GLN 343 Cb 0.78 -0.13 0.00 0.00 1.07 0.00 0.00 27.48 29.21 1sx4 h GLN 343 CO 0.17 0.37 -0.15 0.78 -2.65 0.00 0.00 178.83 177.35 1sx4 h GLY 344 N 0.57 -0.43 2.00 2.39 0.00 -1.35 -1.42 103.07 104.83 1sx4 h GLY 344 Ca 0.30 0.16 -0.00 0.00 0.00 0.00 0.00 47.33 47.79 1sx4 h GLY 344 CO -0.10 -0.16 -0.01 -0.09 0.00 0.00 0.00 176.54 176.19 1sx4 h ARG 345 N -0.74 0.00 -0.14 4.80 9.65 -1.09 -0.41 114.38 126.44 1sx4 h ARG 345 Ca -0.04 0.00 -0.18 0.00 -1.10 0.00 0.00 59.98 58.65 1sx4 h ARG 345 Cb 0.50 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.08 1sx4 h ARG 345 CO 0.07 0.01 -0.67 0.28 2.80 0.00 0.00 179.97 182.46 1sx4 h VAL 346 N 0.00 1.33 0.00 0.20 2.07 -1.29 -2.68 116.25 115.88 1sx4 h VAL 346 Ca -0.00 -1.97 0.00 0.00 0.82 0.00 0.00 66.70 65.55 1sx4 h VAL 346 Cb 0.01 1.94 0.00 0.00 -1.52 0.00 0.00 31.29 31.72 1sx4 h VAL 346 CO 0.00 0.61 0.00 0.00 0.02 0.00 0.00 177.57 178.20 1sx4 n ALA 347 N -2.53 1.69 -0.08 1.67 0.00 -0.22 -1.30 120.51 119.73 1sx4 n ALA 347 Ca -0.04 0.06 -0.15 0.00 0.00 0.00 0.00 53.44 53.31 1sx4 n ALA 347 Cb 0.68 -1.37 -0.10 0.00 0.00 0.00 0.00 19.45 18.65 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 -1.28 -3.35 115.11 114.68 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 0.37 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.15 1sx4 h GLN 348 CO 0.00 0.81 0.00 -0.89 -0.67 0.00 0.00 178.83 178.08 1sx4 n ILE 349 N -4.55 0.95 -0.07 2.54 5.41 -1.02 -1.85 119.36 120.78 1sx4 n ILE 349 Ca -0.19 0.24 -0.10 0.00 1.00 0.00 0.00 62.75 63.71 1sx4 n ILE 349 Cb 0.50 -1.00 -0.03 0.00 -0.71 0.00 0.00 39.64 38.41 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 0.34 -0.01 0.38 9.65 -1.32 -3.20 114.38 120.22 1sx4 h ARG 350 Ca 0.00 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 1sx4 h ARG 350 Cb 0.22 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 28.72 1sx4 h ARG 350 CO 0.00 0.25 -0.28 1.04 2.80 0.00 0.00 179.97 183.78 1sx4 n GLN 351 N -4.89 0.80 -0.22 0.20 6.02 -0.77 -3.75 117.38 114.77 1sx4 n GLN 351 Ca -0.02 -0.48 -0.07 0.00 -0.01 0.00 0.00 57.00 56.42 1sx4 n GLN 351 Cb 0.04 -1.49 0.08 0.00 1.02 0.00 0.00 30.24 29.89 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 1.17 1.05 -0.14 -1.09 1.08 -1.50 -2.70 115.11 112.98 1sx4 h GLN 352 Ca 0.00 -0.27 -0.19 0.00 -1.45 0.00 0.00 58.65 56.74 1sx4 h GLN 352 Cb 0.51 -0.13 -0.00 0.00 -0.05 0.00 0.00 27.48 27.81 1sx4 h GLN 352 CO 0.00 0.96 -0.69 0.82 -0.95 0.00 0.00 178.83 178.97 1sx4 h ILE 353 N 0.99 1.33 -0.91 2.54 2.04 -1.65 -0.79 117.51 121.06 1sx4 h ILE 353 Ca 0.20 -1.99 0.03 0.00 1.00 0.00 0.00 64.86 64.11 1sx4 h ILE 353 Cb 0.41 1.96 -0.05 0.00 -0.74 0.00 0.00 36.82 38.40 1sx4 h ILE 353 CO 0.01 0.61 0.60 -0.33 0.00 0.00 0.00 178.15 179.04 1sx4 h GLU 354 N 0.41 1.13 -0.48 2.37 4.39 -1.62 -2.81 114.58 117.97 1sx4 h GLU 354 Ca -0.02 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.61 1sx4 h GLU 354 Cb 1.27 -0.25 0.00 0.00 -0.10 0.00 0.00 28.75 29.67 1sx4 h GLU 354 CO 0.13 0.75 0.00 0.39 -1.16 0.00 0.00 179.01 179.12 1sx4 n GLU 355 N -4.50 3.12 -2.21 2.33 1.02 -1.03 -4.87 120.64 114.50 1sx4 n GLU 355 Ca 0.12 -2.52 -0.36 0.00 -0.02 0.00 0.00 57.16 54.37 1sx4 n GLU 355 Cb 0.08 -1.59 -0.04 0.00 -0.02 0.00 0.00 31.44 29.87 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 -1.55 2.21 -2.00 0.62 0.00 -0.30 -4.83 121.76 115.90 1sx4 s ALA 356 Ca 0.39 -1.23 0.15 0.00 0.00 0.00 0.00 51.96 51.26 1sx4 s ALA 356 Cb 0.24 -4.40 0.88 0.00 0.00 0.00 0.00 23.12 19.85 1sx4 s ALA 356 CO 0.20 -4.00 1.40 0.25 0.00 0.00 0.00 175.76 173.61 1sx4 n THR 357 N 7.20 0.00 -4.68 0.00 -2.24 -1.26 -4.81 114.28 108.49 1sx4 n THR 357 Ca 0.24 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.71 1sx4 n THR 357 Cb 0.50 -0.42 -0.08 0.00 -2.10 0.00 0.00 70.33 68.23 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 -1.70 4.12 -0.19 3.42 0.15 -1.26 -5.08 113.70 113.15 1sx4 s SER 358 Ca 0.22 -1.57 0.02 0.00 0.70 0.00 0.00 55.95 55.32 1sx4 s SER 358 Cb 0.10 0.33 -0.22 0.00 -1.71 0.00 0.00 66.02 64.52 1sx4 s SER 358 CO 0.17 -0.79 0.08 0.47 1.20 0.00 0.00 173.24 174.38 1sx4 n ASP 359 N -1.24 1.70 0.08 5.45 8.00 -1.26 -4.35 116.55 124.94 1sx4 n ASP 359 Ca -0.15 0.04 -0.11 0.00 0.71 0.00 0.00 54.79 55.27 1sx4 n ASP 359 Cb 0.67 -0.36 -0.04 0.00 -0.02 0.00 0.00 41.12 41.36 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 0.44 0.00 1.24 3.20 -1.98 -3.19 116.97 116.70 1sx4 h TYR 360 Ca -0.50 -0.25 0.00 0.00 3.14 0.00 0.00 58.73 61.12 1sx4 h TYR 360 Cb 2.00 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 40.22 1sx4 h TYR 360 CO 0.04 1.08 0.00 -0.25 -1.64 0.00 0.00 178.16 177.39 1sx4 n ASP 361 N -3.67 0.00 -0.09 -2.11 9.92 -1.26 -3.28 116.55 116.06 1sx4 n ASP 361 Ca -0.05 -0.44 -0.13 0.00 -0.53 0.00 0.00 54.79 53.64 1sx4 n ASP 361 Cb 0.85 0.00 -0.08 0.00 -0.64 0.00 0.00 41.12 41.25 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 -1.00 0.43 0.17 -1.24 0.63 -1.21 -4.36 116.66 110.08 1sx4 n ARG 362 Ca 0.10 0.11 -0.15 0.00 -0.92 0.00 0.00 57.85 57.00 1sx4 n ARG 362 Cb 0.05 -1.32 -0.07 0.00 0.45 0.00 0.00 32.46 31.57 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 -0.11 -0.65 -0.59 -0.14 4.39 -1.54 -2.54 114.58 113.39 1sx4 h GLU 363 Ca -0.40 0.04 0.04 0.00 0.34 0.00 0.00 59.36 59.38 1sx4 h GLU 363 Cb 1.57 0.15 -0.05 0.00 -0.10 0.00 0.00 28.75 30.32 1sx4 h GLU 363 CO -0.10 -0.43 0.33 0.87 -1.16 0.00 0.00 179.01 178.52 1sx4 h LYS 364 N -0.68 0.61 -0.31 2.33 1.79 -1.83 -1.61 116.57 116.88 1sx4 h LYS 364 Ca 0.00 -0.04 -0.00 0.00 -2.18 0.00 0.00 60.65 58.43 1sx4 h LYS 364 Cb 0.66 -0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 31.16 1sx4 h LYS 364 CO -0.15 0.41 0.19 -0.07 -1.08 0.00 0.00 179.45 178.74 1sx4 h LEU 365 N 0.63 0.37 -1.54 2.94 3.38 -1.75 -1.41 115.31 117.94 1sx4 h LEU 365 Ca 0.25 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 1sx4 h LEU 365 Cb 0.11 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1sx4 h LEU 365 CO -0.14 0.32 0.10 1.56 0.09 0.00 0.00 178.44 180.36 1sx4 h GLN 366 N 0.40 0.40 0.97 1.13 4.20 -1.12 -0.53 115.11 120.56 1sx4 h GLN 366 Ca 0.11 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.73 1sx4 h GLN 366 Cb 0.01 -0.08 0.01 0.00 0.30 0.00 0.00 27.48 27.73 1sx4 h GLN 366 CO -0.02 0.35 -0.46 0.93 -0.67 0.00 0.00 178.83 178.95 1sx4 h GLU 367 N 0.40 -1.25 -0.81 1.46 5.08 -0.78 -2.80 114.58 115.88 1sx4 h GLU 367 Ca 0.10 0.09 0.14 0.00 -1.00 0.00 0.00 59.36 58.68 1sx4 h GLU 367 Cb 0.11 0.28 -0.09 0.00 0.50 0.00 0.00 28.75 29.55 1sx4 h GLU 367 CO -0.01 -0.83 0.40 0.00 -1.00 0.00 0.00 179.01 177.56 1sx4 h ARG 368 N -1.32 0.57 -0.93 2.33 3.08 -0.92 0.11 114.38 117.30 1sx4 h ARG 368 Ca -0.13 -0.03 0.13 0.00 0.07 0.00 0.00 59.98 60.01 1sx4 h ARG 368 Cb 1.00 -0.13 -0.09 0.00 0.08 0.00 0.00 29.97 30.83 1sx4 h ARG 368 CO 0.22 0.37 0.55 -0.39 -1.07 0.00 0.00 179.97 179.66 1sx4 h VAL 369 N 0.58 0.85 -0.18 2.04 -1.51 -1.04 -0.97 116.25 116.03 1sx4 h VAL 369 Ca 0.44 -0.29 -0.20 0.00 -1.23 0.00 0.00 66.70 65.42 1sx4 h VAL 369 Cb 0.61 -0.07 0.00 0.00 -2.13 0.00 0.00 31.29 29.70 1sx4 h VAL 369 CO -0.36 0.15 -0.67 0.00 -1.23 0.00 0.00 177.57 175.46 1sx4 h ALA 370 N 1.54 0.47 0.00 5.19 0.00 -0.55 0.54 119.26 126.45 1sx4 h ALA 370 Ca 0.48 -0.57 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1sx4 h ALA 370 Cb 0.55 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1sx4 h ALA 370 CO -0.30 0.70 -0.10 0.87 0.00 0.00 0.00 179.25 180.43 1sx4 h LYS 371 N 0.51 0.00 0.00 0.00 1.57 -0.34 -2.97 116.57 115.33 1sx4 h LYS 371 Ca -0.02 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.41 1sx4 h LYS 371 Cb 1.27 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.52 1sx4 h LYS 371 CO 0.14 0.10 -2.32 1.28 -0.57 0.00 0.00 179.45 178.07 1sx4 n LEU 372 N -3.32 0.09 0.00 2.94 4.77 -0.46 -3.65 117.00 117.37 1sx4 n LEU 372 Ca -0.01 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1sx4 n LEU 372 Cb 0.30 0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.82 1sx4 n LEU 372 CO 0.29 0.49 0.00 0.00 -1.33 0.00 0.00 177.39 176.84 1sx4 n ALA 373 N -2.73 0.08 -1.32 -1.18 0.00 0.19 -5.02 120.51 110.52 1sx4 n ALA 373 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.12 1sx4 n ALA 373 Cb 1.12 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.57 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 2.94 0.74 3.28 0.00 0.00 -1.13 -4.97 105.19 106.05 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 1.66 -0.11 -0.02 0.00 -1.16 -4.19 107.32 103.50 1sx4 s GLY 375 Ca 0.00 -1.80 -0.02 0.00 0.00 0.00 0.00 44.72 42.90 1sx4 s GLY 375 CO 0.00 -1.52 -0.01 0.14 0.00 0.00 0.00 173.10 171.70 1sx4 s VAL 376 N -3.89 4.15 0.01 1.40 1.01 -1.22 -3.64 120.40 118.22 1sx4 s VAL 376 Ca 0.38 -0.29 0.05 0.00 0.00 0.00 0.00 61.98 62.12 1sx4 s VAL 376 Cb 0.07 -2.77 -0.02 0.00 0.00 0.00 0.00 36.38 33.67 1sx4 s VAL 376 CO 0.14 0.56 -0.15 0.00 0.00 0.00 0.00 175.10 175.65 1sx4 s ALA 377 N -0.44 1.26 -0.07 5.51 0.00 -0.60 -1.48 121.76 125.93 1sx4 s ALA 377 Ca 0.08 -0.73 0.05 0.00 0.00 0.00 0.00 51.96 51.36 1sx4 s ALA 377 Cb -0.12 -0.28 -0.01 0.00 0.00 0.00 0.00 23.12 22.71 1sx4 s ALA 377 CO 0.02 0.29 -0.25 0.08 0.00 0.00 0.00 175.76 175.90 1sx4 s VAL 378 N -0.53 2.04 -0.11 0.00 1.01 -0.29 -1.80 120.40 120.72 1sx4 s VAL 378 Ca 0.05 -1.04 -0.05 0.00 0.00 0.00 0.00 61.98 60.93 1sx4 s VAL 378 Cb -0.07 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 1sx4 s VAL 378 CO 0.00 0.56 0.08 -0.63 0.00 0.00 0.00 175.10 175.11 1sx4 s ILE 379 N 0.01 4.96 -0.21 2.22 1.01 0.10 -1.49 121.20 127.80 1sx4 s ILE 379 Ca -0.09 0.00 -0.04 0.00 0.00 0.00 0.00 60.65 60.53 1sx4 s ILE 379 Cb -0.15 -3.14 -0.01 0.00 0.01 0.00 0.00 42.46 39.17 1sx4 s ILE 379 CO 0.05 0.60 -0.05 -0.54 0.00 0.00 0.00 174.94 175.01 1sx4 s LYS 380 N -0.83 3.39 -0.11 2.79 1.02 0.11 -1.69 119.74 124.41 1sx4 s LYS 380 Ca 0.13 -0.62 -0.26 0.00 0.02 0.00 0.00 55.97 55.24 1sx4 s LYS 380 Cb -0.12 -2.99 -0.02 0.00 -0.52 0.00 0.00 37.83 34.18 1sx4 s LYS 380 CO 0.03 -0.17 0.83 0.08 -0.92 0.00 0.00 175.35 175.20 1sx4 s VAL 381 N 1.40 4.92 0.22 3.17 1.01 -1.14 -0.63 120.40 129.35 1sx4 s VAL 381 Ca 0.05 1.67 -0.10 0.00 0.00 0.00 0.00 61.98 63.60 1sx4 s VAL 381 Cb -0.14 -4.15 -0.07 0.00 0.00 0.00 0.00 36.38 32.02 1sx4 s VAL 381 CO -0.03 0.11 0.54 -0.83 0.00 0.00 0.00 175.10 174.89 1sx4 s GLY 382 N 1.04 2.29 -0.17 4.51 0.00 -1.25 -1.87 107.32 111.87 1sx4 s GLY 382 Ca 0.41 -0.27 -0.30 0.00 0.00 0.00 0.00 44.72 44.55 1sx4 s GLY 382 CO 0.17 -0.13 0.99 0.00 0.00 0.00 0.00 173.10 174.12 1sx4 s ALA 383 N -1.79 -1.93 0.08 3.20 0.00 -1.20 -4.82 121.76 115.31 1sx4 s ALA 383 Ca 0.47 1.60 -0.15 0.00 0.00 0.00 0.00 51.96 53.88 1sx4 s ALA 383 Cb -0.11 -0.74 -0.14 0.00 0.00 0.00 0.00 23.12 22.12 1sx4 s ALA 383 CO 0.21 -0.30 1.31 0.00 0.00 0.00 0.00 175.76 176.98 1sx4 h ALA 384 N 2.72 0.31 -5.23 0.00 0.00 -1.87 -3.43 119.26 111.77 1sx4 h ALA 384 Ca -0.19 -0.52 -0.60 0.00 0.00 0.00 0.00 54.91 53.59 1sx4 h ALA 384 Cb 1.16 -0.03 -0.10 0.00 0.00 0.00 0.00 17.79 18.82 1sx4 h ALA 384 CO 0.30 0.54 -0.40 0.25 0.00 0.00 0.00 179.25 179.94 1sx4 n THR 385 N -4.11 0.00 -0.02 0.00 -2.24 -1.26 -5.04 114.28 101.61 1sx4 n THR 385 Ca -0.07 -2.21 -0.19 0.00 -2.27 0.00 0.00 64.05 59.32 1sx4 n THR 385 Cb 0.63 0.30 -0.14 0.00 -2.10 0.00 0.00 70.33 69.03 1sx4 n THR 385 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1sx4 n GLU 386 N -1.35 0.73 -0.13 -0.78 2.13 -1.26 -2.33 120.64 117.64 1sx4 n GLU 386 Ca -0.15 0.25 0.26 0.00 0.66 0.00 0.00 57.16 58.18 1sx4 n GLU 386 Cb 0.60 -1.70 0.71 0.00 0.27 0.00 0.00 31.44 31.33 1sx4 n GLU 386 CO 0.00 0.00 0.00 -0.39 -0.41 0.00 0.00 177.13 176.33 1sx4 h VAL 387 N 0.05 0.60 0.04 6.31 -1.51 -1.98 -2.36 116.25 117.41 1sx4 h VAL 387 Ca -0.42 -0.00 -0.18 0.00 -1.23 0.00 0.00 66.70 64.87 1sx4 h VAL 387 Cb 2.02 0.60 -0.01 0.00 -2.13 0.00 0.00 31.29 31.77 1sx4 h VAL 387 CO 0.07 0.00 -0.92 -0.08 -1.23 0.00 0.00 177.57 175.40 1sx4 h GLU 388 N 0.01 0.09 -0.21 5.19 4.81 -1.97 -3.29 114.58 119.21 1sx4 h GLU 388 Ca 0.38 -0.16 0.06 0.00 -0.13 0.00 0.00 59.36 59.51 1sx4 h GLU 388 Cb 1.52 0.06 -0.07 0.00 0.63 0.00 0.00 28.75 30.88 1sx4 h GLU 388 CO -0.01 1.08 -0.33 1.98 -0.73 0.00 0.00 179.01 181.00 1sx4 h MET 389 N -0.75 -0.35 -0.12 1.92 4.05 -1.25 0.25 114.93 118.70 1sx4 h MET 389 Ca -0.22 0.02 0.03 0.00 -0.28 0.00 0.00 59.70 59.25 1sx4 h MET 389 Cb 1.38 0.08 -0.06 0.00 -0.80 0.00 0.00 31.60 32.19 1sx4 h MET 389 CO -0.05 -0.23 -0.51 0.87 0.23 0.00 0.00 176.91 177.22 1sx4 h LYS 390 N -0.36 -0.55 0.43 0.39 1.57 -1.60 0.28 116.57 116.72 1sx4 h LYS 390 Ca 0.12 0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.91 1sx4 h LYS 390 Cb 0.55 0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.99 1sx4 h LYS 390 CO -0.41 -0.37 -0.20 1.49 -0.57 0.00 0.00 179.45 179.39 1sx4 h GLU 391 N -0.58 -0.55 -0.87 3.15 4.57 -1.54 -2.12 114.58 116.64 1sx4 h GLU 391 Ca 0.04 0.04 0.16 0.00 -1.18 0.00 0.00 59.36 58.42 1sx4 h GLU 391 Cb 0.68 0.13 -0.10 0.00 -0.16 0.00 0.00 28.75 29.29 1sx4 h GLU 391 CO -0.42 -0.31 0.44 -0.22 -1.18 0.00 0.00 179.01 177.32 1sx4 h LYS 392 N -0.67 0.58 -0.05 1.92 1.63 -0.76 -1.59 116.57 117.63 1sx4 h LYS 392 Ca -0.06 -0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 59.70 1sx4 h LYS 392 Cb 0.49 -0.13 -0.00 0.00 -0.60 0.00 0.00 32.23 31.99 1sx4 h LYS 392 CO 0.10 0.38 0.02 -0.22 -3.45 0.00 0.00 179.45 176.27 1sx4 h LYS 393 N 0.59 0.07 -0.57 1.90 3.64 -0.25 -2.10 116.57 119.85 1sx4 h LYS 393 Ca 0.49 -0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.96 1sx4 h LYS 393 Cb 0.75 -0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.47 1sx4 h LYS 393 CO -0.39 0.24 0.09 0.00 -2.27 0.00 0.00 179.45 177.11 1sx4 h ALA 394 N 0.83 0.64 0.28 5.00 0.00 -0.88 0.01 119.26 125.13 1sx4 h ALA 394 Ca 0.02 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1sx4 h ALA 394 Cb 0.19 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1sx4 h ALA 394 CO -0.00 -0.33 -0.13 0.00 0.00 0.00 0.00 179.25 178.79 1sx4 h ARG 395 N 0.22 -0.36 -0.43 0.00 3.08 -0.93 0.14 114.38 116.11 1sx4 h ARG 395 Ca 0.30 0.02 0.09 0.00 0.07 0.00 0.00 59.98 60.46 1sx4 h ARG 395 Cb 0.44 0.08 -0.09 0.00 0.08 0.00 0.00 29.97 30.48 1sx4 h ARG 395 CO -0.41 -0.18 -0.24 0.28 -1.07 0.00 0.00 179.97 178.35 1sx4 h VAL 396 N -0.46 0.34 -0.49 2.04 2.07 -0.86 0.16 116.25 119.05 1sx4 h VAL 396 Ca -0.04 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.57 1sx4 h VAL 396 Cb 0.34 0.34 -0.10 0.00 -1.52 0.00 0.00 31.29 30.35 1sx4 h VAL 396 CO 0.06 0.00 -0.39 -0.33 0.02 0.00 0.00 177.57 176.93 1sx4 h GLU 397 N -0.16 -0.25 -0.88 1.57 4.39 -0.83 0.28 114.58 118.71 1sx4 h GLU 397 Ca 0.20 0.02 0.22 0.00 0.34 0.00 0.00 59.36 60.14 1sx4 h GLU 397 Cb 0.48 0.06 -0.13 0.00 -0.10 0.00 0.00 28.75 29.05 1sx4 h GLU 397 CO -0.53 -0.16 0.32 0.22 -1.16 0.00 0.00 179.01 177.70 1sx4 h ASP 398 N -0.25 0.18 0.38 1.42 3.58 0.92 -1.63 116.42 121.00 1sx4 h ASP 398 Ca 0.17 0.17 -0.32 0.00 0.42 0.00 0.00 57.03 57.48 1sx4 h ASP 398 Cb 0.56 0.19 -0.01 0.00 1.72 0.00 0.00 39.33 41.80 1sx4 h ASP 398 CO -0.62 -0.07 -1.61 0.00 -2.88 0.00 0.00 179.24 174.06 1sx4 h ALA 399 N 1.73 0.27 -0.92 -0.78 0.00 0.23 -2.56 119.26 117.24 1sx4 h ALA 399 Ca 0.55 -1.14 0.26 0.00 0.00 0.00 0.00 54.91 54.58 1sx4 h ALA 399 Cb 1.07 0.35 -0.15 0.00 0.00 0.00 0.00 17.79 19.06 1sx4 h ALA 399 CO -0.58 1.14 0.26 1.25 0.00 0.00 0.00 179.25 181.31 1sx4 h LEU 400 N 0.07 -0.01 -0.03 0.00 7.12 -0.12 -0.42 115.31 121.92 1sx4 h LEU 400 Ca -0.28 0.22 -0.01 0.00 0.13 0.00 0.00 57.88 57.94 1sx4 h LEU 400 Cb 2.04 0.29 -0.00 0.00 -0.53 0.00 0.00 40.66 42.46 1sx4 h LEU 400 CO 0.16 -0.21 -0.02 0.45 -0.13 0.00 0.00 178.44 178.68 1sx4 h HIS 401 N 0.17 0.09 -0.57 1.25 3.86 -1.11 -2.75 115.15 116.08 1sx4 h HIS 401 Ca 0.60 -0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.78 1sx4 h HIS 401 Cb 1.28 -0.02 -0.03 0.00 1.06 0.00 0.00 27.41 29.71 1sx4 h HIS 401 CO -0.26 0.50 0.34 0.00 0.86 0.00 0.00 177.93 179.37 1sx4 h ALA 402 N 0.57 0.73 -0.25 2.45 0.00 -0.88 -1.76 119.26 120.11 1sx4 h ALA 402 Ca 0.01 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.88 1sx4 h ALA 402 Cb 0.48 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1sx4 h ALA 402 CO 0.01 0.21 0.04 1.79 0.00 0.00 0.00 179.25 181.30 1sx4 h THR 403 N 0.77 0.87 -0.50 0.00 1.35 -1.16 0.46 112.91 114.70 1sx4 h THR 403 Ca 0.20 -0.05 0.14 0.00 -0.55 0.00 0.00 66.41 66.16 1sx4 h THR 403 Cb -0.00 0.73 -0.02 0.00 -1.73 0.00 0.00 68.15 67.12 1sx4 h THR 403 CO -0.04 0.02 0.48 0.03 -0.25 0.00 0.00 175.52 175.77 1sx4 h ARG 404 N 0.13 0.00 0.17 4.72 2.47 -1.07 -0.69 114.38 120.11 1sx4 h ARG 404 Ca 0.12 0.00 -0.28 0.00 -1.26 0.00 0.00 59.98 58.55 1sx4 h ARG 404 Cb 0.13 0.00 0.02 0.00 -1.65 0.00 0.00 29.97 28.46 1sx4 h ARG 404 CO -0.16 0.00 -1.34 0.00 0.56 0.00 0.00 179.97 179.03 1sx4 h ALA 405 N 1.51 0.01 -0.73 0.04 0.00 -0.04 -3.09 119.26 116.96 1sx4 h ALA 405 Ca 0.24 -0.93 0.15 0.00 0.00 0.00 0.00 54.91 54.37 1sx4 h ALA 405 Cb 1.19 0.29 -0.11 0.00 0.00 0.00 0.00 17.79 19.17 1sx4 h ALA 405 CO -0.00 0.71 0.19 0.00 0.00 0.00 0.00 179.25 180.14 1sx4 h ALA 406 N 0.07 0.95 -0.05 0.00 0.00 0.12 0.71 119.26 121.06 1sx4 h ALA 406 Ca -0.26 0.16 -0.16 0.00 0.00 0.00 0.00 54.91 54.65 1sx4 h ALA 406 Cb 1.90 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.89 1sx4 h ALA 406 CO 0.16 -0.32 -0.68 0.28 0.00 0.00 0.00 179.25 178.69 1sx4 h VAL 407 N 0.29 1.42 0.00 0.00 2.07 -1.26 0.83 116.25 119.60 1sx4 h VAL 407 Ca 0.41 -2.16 0.00 0.00 0.82 0.00 0.00 66.70 65.77 1sx4 h VAL 407 Cb 0.68 2.13 0.00 0.00 -1.52 0.00 0.00 31.29 32.58 1sx4 h VAL 407 CO -0.49 0.63 -0.95 -1.84 0.02 0.00 0.00 177.57 174.95 1sx4 n GLU 408 N -3.81 0.23 0.00 1.57 0.28 -0.92 -4.63 120.64 113.36 1sx4 n GLU 408 Ca -0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.97 1sx4 n GLU 408 Cb 0.67 -1.58 0.00 0.00 1.43 0.00 0.00 31.44 31.96 1sx4 n GLU 408 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 1sx4 n GLU 409 N -1.88 0.02 0.00 3.44 2.13 0.20 -5.06 120.64 119.49 1sx4 n GLU 409 Ca 0.03 -0.01 0.00 0.00 0.66 0.00 0.00 57.16 57.84 1sx4 n GLU 409 Cb 0.42 -0.38 0.00 0.00 0.27 0.00 0.00 31.44 31.74 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 0.00 -2.32 3.17 8.31 0.00 0.28 -4.38 105.19 110.26 1sx4 n GLY 410 Ca 0.00 -1.82 -0.14 0.00 0.00 0.00 0.00 46.02 44.07 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 -0.28 0.88 0.29 1.61 -7.23 -0.64 0.28 120.40 115.31 1sx4 s VAL 411 Ca 0.00 -1.63 0.04 0.00 -1.81 0.00 0.00 61.98 58.58 1sx4 s VAL 411 Cb 0.00 -1.34 -0.03 0.00 0.56 0.00 0.00 36.38 35.57 1sx4 s VAL 411 CO 0.00 -0.58 0.21 0.68 -0.31 0.00 0.00 175.10 175.10 1sx4 s VAL 412 N -2.50 0.09 -0.06 1.32 -7.23 -0.69 -2.33 120.40 109.00 1sx4 s VAL 412 Ca 0.05 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.92 1sx4 s VAL 412 Cb -0.02 -2.49 -0.03 0.00 0.56 0.00 0.00 36.38 34.39 1sx4 s VAL 412 CO -0.01 0.00 1.10 0.00 -0.31 0.00 0.00 175.10 175.88 1sx4 s ALA 413 N -3.65 3.41 1.00 1.32 0.00 -1.26 -1.93 121.76 120.64 1sx4 s ALA 413 Ca 0.39 0.54 0.00 0.00 0.00 0.00 0.00 51.96 52.89 1sx4 s ALA 413 Cb 0.04 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.70 1sx4 s ALA 413 CO 0.21 -0.60 0.00 0.41 0.00 0.00 0.00 175.76 175.78 1sx4 n GLY 414 N 3.19 -1.82 2.30 0.00 0.00 -0.78 -1.45 105.19 106.62 1sx4 n GLY 414 Ca 0.09 -1.55 -0.02 0.00 0.00 0.00 0.00 46.02 44.54 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 3.65 0.53 2.32 -0.02 0.00 -1.26 -1.19 105.19 109.22 1sx4 n GLY 415 Ca 0.00 -0.23 -0.16 0.00 0.00 0.00 0.00 46.02 45.63 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 -1.76 0.01 0.16 -0.02 0.00 -1.26 -4.05 105.19 98.27 1sx4 n GLY 416 Ca -0.02 -0.24 -0.16 0.00 0.00 0.00 0.00 46.02 45.60 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 1.39 -0.18 1.61 3.04 -1.17 -2.76 116.25 118.17 1sx4 h VAL 417 Ca -0.36 -1.80 0.05 0.00 -1.01 0.00 0.00 66.70 63.58 1sx4 h VAL 417 Cb 1.24 2.24 -0.07 0.00 -2.01 0.00 0.00 31.29 32.69 1sx4 h VAL 417 CO 0.44 0.53 -0.30 0.00 -1.01 0.00 0.00 177.57 177.24 1sx4 h ALA 418 N 0.46 -0.30 -0.67 3.17 0.00 -1.49 0.87 119.26 121.30 1sx4 h ALA 418 Ca -0.03 0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.00 1sx4 h ALA 418 Cb 1.10 0.59 -0.06 0.00 0.00 0.00 0.00 17.79 19.42 1sx4 h ALA 418 CO 0.09 -0.76 0.34 -0.07 0.00 0.00 0.00 179.25 178.85 1sx4 h LEU 419 N -0.35 0.46 -1.31 0.00 4.07 -1.84 0.96 115.31 117.30 1sx4 h LEU 419 Ca 0.11 0.05 -0.04 0.00 0.08 0.00 0.00 57.88 58.08 1sx4 h LEU 419 Cb 0.52 -0.03 -0.02 0.00 1.08 0.00 0.00 40.66 42.22 1sx4 h LEU 419 CO -0.38 0.28 0.02 -0.29 -1.08 0.00 0.00 178.44 176.99 1sx4 h ILE 420 N 0.60 1.18 -0.06 1.22 2.10 -0.84 -1.38 117.51 120.34 1sx4 h ILE 420 Ca 0.32 -0.69 -0.02 0.00 1.08 0.00 0.00 64.86 65.56 1sx4 h ILE 420 Cb 0.30 0.91 -0.00 0.00 -1.09 0.00 0.00 36.82 36.94 1sx4 h ILE 420 CO -0.24 0.24 -0.03 0.03 -1.08 0.00 0.00 178.15 177.07 1sx4 h ARG 421 N 0.47 0.12 0.00 2.19 2.47 -0.07 -2.91 114.38 116.65 1sx4 h ARG 421 Ca 0.11 -0.05 -0.02 0.00 -1.26 0.00 0.00 59.98 58.75 1sx4 h ARG 421 Cb 0.27 -0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.59 1sx4 h ARG 421 CO 0.01 0.51 -0.10 -0.39 0.56 0.00 0.00 179.97 180.55 1sx4 h VAL 422 N -0.27 0.47 -0.69 2.04 -1.51 -0.38 0.45 116.25 116.35 1sx4 h VAL 422 Ca 0.01 -0.50 -0.03 0.00 -1.23 0.00 0.00 66.70 64.95 1sx4 h VAL 422 Cb 0.47 1.34 -0.03 0.00 -2.13 0.00 0.00 31.29 30.94 1sx4 h VAL 422 CO 0.01 0.10 0.30 0.00 -1.23 0.00 0.00 177.57 176.75 1sx4 h ALA 423 N 1.90 1.24 0.00 5.19 0.00 -1.22 -2.54 119.26 123.83 1sx4 h ALA 423 Ca -0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 1sx4 h ALA 423 Cb 0.33 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1sx4 h ALA 423 CO 0.01 0.57 -0.17 0.66 0.00 0.00 0.00 179.25 180.32 1sx4 h SER 424 N 0.98 0.00 0.12 0.00 4.64 -0.72 -2.85 113.55 115.72 1sx4 h SER 424 Ca 0.24 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.50 1sx4 h SER 424 Cb 0.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.23 1sx4 h SER 424 CO -0.03 0.17 -0.19 0.11 -0.87 0.00 0.00 176.83 176.02 1sx4 h LYS 425 N 0.00 0.15 -0.42 4.77 1.57 -1.20 -3.07 116.57 118.37 1sx4 h LYS 425 Ca -0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1sx4 h LYS 425 Cb 1.06 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.35 1sx4 h LYS 425 CO 0.02 0.34 0.00 1.28 -0.57 0.00 0.00 179.45 180.52 1sx4 n LEU 426 N -4.25 2.78 0.27 2.94 4.77 -0.97 -4.40 117.00 118.13 1sx4 n LEU 426 Ca -0.01 -1.30 0.08 0.00 -0.03 0.00 0.00 56.01 54.75 1sx4 n LEU 426 Cb 0.29 -0.28 0.41 0.00 -2.33 0.00 0.00 43.42 41.51 1sx4 n LEU 426 CO 0.38 0.65 0.97 0.00 -1.33 0.00 0.00 177.39 178.05 1sx4 h ALA 427 N 4.14 1.48 -0.21 -1.18 0.00 -1.41 0.13 119.26 122.21 1sx4 h ALA 427 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1sx4 h ALA 427 Cb 0.74 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1sx4 h ALA 427 CO 0.00 -0.48 0.00 -0.25 0.00 0.00 0.00 179.25 178.52 1sx4 n ASP 428 N -2.45 2.56 -4.77 0.00 8.00 -1.26 -5.02 116.55 113.61 1sx4 n ASP 428 Ca -0.01 -1.76 -0.41 0.00 0.71 0.00 0.00 54.79 53.32 1sx4 n ASP 428 Cb 0.56 -0.13 -0.02 0.00 -0.02 0.00 0.00 41.12 41.50 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 -1.03 4.44 0.10 0.64 2.96 0.47 -5.02 118.68 121.24 1sx4 s LEU 429 Ca 0.21 2.61 -0.02 0.00 -0.22 0.00 0.00 54.13 56.71 1sx4 s LEU 429 Cb 0.12 -3.64 -0.04 0.00 0.50 0.00 0.00 46.19 43.13 1sx4 s LEU 429 CO 0.17 -0.48 0.05 -0.13 -1.32 0.00 0.00 176.35 174.64 1sx4 s ARG 430 N -1.60 0.84 0.00 1.98 1.81 -1.26 -4.99 118.95 115.72 1sx4 s ARG 430 Ca 0.49 -1.32 0.00 0.00 -1.72 0.00 0.00 55.73 53.18 1sx4 s ARG 430 Cb -0.38 0.25 0.00 0.00 -0.45 0.00 0.00 34.95 34.36 1sx4 s ARG 430 CO 0.50 -0.22 0.00 0.41 -0.68 0.00 0.00 175.30 175.31 1sx4 n GLY 431 N -0.03 5.66 0.17 -3.53 0.00 -1.26 -5.02 105.19 101.17 1sx4 n GLY 431 Ca -0.09 -2.12 0.13 0.00 0.00 0.00 0.00 46.02 43.93 1sx4 n GLY 431 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1sx4 h GLN 432 N 0.00 0.00 -2.27 1.61 4.20 -1.99 -3.47 115.11 113.19 1sx4 h GLN 432 Ca 0.00 0.00 0.13 0.00 0.06 0.00 0.00 58.65 58.84 1sx4 h GLN 432 Cb 0.00 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 27.64 1sx4 h GLN 432 CO 0.00 0.00 0.50 0.54 -0.67 0.00 0.00 178.83 179.20 1sx4 s ASN 433 N -4.26 -0.32 0.22 1.46 4.22 -1.26 -5.04 114.94 109.96 1sx4 s ASN 433 Ca -0.01 -0.08 -0.08 0.00 -2.14 0.00 0.00 52.86 50.55 1sx4 s ASN 433 Cb 0.08 0.40 0.19 0.00 1.28 0.00 0.00 41.25 43.20 1sx4 s ASN 433 CO 0.29 -0.66 1.88 -0.08 -2.04 0.00 0.00 177.10 176.48 1sx4 h GLU 434 N 2.00 1.15 -0.21 3.55 4.57 -2.00 -0.36 114.58 123.28 1sx4 h GLU 434 Ca -0.22 -0.09 0.05 0.00 -1.18 0.00 0.00 59.36 57.92 1sx4 h GLU 434 Cb 1.24 -0.25 -0.06 0.00 -0.16 0.00 0.00 28.75 29.52 1sx4 h GLU 434 CO 0.30 0.79 -0.17 -0.44 -1.18 0.00 0.00 179.01 178.31 1sx4 h ASP 435 N 1.17 -0.54 -0.70 1.04 3.32 -1.97 0.17 116.42 118.92 1sx4 h ASP 435 Ca 0.31 0.11 0.19 0.00 0.02 0.00 0.00 57.03 57.66 1sx4 h ASP 435 Cb -0.08 0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.71 1sx4 h ASP 435 CO -0.06 -0.21 0.50 1.56 -1.72 0.00 0.00 179.24 179.31 1sx4 h GLN 436 N -0.17 0.07 -0.33 3.56 4.20 -1.24 0.22 115.11 121.42 1sx4 h GLN 436 Ca 0.13 -0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.74 1sx4 h GLN 436 Cb 0.36 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 1sx4 h GLN 436 CO -0.32 0.04 -0.13 -0.91 -0.67 0.00 0.00 178.83 176.85 1sx4 h ASN 437 N 0.07 0.69 -0.63 1.46 2.35 -0.23 0.36 115.58 119.65 1sx4 h ASN 437 Ca 0.34 -0.39 -0.04 0.00 -0.55 0.00 0.00 56.30 55.66 1sx4 h ASN 437 Cb 1.24 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 39.40 1sx4 h ASN 437 CO -0.03 0.93 0.25 0.58 -1.65 0.00 0.00 177.43 177.50 1sx4 h VAL 438 N 0.44 1.23 -0.59 2.81 2.07 0.45 -1.72 116.25 120.95 1sx4 h VAL 438 Ca 0.08 -0.74 0.08 0.00 0.82 0.00 0.00 66.70 66.93 1sx4 h VAL 438 Cb 0.66 0.55 -0.06 0.00 -1.52 0.00 0.00 31.29 30.91 1sx4 h VAL 438 CO 0.04 0.29 0.25 1.23 0.02 0.00 0.00 177.57 179.41 1sx4 h GLY 439 N 0.88 0.83 0.95 2.17 0.00 -0.14 0.26 103.07 108.01 1sx4 h GLY 439 Ca 0.21 -0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.38 1sx4 h GLY 439 CO -0.02 0.04 -0.13 -2.22 0.00 0.00 0.00 176.54 174.21 1sx4 h ILE 440 N 0.47 0.73 -0.06 2.60 2.04 0.01 -2.49 117.51 120.81 1sx4 h ILE 440 Ca 0.28 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.14 1sx4 h ILE 440 Cb 0.29 0.73 -0.00 0.00 -0.74 0.00 0.00 36.82 37.10 1sx4 h ILE 440 CO -0.25 0.00 0.04 0.11 0.00 0.00 0.00 178.15 178.05 1sx4 h LYS 441 N -0.33 0.08 -0.01 2.37 6.56 -0.70 0.21 116.57 124.76 1sx4 h LYS 441 Ca -0.02 -0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.56 1sx4 h LYS 441 Cb 0.27 -0.02 -0.00 0.00 -0.57 0.00 0.00 32.23 31.91 1sx4 h LYS 441 CO 0.03 0.05 0.00 0.28 -2.06 0.00 0.00 179.45 177.75 1sx4 h VAL 442 N 0.08 1.01 -0.05 0.50 2.07 -0.05 -0.35 116.25 119.45 1sx4 h VAL 442 Ca 0.02 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1sx4 h VAL 442 Cb -0.01 1.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.78 1sx4 h VAL 442 CO -0.00 0.01 0.01 0.00 0.02 0.00 0.00 177.57 177.60 1sx4 h ALA 443 N 0.99 0.07 -0.74 1.67 0.00 -0.79 -2.45 119.26 118.01 1sx4 h ALA 443 Ca 0.00 -0.14 0.15 0.00 0.00 0.00 0.00 54.91 54.93 1sx4 h ALA 443 Cb 0.01 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 17.68 1sx4 h ALA 443 CO -0.00 -0.30 0.23 -0.07 0.00 0.00 0.00 179.25 179.11 1sx4 h LEU 444 N -0.16 0.12 -0.42 0.00 3.38 -1.29 0.71 115.31 117.66 1sx4 h LEU 444 Ca 0.02 0.13 0.03 0.00 0.09 0.00 0.00 57.88 58.14 1sx4 h LEU 444 Cb 0.27 0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 1sx4 h LEU 444 CO 0.00 0.01 0.22 -0.09 0.09 0.00 0.00 178.44 178.68 1sx4 h ARG 445 N 0.33 0.44 0.00 1.13 2.43 -0.85 0.43 114.38 118.29 1sx4 h ARG 445 Ca 0.42 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.54 1sx4 h ARG 445 Cb 0.69 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.14 1sx4 h ARG 445 CO -0.47 0.29 -0.08 0.00 -1.51 0.00 0.00 179.97 178.20 1sx4 h ALA 446 N 1.20 1.22 0.00 2.80 0.00 -0.65 -2.25 119.26 121.58 1sx4 h ALA 446 Ca 0.17 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1sx4 h ALA 446 Cb 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1sx4 h ALA 446 CO -0.10 0.10 0.00 0.52 0.00 0.00 0.00 179.25 179.77 1sx4 h MET 447 N 0.00 0.00 0.00 0.00 2.86 0.13 0.43 114.93 118.35 1sx4 h MET 447 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1sx4 h MET 447 Cb 0.30 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.96 1sx4 h MET 447 CO 0.01 0.00 0.00 0.39 1.06 0.00 0.00 176.91 178.37 1sx4 n GLU 448 N -2.36 0.05 0.18 1.72 1.02 -0.85 -3.99 120.64 116.41 1sx4 n GLU 448 Ca -0.01 0.05 -0.14 0.00 -0.02 0.00 0.00 57.16 57.04 1sx4 n GLU 448 Cb 0.09 -1.56 -0.08 0.00 -0.02 0.00 0.00 31.44 29.87 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 2.90 -0.44 -0.99 0.62 0.00 -0.30 -2.08 119.26 118.96 1sx4 h ALA 449 Ca 0.00 -0.15 0.14 0.00 0.00 0.00 0.00 54.91 54.91 1sx4 h ALA 449 Cb 0.53 0.17 -0.09 0.00 0.00 0.00 0.00 17.79 18.41 1sx4 h ALA 449 CO 0.00 -0.66 0.62 -1.35 0.00 0.00 0.00 179.25 177.86 1sx4 h PRO 450 N -0.61 0.86 -0.31 0.00 0.11 -1.79 0.15 132.00 130.41 1sx4 h PRO 450 Ca -0.05 -0.05 -0.15 0.00 0.11 0.00 0.00 66.00 65.86 1sx4 h PRO 450 Cb 0.44 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 31.36 1sx4 h PRO 450 CO 0.07 0.57 -0.39 1.25 -0.21 0.00 0.00 178.00 179.30 1sx4 h LEU 451 N 0.89 0.87 -1.18 2.35 6.46 -1.67 -1.76 115.31 121.27 1sx4 h LEU 451 Ca 0.52 -0.49 -0.07 0.00 -0.12 0.00 0.00 57.88 57.71 1sx4 h LEU 451 Cb 0.64 -0.25 -0.01 0.00 -0.73 0.00 0.00 40.66 40.31 1sx4 h LEU 451 CO -0.29 1.19 -0.17 0.03 -0.62 0.00 0.00 178.44 178.58 1sx4 h ARG 452 N 0.58 0.36 -0.20 1.25 3.08 -0.10 -0.05 114.38 119.30 1sx4 h ARG 452 Ca 0.04 -0.10 -0.12 0.00 0.07 0.00 0.00 59.98 59.86 1sx4 h ARG 452 Cb 0.98 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.98 1sx4 h ARG 452 CO 0.09 0.53 -0.39 1.96 -1.07 0.00 0.00 179.97 181.09 1sx4 h GLN 453 N 0.34 0.45 -0.43 0.04 1.08 -0.82 -2.53 115.11 113.23 1sx4 h GLN 453 Ca 0.06 -0.22 -0.08 0.00 -1.45 0.00 0.00 58.65 56.96 1sx4 h GLN 453 Cb 0.50 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.91 1sx4 h GLN 453 CO 0.03 0.78 -0.05 0.82 -0.95 0.00 0.00 178.83 179.45 1sx4 h ILE 454 N 0.38 1.27 -0.44 2.54 2.04 -0.29 -0.75 117.51 122.26 1sx4 h ILE 454 Ca 0.04 -1.13 -0.12 0.00 1.00 0.00 0.00 64.86 64.64 1sx4 h ILE 454 Cb 0.86 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 38.05 1sx4 h ILE 454 CO 0.07 0.38 -0.22 0.58 0.00 0.00 0.00 178.15 178.97 1sx4 h VAL 455 N 0.63 1.27 0.00 1.67 2.07 -1.06 -2.90 116.25 117.93 1sx4 h VAL 455 Ca 0.12 -1.36 -0.06 0.00 0.82 0.00 0.00 66.70 66.22 1sx4 h VAL 455 Cb 0.57 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 1sx4 h VAL 455 CO 0.03 0.46 -0.27 0.25 0.02 0.00 0.00 177.57 178.07 1sx4 h LEU 456 N 0.77 0.00 0.00 2.57 5.85 -0.84 -2.19 115.31 121.46 1sx4 h LEU 456 Ca 0.10 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1sx4 h LEU 456 Cb 0.76 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.79 1sx4 h LEU 456 CO 0.06 0.27 -0.01 0.59 -0.34 0.00 0.00 178.44 179.01 1sx4 n ASN 457 N -4.21 0.69 -0.66 1.25 5.03 -0.38 -0.76 115.26 116.22 1sx4 n ASN 457 Ca -0.02 0.56 0.13 0.00 0.87 0.00 0.00 54.58 56.11 1sx4 n ASN 457 Cb 0.32 -0.74 0.25 0.00 -1.02 0.00 0.00 39.78 38.59 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 1.30 0.08 0.71 0.00 0.00 0.06 -5.01 105.19 102.33 1sx4 n GLY 459 Ca 0.15 -0.28 -0.06 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.44 1.65 -3.31 1.61 1.02 -1.07 -5.03 120.64 113.07 1sx4 n GLU 460 Ca -0.17 -0.70 -0.44 0.00 -0.02 0.00 0.00 57.16 55.83 1sx4 n GLU 460 Cb 0.60 0.16 -0.07 0.00 -0.02 0.00 0.00 31.44 32.11 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 3.03 0.33 3.49 2.02 -1.26 -3.95 118.70 119.98 1sx4 s GLU 461 Ca 0.02 -1.19 0.12 0.00 0.02 0.00 0.00 54.97 53.93 1sx4 s GLU 461 Cb -0.00 -4.12 1.01 0.00 0.10 0.00 0.00 34.13 31.12 1sx4 s GLU 461 CO 0.01 -1.08 1.66 -1.35 0.02 0.00 0.00 175.26 174.51 1sx4 h PRO 462 N 8.83 0.28 0.00 0.39 0.11 -1.86 -1.28 132.00 138.47 1sx4 h PRO 462 Ca -0.28 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1sx4 h PRO 462 Cb 1.11 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1sx4 h PRO 462 CO 0.90 0.18 -0.53 -1.13 -0.21 0.00 0.00 178.00 177.21 1sx4 n SER 463 N -5.10 0.70 -0.07 -2.05 3.41 -1.26 -0.80 113.62 108.45 1sx4 n SER 463 Ca 0.30 0.17 -0.11 0.00 -0.26 0.00 0.00 58.87 58.97 1sx4 n SER 463 Cb 0.93 0.03 -0.10 0.00 -0.26 0.00 0.00 64.21 64.81 1sx4 n SER 463 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1sx4 h VAL 464 N 0.00 1.35 0.39 -3.33 2.07 -1.66 -2.50 116.25 112.56 1sx4 h VAL 464 Ca 0.00 -2.02 -0.00 0.00 0.82 0.00 0.00 66.70 65.50 1sx4 h VAL 464 Cb 0.73 2.56 -0.03 0.00 -1.52 0.00 0.00 31.29 33.03 1sx4 h VAL 464 CO 0.00 0.46 -0.48 0.58 0.02 0.00 0.00 177.57 178.15 1sx4 h VAL 465 N -1.00 0.06 -0.62 2.57 2.07 -1.45 -2.07 116.25 115.81 1sx4 h VAL 465 Ca -0.00 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.65 1sx4 h VAL 465 Cb 0.76 0.06 -0.11 0.00 -1.52 0.00 0.00 31.29 30.48 1sx4 h VAL 465 CO -0.00 0.00 -0.11 0.00 0.02 0.00 0.00 177.57 177.48 1sx4 h ALA 466 N -0.65 0.48 -0.51 1.67 0.00 -1.12 -0.33 119.26 118.79 1sx4 h ALA 466 Ca -0.04 0.23 0.10 0.00 0.00 0.00 0.00 54.91 55.20 1sx4 h ALA 466 Cb 0.81 0.43 -0.08 0.00 0.00 0.00 0.00 17.79 18.95 1sx4 h ALA 466 CO -0.12 -0.42 0.04 -0.91 0.00 0.00 0.00 179.25 177.84 1sx4 h ASN 467 N 0.03 -0.14 0.17 0.00 4.21 -1.23 0.98 115.58 119.61 1sx4 h ASN 467 Ca 0.31 0.11 -0.14 0.00 1.21 0.00 0.00 56.30 57.79 1sx4 h ASN 467 Cb 0.49 0.18 -0.01 0.00 -1.12 0.00 0.00 38.32 37.86 1sx4 h ASN 467 CO -0.61 -0.04 -0.53 0.71 -1.29 0.00 0.00 177.43 175.67 1sx4 h THR 468 N 0.16 1.34 -0.61 2.81 1.35 -0.76 -0.85 112.91 116.35 1sx4 h THR 468 Ca 0.26 -1.79 -0.07 0.00 -0.55 0.00 0.00 66.41 64.27 1sx4 h THR 468 Cb 0.39 1.81 -0.03 0.00 -1.73 0.00 0.00 68.15 68.59 1sx4 h THR 468 CO -0.40 0.54 0.12 0.58 -0.25 0.00 0.00 175.52 176.11 1sx4 h VAL 469 N 0.30 1.25 -0.67 6.82 2.07 -0.42 -2.29 116.25 123.30 1sx4 h VAL 469 Ca 0.01 -0.95 -0.05 0.00 0.82 0.00 0.00 66.70 66.53 1sx4 h VAL 469 Cb 1.03 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 1sx4 h VAL 469 CO 0.09 0.35 0.24 0.11 0.02 0.00 0.00 177.57 178.38 1sx4 h LYS 470 N 0.93 1.01 0.00 1.57 1.57 0.13 -2.33 116.57 119.45 1sx4 h LYS 470 Ca 0.19 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1sx4 h LYS 470 Cb 0.38 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.53 1sx4 h LYS 470 CO 0.01 0.85 0.00 0.41 -0.57 0.00 0.00 179.45 180.14 1sx4 n GLY 471 N -0.90 -0.99 0.00 3.86 0.00 -0.35 -4.72 105.19 102.09 1sx4 n GLY 471 Ca 0.06 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.54 1.55 3.36 -0.02 0.00 -0.88 -5.08 105.19 103.57 1sx4 n GLY 472 Ca 0.01 -1.72 -0.15 0.00 0.00 0.00 0.00 46.02 44.16 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 -1.00 -0.39 1.15 1.61 -0.00 -1.26 -5.03 116.67 111.74 1sx4 s ASP 473 Ca 0.00 0.39 0.00 0.00 -0.00 0.00 0.00 52.55 52.94 1sx4 s ASP 473 Cb 0.00 0.45 0.00 0.00 -0.00 0.00 0.00 42.92 43.37 1sx4 s ASP 473 CO 0.00 -0.49 0.00 0.61 -0.00 0.00 0.00 175.17 175.29 1sx4 n GLY 474 N 1.23 1.27 0.61 0.21 0.00 -1.26 -1.89 105.19 105.36 1sx4 n GLY 474 Ca -0.20 0.53 0.05 0.00 0.00 0.00 0.00 46.02 46.40 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 8.52 2.20 -4.74 1.61 5.03 -1.26 -4.93 115.26 121.69 1sx4 n ASN 475 Ca 0.00 -3.60 -0.41 0.00 0.87 0.00 0.00 54.58 51.43 1sx4 n ASN 475 Cb 0.00 -0.53 -0.03 0.00 -1.02 0.00 0.00 39.78 38.20 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 -3.12 3.40 0.28 3.10 5.04 -0.79 -0.90 117.35 124.35 1sx4 s TYR 476 Ca 0.38 1.42 -0.09 0.00 -2.44 0.00 0.00 57.07 56.34 1sx4 s TYR 476 Cb 0.35 -3.45 0.04 0.00 0.35 0.00 0.00 41.96 39.24 1sx4 s TYR 476 CO -0.02 -1.27 0.53 0.41 -1.34 0.00 0.00 175.55 173.86 1sx4 n GLY 477 N 2.08 1.49 3.62 8.97 0.00 0.14 -4.77 105.19 116.71 1sx4 n GLY 477 Ca 0.04 -1.26 -0.34 0.00 0.00 0.00 0.00 46.02 44.45 1sx4 n GLY 477 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1sx4 s TYR 478 N -3.95 3.20 -0.55 1.61 5.04 -1.26 -1.19 117.35 120.25 1sx4 s TYR 478 Ca 0.13 0.01 -0.18 0.00 -2.44 0.00 0.00 57.07 54.60 1sx4 s TYR 478 Cb -0.03 -2.00 0.09 0.00 0.35 0.00 0.00 41.96 40.37 1sx4 s TYR 478 CO 0.10 0.17 0.61 1.21 -1.34 0.00 0.00 175.55 176.30 1sx4 s ASN 479 N 0.14 6.19 0.45 4.32 3.84 0.46 -4.87 114.94 125.47 1sx4 s ASN 479 Ca 0.03 -1.36 0.15 0.00 0.21 0.00 0.00 52.86 51.89 1sx4 s ASN 479 Cb -0.13 -2.27 1.02 0.00 -0.55 0.00 0.00 41.25 39.32 1sx4 s ASN 479 CO 0.01 -0.95 1.99 0.00 -2.79 0.00 0.00 177.10 175.36 1sx4 h ALA 480 N 9.03 1.65 -0.09 1.71 0.00 -1.95 0.24 119.26 129.86 1sx4 h ALA 480 Ca -0.29 -0.17 -0.21 0.00 0.00 0.00 0.00 54.91 54.24 1sx4 h ALA 480 Cb 1.09 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1sx4 h ALA 480 CO 1.03 0.24 -0.81 0.00 0.00 0.00 0.00 179.25 179.70 1sx4 h ALA 481 N 1.81 0.42 -0.48 0.00 0.00 -1.95 -3.23 119.26 115.83 1sx4 h ALA 481 Ca -0.00 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1sx4 h ALA 481 Cb 0.34 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1sx4 h ALA 481 CO 0.02 0.74 0.00 0.25 0.00 0.00 0.00 179.25 180.26 1sx4 n THR 482 N -3.86 1.51 -2.78 0.00 -2.24 -0.96 -4.93 114.28 101.02 1sx4 n THR 482 Ca -0.06 -1.23 -0.15 0.00 -2.27 0.00 0.00 64.05 60.34 1sx4 n THR 482 Cb 0.76 0.24 -0.03 0.00 -2.10 0.00 0.00 70.33 69.20 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 0.67 -1.66 -4.26 -0.78 0.28 0.79 -4.96 120.64 110.72 1sx4 n GLU 483 Ca 0.20 0.05 -0.19 0.00 -0.16 0.00 0.00 57.16 57.06 1sx4 n GLU 483 Cb 0.69 -3.32 -0.11 0.00 1.43 0.00 0.00 31.44 30.12 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 -4.51 1.08 0.49 3.44 -1.05 -0.97 -4.91 118.70 112.27 1sx4 s GLU 484 Ca 0.29 -1.28 -0.19 0.00 -0.15 0.00 0.00 54.97 53.64 1sx4 s GLU 484 Cb -0.17 -0.99 -0.08 0.00 -0.44 0.00 0.00 34.13 32.45 1sx4 s GLU 484 CO 0.35 0.19 1.00 0.71 0.95 0.00 0.00 175.26 178.46 1sx4 s TYR 485 N -2.16 3.25 -0.96 4.83 1.51 -1.26 -0.40 117.35 122.15 1sx4 s TYR 485 Ca 0.11 1.54 0.00 0.00 -1.01 0.00 0.00 57.07 57.71 1sx4 s TYR 485 Cb -0.05 -2.90 0.00 0.00 -0.11 0.00 0.00 41.96 38.90 1sx4 s TYR 485 CO 0.04 -0.49 0.00 0.41 -1.11 0.00 0.00 175.55 174.40 1sx4 n GLY 486 N -0.92 -1.09 3.62 0.71 0.00 -0.33 -4.86 105.19 102.32 1sx4 n GLY 486 Ca 0.08 -0.83 -0.43 0.00 0.00 0.00 0.00 46.02 44.83 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 6.79 0.26 1.61 3.84 -1.26 0.25 114.94 122.43 1sx4 s ASN 487 Ca 0.00 0.81 -0.04 0.00 0.21 0.00 0.00 52.86 53.84 1sx4 s ASN 487 Cb 0.00 -2.50 0.31 0.00 -0.55 0.00 0.00 41.25 38.51 1sx4 s ASN 487 CO 0.00 -0.85 1.82 0.24 -2.79 0.00 0.00 177.10 175.52 1sx4 h MET 488 N 8.28 1.01 -0.46 0.43 2.86 -1.34 -1.87 114.93 123.83 1sx4 h MET 488 Ca -0.22 -0.18 -0.12 0.00 -2.06 0.00 0.00 59.70 57.13 1sx4 h MET 488 Cb 1.07 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.55 1sx4 h MET 488 CO 1.00 0.83 -0.17 0.82 1.06 0.00 0.00 176.91 180.46 1sx4 h ILE 489 N 0.99 1.27 -0.55 -1.22 1.08 -1.82 -2.10 117.51 115.17 1sx4 h ILE 489 Ca 0.23 -1.31 -0.01 0.00 -0.39 0.00 0.00 64.86 63.38 1sx4 h ILE 489 Cb 0.21 1.14 -0.03 0.00 -3.07 0.00 0.00 36.82 35.08 1sx4 h ILE 489 CO -0.02 0.45 0.30 0.44 -0.69 0.00 0.00 178.15 178.64 1sx4 h ASP 490 N 0.78 0.66 -0.02 1.72 3.32 -1.87 -0.69 116.42 120.32 1sx4 h ASP 490 Ca 0.11 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1sx4 h ASP 490 Cb 0.73 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.11 1sx4 h ASP 490 CO 0.06 0.53 0.00 0.23 -1.72 0.00 0.00 179.24 178.34 1sx4 n MET 491 N -4.40 1.04 -2.20 3.56 2.81 -0.73 -4.89 117.12 112.31 1sx4 n MET 491 Ca 0.05 -0.07 -0.18 0.00 -1.81 0.00 0.00 57.70 55.69 1sx4 n MET 491 Cb 0.09 -1.09 -0.03 0.00 -0.71 0.00 0.00 33.22 31.49 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 0.60 0.05 3.21 3.03 0.00 -0.26 -4.94 105.19 106.87 1sx4 n GLY 492 Ca 0.04 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.44 4.85 -3.98 -0.61 5.41 -0.80 -4.85 119.36 115.93 1sx4 n ILE 493 Ca -0.21 -5.54 -0.35 0.00 1.00 0.00 0.00 62.75 57.65 1sx4 n ILE 493 Cb 0.65 -2.38 -0.10 0.00 -0.71 0.00 0.00 39.64 37.10 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 -1.70 3.80 0.07 1.39 1.43 -1.26 -1.87 118.68 120.53 1sx4 s LEU 494 Ca 0.32 0.06 -0.18 0.00 -1.03 0.00 0.00 54.13 53.31 1sx4 s LEU 494 Cb -0.04 -1.96 -0.07 0.00 0.03 0.00 0.00 46.19 44.15 1sx4 s LEU 494 CO -0.00 0.16 0.53 -1.81 0.23 0.00 0.00 176.35 175.46 1sx4 s ASP 495 N 0.47 6.97 0.16 2.29 1.01 -0.81 -4.66 116.67 122.09 1sx4 s ASP 495 Ca 0.03 1.17 -0.30 0.00 0.71 0.00 0.00 52.55 54.16 1sx4 s ASP 495 Cb -0.13 -2.33 -0.08 0.00 1.01 0.00 0.00 42.92 41.40 1sx4 s ASP 495 CO 0.01 0.26 1.22 -2.84 0.21 0.00 0.00 175.17 174.03 1sx4 s PRO 496 N -1.24 4.46 0.11 8.23 0.02 -1.26 -1.70 135.00 143.61 1sx4 s PRO 496 Ca 0.29 1.89 -0.30 0.00 0.02 0.00 0.00 61.00 62.90 1sx4 s PRO 496 Cb -0.18 -3.26 -0.10 0.00 0.02 0.00 0.00 34.50 30.98 1sx4 s PRO 496 CO 0.18 -0.16 1.61 1.15 -0.33 0.00 0.00 177.00 179.45 1sx4 h THR 497 N 3.94 0.29 -1.66 0.99 2.02 0.38 -0.99 112.91 117.88 1sx4 h THR 497 Ca -0.44 0.00 0.48 0.00 0.77 0.00 0.00 66.41 67.22 1sx4 h THR 497 Cb 1.21 0.29 -0.07 0.00 -1.74 0.00 0.00 68.15 67.85 1sx4 h THR 497 CO 0.77 0.00 1.28 0.50 0.37 0.00 0.00 175.52 178.44 1sx4 h LYS 498 N -0.62 0.00 0.21 6.66 3.64 -1.77 0.17 116.57 124.86 1sx4 h LYS 498 Ca 0.01 0.00 -0.32 0.00 -1.27 0.00 0.00 60.65 59.07 1sx4 h LYS 498 Cb 0.61 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.46 1sx4 h LYS 498 CO -0.15 0.00 -1.51 -0.39 -2.27 0.00 0.00 179.45 175.13 1sx4 h VAL 499 N 0.00 1.15 -0.82 2.00 -1.51 -1.55 -2.61 116.25 112.91 1sx4 h VAL 499 Ca 0.79 -2.59 0.06 0.00 -1.23 0.00 0.00 66.70 63.73 1sx4 h VAL 499 Cb 3.33 2.93 -0.05 0.00 -2.13 0.00 0.00 31.29 35.37 1sx4 h VAL 499 CO -0.01 0.81 0.54 0.74 -1.23 0.00 0.00 177.57 178.42 1sx4 h THR 500 N 0.04 1.06 -0.12 7.19 2.02 -0.31 -1.76 112.91 121.02 1sx4 h THR 500 Ca -0.28 -0.31 -0.23 0.00 0.77 0.00 0.00 66.41 66.35 1sx4 h THR 500 Cb 2.06 0.06 0.01 0.00 -1.74 0.00 0.00 68.15 68.55 1sx4 h THR 500 CO 0.21 0.17 -0.82 -0.09 0.37 0.00 0.00 175.52 175.35 1sx4 h ARG 501 N 0.91 0.77 -0.10 6.66 1.12 -0.98 -2.49 114.38 120.27 1sx4 h ARG 501 Ca 0.35 -0.67 -0.03 0.00 -1.11 0.00 0.00 59.98 58.52 1sx4 h ARG 501 Cb 0.20 0.15 -0.00 0.00 -0.01 0.00 0.00 29.97 30.31 1sx4 h ARG 501 CO -0.12 1.27 -0.06 0.77 -3.11 0.00 0.00 179.97 178.72 1sx4 h SER 502 N 0.50 0.23 -0.93 -3.80 0.02 -1.11 -0.24 113.55 108.21 1sx4 h SER 502 Ca -0.07 -0.43 0.08 0.00 -0.84 0.00 0.00 61.79 60.53 1sx4 h SER 502 Cb 1.46 -0.06 -0.11 0.00 0.14 0.00 0.00 62.40 63.82 1sx4 h SER 502 CO 0.17 0.61 -0.57 0.00 -1.14 0.00 0.00 176.83 175.90 1sx4 h ALA 503 N 0.62 -0.55 -0.01 3.77 0.00 -1.41 -1.32 119.26 120.35 1sx4 h ALA 503 Ca 0.02 0.11 0.03 0.00 0.00 0.00 0.00 54.91 55.07 1sx4 h ALA 503 Cb 0.53 1.35 -0.05 0.00 0.00 0.00 0.00 17.79 19.62 1sx4 h ALA 503 CO 0.02 -0.95 -0.37 1.25 0.00 0.00 0.00 179.25 179.19 1sx4 h LEU 504 N -0.03 -1.13 0.24 0.00 6.46 -1.08 -2.39 115.31 117.38 1sx4 h LEU 504 Ca 0.15 0.14 -0.00 0.00 -0.12 0.00 0.00 57.88 58.05 1sx4 h LEU 504 Cb 0.41 0.45 -0.03 0.00 -0.73 0.00 0.00 40.66 40.76 1sx4 h LEU 504 CO -0.89 -0.42 -0.41 1.56 -0.62 0.00 0.00 178.44 177.65 1sx4 h GLN 505 N -0.52 -0.67 -0.88 1.25 4.20 -0.78 -0.49 115.11 117.23 1sx4 h GLN 505 Ca 0.06 0.05 0.07 0.00 0.06 0.00 0.00 58.65 58.88 1sx4 h GLN 505 Cb 0.61 0.15 -0.06 0.00 0.30 0.00 0.00 27.48 28.48 1sx4 h GLN 505 CO -0.30 -0.45 0.54 1.88 -0.67 0.00 0.00 178.83 179.83 1sx4 h TYR 506 N -0.69 1.00 -0.08 2.96 0.05 -1.32 0.12 116.97 119.01 1sx4 h TYR 506 Ca -0.03 0.03 -0.06 0.00 0.05 0.00 0.00 58.73 58.73 1sx4 h TYR 506 Cb 0.65 -0.32 0.00 0.00 1.01 0.00 0.00 36.73 38.06 1sx4 h TYR 506 CO -0.32 0.50 -0.17 0.00 -1.05 0.00 0.00 178.16 177.12 1sx4 h ALA 507 N 1.42 0.13 -0.34 3.88 0.00 -1.22 -2.41 119.26 120.72 1sx4 h ALA 507 Ca 0.39 -0.36 0.06 0.00 0.00 0.00 0.00 54.91 55.00 1sx4 h ALA 507 Cb 0.19 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 1sx4 h ALA 507 CO -0.18 0.05 -0.00 0.00 0.00 0.00 0.00 179.25 179.12 1sx4 h ALA 508 N 0.49 0.30 -0.73 0.00 0.00 -0.94 -0.22 119.26 118.16 1sx4 h ALA 508 Ca 0.00 0.10 0.16 0.00 0.00 0.00 0.00 54.91 55.17 1sx4 h ALA 508 Cb 0.76 0.16 -0.13 0.00 0.00 0.00 0.00 17.79 18.59 1sx4 h ALA 508 CO 0.04 -0.40 0.01 1.03 0.00 0.00 0.00 179.25 179.93 1sx4 h SER 509 N 0.09 -0.32 0.00 0.00 0.87 -0.56 0.82 113.55 114.45 1sx4 h SER 509 Ca 0.16 0.18 -0.00 0.00 -1.23 0.00 0.00 61.79 60.90 1sx4 h SER 509 Cb 0.22 0.32 -0.00 0.00 -0.44 0.00 0.00 62.40 62.51 1sx4 h SER 509 CO -0.27 -0.16 -0.09 -0.37 -0.53 0.00 0.00 176.83 175.41 1sx4 h VAL 510 N 0.11 0.12 -0.96 2.23 -1.51 -1.37 -3.32 116.25 111.56 1sx4 h VAL 510 Ca 0.39 -1.10 0.31 0.00 -1.23 0.00 0.00 66.70 65.07 1sx4 h VAL 510 Cb 0.68 0.24 -0.17 0.00 -2.13 0.00 0.00 31.29 29.92 1sx4 h VAL 510 CO -0.63 0.04 0.29 0.00 -1.23 0.00 0.00 177.57 176.04 1sx4 h ALA 511 N -0.93 1.56 -0.51 5.19 0.00 -0.93 0.31 119.26 123.95 1sx4 h ALA 511 Ca -0.00 0.27 0.08 0.00 0.00 0.00 0.00 54.91 55.25 1sx4 h ALA 511 Cb 0.15 0.39 -0.10 0.00 0.00 0.00 0.00 17.79 18.23 1sx4 h ALA 511 CO -0.00 -0.64 -0.44 0.78 0.00 0.00 0.00 179.25 178.94 1sx4 h GLY 512 N 0.11 -0.55 0.98 0.00 0.00 0.50 -2.40 103.07 101.71 1sx4 h GLY 512 Ca 0.67 0.57 -0.01 0.00 0.00 0.00 0.00 47.33 48.57 1sx4 h GLY 512 CO -0.76 -0.16 -0.06 1.41 0.00 0.00 0.00 176.54 176.97 1sx4 h LEU 513 N -0.27 -0.14 -1.27 3.11 3.38 -0.55 -2.93 115.31 116.63 1sx4 h LEU 513 Ca 0.16 -0.02 0.39 0.00 0.09 0.00 0.00 57.88 58.50 1sx4 h LEU 513 Cb 0.57 0.04 -0.13 0.00 0.09 0.00 0.00 40.66 41.22 1sx4 h LEU 513 CO -0.64 -0.08 0.74 0.24 0.09 0.00 0.00 178.44 178.79 1sx4 h MET 514 N -0.19 0.16 -0.01 1.13 2.86 -0.94 0.25 114.93 118.20 1sx4 h MET 514 Ca -0.02 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1sx4 h MET 514 Cb 0.15 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.77 1sx4 h MET 514 CO 0.03 0.10 -0.02 0.44 1.06 0.00 0.00 176.91 178.53 1sx4 n ILE 515 N -4.82 0.00 -0.49 -1.22 -5.35 -0.92 -2.53 119.36 104.03 1sx4 n ILE 515 Ca 0.35 -0.11 0.08 0.00 -0.27 0.00 0.00 62.75 62.80 1sx4 n ILE 515 Cb 1.26 -0.06 0.24 0.00 -1.74 0.00 0.00 39.64 39.34 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 -0.54 1.49 -1.69 7.28 -2.24 0.89 -4.85 114.28 114.62 1sx4 n THR 516 Ca 0.21 -1.25 -0.44 0.00 -2.27 0.00 0.00 64.05 60.30 1sx4 n THR 516 Cb 0.23 0.24 -0.04 0.00 -2.10 0.00 0.00 70.33 68.66 1sx4 n THR 516 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1sx4 n THR 517 N 0.54 0.12 0.00 4.28 -1.04 -1.05 -4.91 114.28 112.21 1sx4 n THR 517 Ca 0.18 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 62.17 1sx4 n THR 517 Cb 0.66 -1.87 0.00 0.00 -1.82 0.00 0.00 70.33 67.31 1sx4 n THR 517 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1sx4 n GLU 518 N 4.34 2.05 -4.11 -2.82 4.07 -1.26 -4.83 120.64 118.08 1sx4 n GLU 518 Ca 0.17 0.00 -0.14 0.00 -0.06 0.00 0.00 57.16 57.13 1sx4 n GLU 518 Cb 0.33 -0.82 -0.11 0.00 -0.06 0.00 0.00 31.44 30.77 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 -2.01 0.11 0.01 0.00 -1.94 0.36 -4.98 119.30 110.85 1sx4 s MET 520 Ca -0.04 0.39 0.08 0.00 -1.71 0.00 0.00 55.69 54.40 1sx4 s MET 520 Cb -0.07 -0.17 -0.02 0.00 2.01 0.00 0.00 34.83 36.58 1sx4 s MET 520 CO 0.00 -0.16 -0.23 0.08 -0.01 0.00 0.00 175.02 174.70 1sx4 s VAL 521 N 1.17 1.84 -0.00 -6.03 1.01 -1.26 0.03 120.40 117.15 1sx4 s VAL 521 Ca -0.09 -1.12 -0.07 0.00 0.00 0.00 0.00 61.98 60.70 1sx4 s VAL 521 Cb -0.11 -1.55 0.02 0.00 0.00 0.00 0.00 36.38 34.74 1sx4 s VAL 521 CO -0.06 0.40 0.31 1.07 0.00 0.00 0.00 175.10 176.81 1sx4 n THR 522 N 2.18 0.00 -2.78 3.92 5.66 -1.15 -5.01 114.28 117.10 1sx4 n THR 522 Ca -0.16 -0.04 -0.24 0.00 -3.05 0.00 0.00 64.05 60.56 1sx4 n THR 522 Cb 0.52 0.14 0.02 0.00 -1.55 0.00 0.00 70.33 69.46 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 -1.68 5.70 0.35 1.09 1.11 -1.26 -1.07 116.67 120.90 1sx4 s ASP 523 Ca 0.07 0.37 -0.27 0.00 0.18 0.00 0.00 52.55 52.90 1sx4 s ASP 523 Cb -0.00 -1.51 -0.09 0.00 1.07 0.00 0.00 42.92 42.39 1sx4 s ASP 523 CO -0.00 -0.85 1.16 -0.76 1.18 0.00 0.00 175.17 175.89 1sx4 s LEU 524 N -4.70 4.35 0.00 1.23 1.43 -1.17 -4.37 118.68 115.46 1sx4 s LEU 524 Ca 0.51 2.35 0.00 0.00 -1.03 0.00 0.00 54.13 55.96 1sx4 s LEU 524 Cb -0.10 -3.84 0.00 0.00 0.03 0.00 0.00 46.19 42.28 1sx4 s LEU 524 CO 0.40 -0.46 0.44 -0.81 0.23 0.00 0.00 176.35 176.15